USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 896 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: B 201 ASN : amide:sc= 0.0673 X(o=0.14,f=-0.16) USER MOD Set 1.2: B 203 GLN : amide:sc= 0.0692 X(o=0.14,f=-0.16) USER MOD Single : A 1 GLU N :NH3+ -172:sc= 0 (180deg=-0.0413) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0724 K(o=-0.072,f=-1.5!) USER MOD Single : A 9 ASN : amide:sc= 0.776 K(o=0.78,f=0) USER MOD Single : A 12 SER OG : rot -22:sc= 0.0156 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.0159) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 82:sc= 1.2 USER MOD Single : A 24 HIS : no HD1:sc= -1.15 X(o=-1.1,f=-0.87) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HE2:sc= 0.284 K(o=0.28,f=-1.1) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -0.405 X(o=-0.4,f=-0.0038) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 MET CE :methyl -174:sc= -3.79! (180deg=-4.12!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.136 X(o=-0.14,f=-0.023) USER MOD Single : A 69 GLN : amide:sc= 0.552 K(o=0.55,f=-9.6!) USER MOD Single : A 74 SER OG : rot 71:sc= 0.205 USER MOD Single : A 78 GLN : amide:sc= 0.407 X(o=0.41,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0136) USER MOD Single : B 200 MET CE :methyl -127:sc= -0.576 (180deg=-2.41!) USER MOD Single : B 204 MET CE :methyl 173:sc= -0.788 (180deg=-0.936) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD Single : B 221 HIS : no HD1:sc= -0.894 K(o=-0.89,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 32.964 55.579 40.122 1.00 0.00 N ATOM 2 CA GLU A 1 32.526 55.306 38.735 1.00 0.00 C ATOM 3 C GLU A 1 32.301 53.846 38.540 1.00 0.00 C ATOM 4 O GLU A 1 31.164 53.378 38.546 1.00 0.00 O ATOM 5 CB GLU A 1 33.539 55.863 37.720 1.00 0.00 C ATOM 6 CG GLU A 1 33.465 57.386 37.588 1.00 0.00 C ATOM 7 CD GLU A 1 34.563 57.992 36.727 1.00 0.00 C ATOM 8 OE1 GLU A 1 35.325 57.257 36.041 1.00 0.00 O ATOM 9 OE2 GLU A 1 34.671 59.247 36.738 1.00 0.00 O ATOM 0 H1 GLU A 1 32.986 56.606 40.283 1.00 0.00 H new ATOM 0 H2 GLU A 1 32.299 55.138 40.789 1.00 0.00 H new ATOM 0 H3 GLU A 1 33.915 55.185 40.270 1.00 0.00 H new ATOM 0 HA GLU A 1 31.579 55.817 38.562 1.00 0.00 H new ATOM 0 HB2 GLU A 1 34.546 55.577 38.023 1.00 0.00 H new ATOM 0 HB3 GLU A 1 33.359 55.409 36.746 1.00 0.00 H new ATOM 0 HG2 GLU A 1 32.497 57.656 37.166 1.00 0.00 H new ATOM 0 HG3 GLU A 1 33.513 57.828 38.583 1.00 0.00 H new ATOM 18 N SER A 2 33.373 53.046 38.400 1.00 0.00 N ATOM 19 CA SER A 2 33.253 51.621 38.407 1.00 0.00 C ATOM 20 C SER A 2 34.559 50.991 38.754 1.00 0.00 C ATOM 21 O SER A 2 35.607 51.383 38.244 1.00 0.00 O ATOM 22 CB SER A 2 32.742 51.014 37.090 1.00 0.00 C ATOM 23 OG SER A 2 33.443 51.503 35.956 1.00 0.00 O ATOM 0 H SER A 2 34.327 53.388 38.281 1.00 0.00 H new ATOM 0 HA SER A 2 32.498 51.406 39.163 1.00 0.00 H new ATOM 0 HB2 SER A 2 32.839 49.929 37.132 1.00 0.00 H new ATOM 0 HB3 SER A 2 31.680 51.235 36.980 1.00 0.00 H new ATOM 0 HG SER A 2 33.083 51.087 35.145 1.00 0.00 H new ATOM 29 N ASP A 3 34.551 49.989 39.651 1.00 0.00 N ATOM 30 CA ASP A 3 35.687 49.163 39.920 1.00 0.00 C ATOM 31 C ASP A 3 35.674 47.968 39.031 1.00 0.00 C ATOM 32 O ASP A 3 36.676 47.630 38.403 1.00 0.00 O ATOM 33 CB ASP A 3 35.722 48.787 41.411 1.00 0.00 C ATOM 34 CG ASP A 3 37.053 48.164 41.811 1.00 0.00 C ATOM 35 OD1 ASP A 3 38.105 48.852 41.722 1.00 0.00 O ATOM 36 OD2 ASP A 3 37.054 46.981 42.244 1.00 0.00 O ATOM 0 H ASP A 3 33.730 49.746 40.206 1.00 0.00 H new ATOM 0 HA ASP A 3 36.603 49.713 39.704 1.00 0.00 H new ATOM 0 HB2 ASP A 3 35.543 49.677 42.014 1.00 0.00 H new ATOM 0 HB3 ASP A 3 34.915 48.088 41.628 1.00 0.00 H new ATOM 41 N SER A 4 34.517 47.287 38.931 1.00 0.00 N ATOM 42 CA SER A 4 34.276 46.162 38.082 1.00 0.00 C ATOM 43 C SER A 4 35.032 44.951 38.512 1.00 0.00 C ATOM 44 O SER A 4 35.928 44.432 37.849 1.00 0.00 O ATOM 45 CB SER A 4 34.408 46.451 36.578 1.00 0.00 C ATOM 46 OG SER A 4 33.527 47.486 36.167 1.00 0.00 O ATOM 0 H SER A 4 33.696 47.541 39.481 1.00 0.00 H new ATOM 0 HA SER A 4 33.218 45.936 38.216 1.00 0.00 H new ATOM 0 HB2 SER A 4 35.435 46.735 36.350 1.00 0.00 H new ATOM 0 HB3 SER A 4 34.195 45.544 36.012 1.00 0.00 H new ATOM 0 HG SER A 4 33.637 47.647 35.207 1.00 0.00 H new ATOM 52 N VAL A 5 34.616 44.461 39.692 1.00 0.00 N ATOM 53 CA VAL A 5 35.152 43.383 40.464 1.00 0.00 C ATOM 54 C VAL A 5 34.946 42.080 39.771 1.00 0.00 C ATOM 55 O VAL A 5 35.868 41.300 39.538 1.00 0.00 O ATOM 56 CB VAL A 5 34.496 43.348 41.812 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.023 42.178 42.659 1.00 0.00 C ATOM 58 CG2 VAL A 5 34.778 44.680 42.529 1.00 0.00 C ATOM 0 H VAL A 5 33.807 44.872 40.158 1.00 0.00 H new ATOM 0 HA VAL A 5 36.223 43.545 40.583 1.00 0.00 H new ATOM 0 HB VAL A 5 33.423 43.205 41.681 1.00 0.00 H new ATOM 0 HG11 VAL A 5 34.528 42.180 43.630 1.00 0.00 H new ATOM 0 HG12 VAL A 5 34.817 41.237 42.149 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.098 42.286 42.800 1.00 0.00 H new ATOM 0 HG21 VAL A 5 34.307 44.671 43.512 1.00 0.00 H new ATOM 0 HG22 VAL A 5 35.854 44.811 42.643 1.00 0.00 H new ATOM 0 HG23 VAL A 5 34.373 45.503 41.940 1.00 0.00 H new ATOM 68 N GLU A 6 33.696 41.804 39.357 1.00 0.00 N ATOM 69 CA GLU A 6 33.334 40.613 38.655 1.00 0.00 C ATOM 70 C GLU A 6 33.967 40.498 37.311 1.00 0.00 C ATOM 71 O GLU A 6 34.241 39.403 36.823 1.00 0.00 O ATOM 72 CB GLU A 6 31.802 40.535 38.528 1.00 0.00 C ATOM 73 CG GLU A 6 31.272 41.577 37.541 1.00 0.00 C ATOM 74 CD GLU A 6 29.780 41.879 37.558 1.00 0.00 C ATOM 75 OE1 GLU A 6 28.973 41.209 38.255 1.00 0.00 O ATOM 76 OE2 GLU A 6 29.414 42.881 36.887 1.00 0.00 O ATOM 0 H GLU A 6 32.910 42.433 39.517 1.00 0.00 H new ATOM 0 HA GLU A 6 33.711 39.775 39.241 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.513 39.538 38.197 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.346 40.692 39.505 1.00 0.00 H new ATOM 0 HG2 GLU A 6 31.804 42.511 37.722 1.00 0.00 H new ATOM 0 HG3 GLU A 6 31.536 41.250 36.535 1.00 0.00 H new ATOM 83 N PHE A 7 34.316 41.649 36.710 1.00 0.00 N ATOM 84 CA PHE A 7 35.060 41.723 35.492 1.00 0.00 C ATOM 85 C PHE A 7 36.440 41.195 35.686 1.00 0.00 C ATOM 86 O PHE A 7 36.939 40.424 34.868 1.00 0.00 O ATOM 87 CB PHE A 7 35.035 43.170 34.971 1.00 0.00 C ATOM 88 CG PHE A 7 34.992 43.265 33.485 1.00 0.00 C ATOM 89 CD1 PHE A 7 36.014 42.786 32.701 1.00 0.00 C ATOM 90 CD2 PHE A 7 33.905 43.844 32.873 1.00 0.00 C ATOM 91 CE1 PHE A 7 35.934 42.839 31.329 1.00 0.00 C ATOM 92 CE2 PHE A 7 33.815 43.908 31.503 1.00 0.00 C ATOM 93 CZ PHE A 7 34.831 43.399 30.728 1.00 0.00 C ATOM 0 H PHE A 7 34.070 42.564 37.088 1.00 0.00 H new ATOM 0 HA PHE A 7 34.600 41.092 34.732 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.167 43.682 35.385 1.00 0.00 H new ATOM 0 HB3 PHE A 7 35.918 43.694 35.335 1.00 0.00 H new ATOM 0 HD1 PHE A 7 36.891 42.363 33.168 1.00 0.00 H new ATOM 0 HD2 PHE A 7 33.110 44.255 33.478 1.00 0.00 H new ATOM 0 HE1 PHE A 7 36.736 42.442 30.725 1.00 0.00 H new ATOM 0 HE2 PHE A 7 32.950 44.356 31.037 1.00 0.00 H new ATOM 0 HZ PHE A 7 34.763 43.439 29.651 1.00 0.00 H new ATOM 103 N ASN A 8 37.065 41.488 36.839 1.00 0.00 N ATOM 104 CA ASN A 8 38.395 41.110 37.204 1.00 0.00 C ATOM 105 C ASN A 8 38.463 39.668 37.574 1.00 0.00 C ATOM 106 O ASN A 8 39.512 39.037 37.449 1.00 0.00 O ATOM 107 CB ASN A 8 38.948 41.963 38.357 1.00 0.00 C ATOM 108 CG ASN A 8 39.229 43.375 37.862 1.00 0.00 C ATOM 109 OD1 ASN A 8 39.570 43.594 36.701 1.00 0.00 O ATOM 110 ND2 ASN A 8 39.096 44.387 38.760 1.00 0.00 N ATOM 0 H ASN A 8 36.605 42.030 37.571 1.00 0.00 H new ATOM 0 HA ASN A 8 39.015 41.285 36.325 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.231 41.991 39.178 1.00 0.00 H new ATOM 0 HB3 ASN A 8 39.862 41.515 38.747 1.00 0.00 H new ATOM 0 HD21 ASN A 8 39.280 45.349 38.475 1.00 0.00 H new ATOM 0 HD22 ASN A 8 38.812 44.184 39.718 1.00 0.00 H new ATOM 117 N ASN A 9 37.332 39.063 37.978 1.00 0.00 N ATOM 118 CA ASN A 9 37.228 37.651 38.180 1.00 0.00 C ATOM 119 C ASN A 9 37.179 36.911 36.887 1.00 0.00 C ATOM 120 O ASN A 9 37.655 35.781 36.787 1.00 0.00 O ATOM 121 CB ASN A 9 36.003 37.283 39.033 1.00 0.00 C ATOM 122 CG ASN A 9 36.301 37.589 40.493 1.00 0.00 C ATOM 123 OD1 ASN A 9 36.766 36.721 41.230 1.00 0.00 O ATOM 124 ND2 ASN A 9 36.072 38.854 40.939 1.00 0.00 N ATOM 0 H ASN A 9 36.467 39.569 38.169 1.00 0.00 H new ATOM 0 HA ASN A 9 38.127 37.352 38.719 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.131 37.847 38.701 1.00 0.00 H new ATOM 0 HB3 ASN A 9 35.764 36.226 38.912 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.287 39.101 41.905 1.00 0.00 H new ATOM 0 HD22 ASN A 9 35.686 39.555 40.307 1.00 0.00 H new ATOM 131 N ALA A 10 36.651 37.534 35.818 1.00 0.00 N ATOM 132 CA ALA A 10 36.772 36.995 34.499 1.00 0.00 C ATOM 133 C ALA A 10 38.178 37.060 34.010 1.00 0.00 C ATOM 134 O ALA A 10 38.695 36.076 33.481 1.00 0.00 O ATOM 135 CB ALA A 10 35.760 37.659 33.550 1.00 0.00 C ATOM 0 H ALA A 10 36.138 38.414 35.868 1.00 0.00 H new ATOM 0 HA ALA A 10 36.522 35.934 34.527 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.867 37.236 32.551 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.748 37.480 33.914 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.947 38.732 33.512 1.00 0.00 H new ATOM 141 N ILE A 11 38.890 38.178 34.238 1.00 0.00 N ATOM 142 CA ILE A 11 40.276 38.347 33.933 1.00 0.00 C ATOM 143 C ILE A 11 41.156 37.334 34.579 1.00 0.00 C ATOM 144 O ILE A 11 41.986 36.698 33.931 1.00 0.00 O ATOM 145 CB ILE A 11 40.817 39.685 34.345 1.00 0.00 C ATOM 146 CG1 ILE A 11 39.963 40.873 33.874 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.228 39.908 33.772 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.501 40.796 32.419 1.00 0.00 C ATOM 0 H ILE A 11 38.475 39.009 34.658 1.00 0.00 H new ATOM 0 HA ILE A 11 40.298 38.238 32.849 1.00 0.00 H new ATOM 0 HB ILE A 11 40.816 39.655 35.435 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.085 40.947 34.515 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.536 41.790 34.010 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.598 40.885 34.085 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.898 39.131 34.141 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.189 39.866 32.683 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.906 41.677 32.179 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.370 40.756 31.763 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.897 39.900 32.276 1.00 0.00 H new ATOM 160 N SER A 12 40.996 37.144 35.901 1.00 0.00 N ATOM 161 CA SER A 12 41.786 36.239 36.677 1.00 0.00 C ATOM 162 C SER A 12 41.680 34.816 36.249 1.00 0.00 C ATOM 163 O SER A 12 42.672 34.090 36.255 1.00 0.00 O ATOM 164 CB SER A 12 41.594 36.388 38.196 1.00 0.00 C ATOM 165 OG SER A 12 40.319 35.966 38.660 1.00 0.00 O ATOM 0 H SER A 12 40.292 37.638 36.449 1.00 0.00 H new ATOM 0 HA SER A 12 42.809 36.547 36.462 1.00 0.00 H new ATOM 0 HB2 SER A 12 42.365 35.812 38.708 1.00 0.00 H new ATOM 0 HB3 SER A 12 41.742 37.433 38.470 1.00 0.00 H new ATOM 0 HG SER A 12 39.676 35.993 37.921 1.00 0.00 H new ATOM 171 N TYR A 13 40.498 34.374 35.785 1.00 0.00 N ATOM 172 CA TYR A 13 40.304 33.083 35.201 1.00 0.00 C ATOM 173 C TYR A 13 41.036 32.920 33.914 1.00 0.00 C ATOM 174 O TYR A 13 41.784 31.958 33.746 1.00 0.00 O ATOM 175 CB TYR A 13 38.804 32.781 35.041 1.00 0.00 C ATOM 176 CG TYR A 13 38.467 31.377 34.673 1.00 0.00 C ATOM 177 CD1 TYR A 13 39.170 30.281 35.114 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.395 31.175 33.836 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.837 29.015 34.696 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.068 29.918 33.387 1.00 0.00 C ATOM 181 CZ TYR A 13 37.799 28.833 33.812 1.00 0.00 C ATOM 182 OH TYR A 13 37.535 27.552 33.280 1.00 0.00 O ATOM 0 H TYR A 13 39.647 34.935 35.817 1.00 0.00 H new ATOM 0 HA TYR A 13 40.731 32.351 35.887 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.301 33.023 35.977 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.397 33.445 34.279 1.00 0.00 H new ATOM 0 HD1 TYR A 13 39.995 30.417 35.798 1.00 0.00 H new ATOM 0 HD2 TYR A 13 36.799 32.020 33.526 1.00 0.00 H new ATOM 0 HE1 TYR A 13 39.390 28.163 35.062 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.242 29.783 32.704 1.00 0.00 H new ATOM 0 HH TYR A 13 36.767 27.602 32.673 1.00 0.00 H new ATOM 192 N VAL A 14 40.914 33.864 32.964 1.00 0.00 N ATOM 193 CA VAL A 14 41.621 33.893 31.722 1.00 0.00 C ATOM 194 C VAL A 14 43.100 33.916 31.903 1.00 0.00 C ATOM 195 O VAL A 14 43.840 33.179 31.252 1.00 0.00 O ATOM 196 CB VAL A 14 41.217 35.089 30.912 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.898 35.108 29.532 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.712 34.983 30.617 1.00 0.00 C ATOM 0 H VAL A 14 40.281 34.657 33.071 1.00 0.00 H new ATOM 0 HA VAL A 14 41.356 32.974 31.200 1.00 0.00 H new ATOM 0 HB VAL A 14 41.494 35.976 31.482 1.00 0.00 H new ATOM 0 HG11 VAL A 14 41.577 35.991 28.980 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.980 35.134 29.661 1.00 0.00 H new ATOM 0 HG13 VAL A 14 41.620 34.212 28.977 1.00 0.00 H new ATOM 0 HG21 VAL A 14 39.395 35.844 30.028 1.00 0.00 H new ATOM 0 HG22 VAL A 14 39.514 34.068 30.058 1.00 0.00 H new ATOM 0 HG23 VAL A 14 39.158 34.962 31.555 1.00 0.00 H new ATOM 208 N ASN A 15 43.603 34.735 32.844 1.00 0.00 N ATOM 209 CA ASN A 15 44.960 34.690 33.290 1.00 0.00 C ATOM 210 C ASN A 15 45.455 33.362 33.749 1.00 0.00 C ATOM 211 O ASN A 15 46.555 32.959 33.375 1.00 0.00 O ATOM 212 CB ASN A 15 45.198 35.747 34.382 1.00 0.00 C ATOM 213 CG ASN A 15 46.652 35.892 34.807 1.00 0.00 C ATOM 214 OD1 ASN A 15 47.086 35.248 35.760 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.439 36.746 34.100 1.00 0.00 N ATOM 0 H ASN A 15 43.046 35.452 33.309 1.00 0.00 H new ATOM 0 HA ASN A 15 45.545 34.909 32.397 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.839 36.711 34.022 1.00 0.00 H new ATOM 0 HB3 ASN A 15 44.600 35.490 35.256 1.00 0.00 H new ATOM 0 HD21 ASN A 15 48.419 36.866 34.356 1.00 0.00 H new ATOM 0 HD22 ASN A 15 47.049 37.266 33.314 1.00 0.00 H new ATOM 222 N LYS A 16 44.687 32.595 34.543 1.00 0.00 N ATOM 223 CA LYS A 16 45.025 31.255 34.911 1.00 0.00 C ATOM 224 C LYS A 16 45.141 30.371 33.717 1.00 0.00 C ATOM 225 O LYS A 16 46.118 29.642 33.557 1.00 0.00 O ATOM 226 CB LYS A 16 44.009 30.586 35.852 1.00 0.00 C ATOM 227 CG LYS A 16 43.984 31.145 37.275 1.00 0.00 C ATOM 228 CD LYS A 16 42.848 30.574 38.126 1.00 0.00 C ATOM 229 CE LYS A 16 43.229 29.475 39.120 1.00 0.00 C ATOM 230 NZ LYS A 16 43.664 28.221 38.465 1.00 0.00 N ATOM 0 H LYS A 16 43.805 32.916 34.941 1.00 0.00 H new ATOM 0 HA LYS A 16 45.977 31.361 35.430 1.00 0.00 H new ATOM 0 HB2 LYS A 16 43.014 30.688 35.420 1.00 0.00 H new ATOM 0 HB3 LYS A 16 44.228 29.519 35.900 1.00 0.00 H new ATOM 0 HG2 LYS A 16 44.936 30.930 37.760 1.00 0.00 H new ATOM 0 HG3 LYS A 16 43.887 32.230 37.231 1.00 0.00 H new ATOM 0 HD2 LYS A 16 42.392 31.394 38.681 1.00 0.00 H new ATOM 0 HD3 LYS A 16 42.084 30.179 37.456 1.00 0.00 H new ATOM 0 HE2 LYS A 16 44.030 29.838 39.763 1.00 0.00 H new ATOM 0 HE3 LYS A 16 42.375 29.264 39.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 43.583 27.432 39.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 43.062 28.035 37.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 44.654 28.314 38.159 1.00 0.00 H new ATOM 244 N ILE A 17 44.164 30.442 32.797 1.00 0.00 N ATOM 245 CA ILE A 17 44.110 29.716 31.566 1.00 0.00 C ATOM 246 C ILE A 17 45.258 30.012 30.664 1.00 0.00 C ATOM 247 O ILE A 17 45.874 29.092 30.126 1.00 0.00 O ATOM 248 CB ILE A 17 42.781 29.970 30.919 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.669 29.362 31.789 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.746 29.391 29.494 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.270 29.838 31.400 1.00 0.00 C ATOM 0 H ILE A 17 43.355 31.050 32.923 1.00 0.00 H new ATOM 0 HA ILE A 17 44.204 28.651 31.780 1.00 0.00 H new ATOM 0 HB ILE A 17 42.621 31.045 30.838 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.710 28.275 31.712 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.854 29.615 32.833 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.772 29.588 29.045 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.524 29.859 28.892 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.916 28.315 29.534 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.532 29.371 32.053 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.212 30.922 31.504 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.066 29.561 30.366 1.00 0.00 H new ATOM 263 N LYS A 18 45.654 31.287 30.496 1.00 0.00 N ATOM 264 CA LYS A 18 46.829 31.696 29.792 1.00 0.00 C ATOM 265 C LYS A 18 48.079 31.072 30.311 1.00 0.00 C ATOM 266 O LYS A 18 48.899 30.565 29.549 1.00 0.00 O ATOM 267 CB LYS A 18 47.073 33.213 29.872 1.00 0.00 C ATOM 268 CG LYS A 18 46.075 34.065 29.083 1.00 0.00 C ATOM 269 CD LYS A 18 46.763 34.993 28.081 1.00 0.00 C ATOM 270 CE LYS A 18 47.574 36.116 28.732 1.00 0.00 C ATOM 271 NZ LYS A 18 48.298 36.896 27.703 1.00 0.00 N ATOM 0 H LYS A 18 45.125 32.074 30.872 1.00 0.00 H new ATOM 0 HA LYS A 18 46.628 31.374 28.770 1.00 0.00 H new ATOM 0 HB2 LYS A 18 47.042 33.517 30.918 1.00 0.00 H new ATOM 0 HB3 LYS A 18 48.078 33.425 29.508 1.00 0.00 H new ATOM 0 HG2 LYS A 18 45.383 33.411 28.552 1.00 0.00 H new ATOM 0 HG3 LYS A 18 45.482 34.660 29.777 1.00 0.00 H new ATOM 0 HD2 LYS A 18 47.424 34.402 27.447 1.00 0.00 H new ATOM 0 HD3 LYS A 18 46.007 35.434 27.431 1.00 0.00 H new ATOM 0 HE2 LYS A 18 46.910 36.773 29.295 1.00 0.00 H new ATOM 0 HE3 LYS A 18 48.284 35.694 29.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 48.843 37.654 28.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 48.945 36.269 27.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 47.615 37.314 27.040 1.00 0.00 H new ATOM 285 N THR A 19 48.250 31.106 31.645 1.00 0.00 N ATOM 286 CA THR A 19 49.393 30.592 32.334 1.00 0.00 C ATOM 287 C THR A 19 49.435 29.103 32.365 1.00 0.00 C ATOM 288 O THR A 19 50.496 28.495 32.487 1.00 0.00 O ATOM 289 CB THR A 19 49.475 31.146 33.725 1.00 0.00 C ATOM 290 OG1 THR A 19 49.215 32.541 33.749 1.00 0.00 O ATOM 291 CG2 THR A 19 50.906 31.011 34.274 1.00 0.00 C ATOM 0 H THR A 19 47.557 31.512 32.274 1.00 0.00 H new ATOM 0 HA THR A 19 50.264 30.921 31.767 1.00 0.00 H new ATOM 0 HB THR A 19 48.743 30.590 34.311 1.00 0.00 H new ATOM 0 HG1 THR A 19 48.247 32.694 33.741 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.948 31.418 35.284 1.00 0.00 H new ATOM 0 HG22 THR A 19 51.190 29.959 34.294 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.595 31.561 33.633 1.00 0.00 H new ATOM 299 N ARG A 20 48.289 28.413 32.222 1.00 0.00 N ATOM 300 CA ARG A 20 48.240 26.999 32.014 1.00 0.00 C ATOM 301 C ARG A 20 48.451 26.565 30.604 1.00 0.00 C ATOM 302 O ARG A 20 49.165 25.597 30.351 1.00 0.00 O ATOM 303 CB ARG A 20 46.894 26.429 32.495 1.00 0.00 C ATOM 304 CG ARG A 20 46.746 26.413 34.017 1.00 0.00 C ATOM 305 CD ARG A 20 47.821 25.578 34.716 1.00 0.00 C ATOM 306 NE ARG A 20 47.472 25.557 36.165 1.00 0.00 N ATOM 307 CZ ARG A 20 46.720 24.578 36.746 1.00 0.00 C ATOM 308 NH1 ARG A 20 46.203 23.540 36.027 1.00 0.00 N ATOM 309 NH2 ARG A 20 46.486 24.618 38.091 1.00 0.00 N ATOM 0 H ARG A 20 47.369 28.852 32.252 1.00 0.00 H new ATOM 0 HA ARG A 20 49.074 26.608 32.597 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.084 27.019 32.066 1.00 0.00 H new ATOM 0 HB3 ARG A 20 46.783 25.413 32.117 1.00 0.00 H new ATOM 0 HG2 ARG A 20 46.789 27.436 34.391 1.00 0.00 H new ATOM 0 HG3 ARG A 20 45.763 26.020 34.276 1.00 0.00 H new ATOM 0 HD2 ARG A 20 47.850 24.567 34.310 1.00 0.00 H new ATOM 0 HD3 ARG A 20 48.809 26.012 34.562 1.00 0.00 H new ATOM 0 HE ARG A 20 47.814 26.316 36.754 1.00 0.00 H new ATOM 0 HH11 ARG A 20 46.375 23.479 35.023 1.00 0.00 H new ATOM 0 HH12 ARG A 20 45.645 22.825 36.493 1.00 0.00 H new ATOM 0 HH21 ARG A 20 46.872 25.376 38.654 1.00 0.00 H new ATOM 0 HH22 ARG A 20 45.925 23.890 38.533 1.00 0.00 H new ATOM 323 N PHE A 21 47.866 27.244 29.600 1.00 0.00 N ATOM 324 CA PHE A 21 47.985 26.874 28.224 1.00 0.00 C ATOM 325 C PHE A 21 49.226 27.391 27.581 1.00 0.00 C ATOM 326 O PHE A 21 49.254 27.855 26.443 1.00 0.00 O ATOM 327 CB PHE A 21 46.730 27.257 27.423 1.00 0.00 C ATOM 328 CG PHE A 21 45.535 26.427 27.743 1.00 0.00 C ATOM 329 CD1 PHE A 21 45.592 25.131 28.197 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.302 26.980 27.482 1.00 0.00 C ATOM 331 CE1 PHE A 21 44.446 24.391 28.378 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.147 26.263 27.685 1.00 0.00 C ATOM 333 CZ PHE A 21 43.221 24.964 28.131 1.00 0.00 C ATOM 0 H PHE A 21 47.294 28.075 29.750 1.00 0.00 H new ATOM 0 HA PHE A 21 48.070 25.787 28.212 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.495 28.304 27.613 1.00 0.00 H new ATOM 0 HB3 PHE A 21 46.948 27.168 26.359 1.00 0.00 H new ATOM 0 HD1 PHE A 21 46.552 24.686 28.415 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.241 27.993 27.112 1.00 0.00 H new ATOM 0 HE1 PHE A 21 44.509 23.366 28.712 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.186 26.718 27.495 1.00 0.00 H new ATOM 0 HZ PHE A 21 42.317 24.394 28.287 1.00 0.00 H new ATOM 343 N LEU A 22 50.360 27.177 28.271 1.00 0.00 N ATOM 344 CA LEU A 22 51.681 27.355 27.754 1.00 0.00 C ATOM 345 C LEU A 22 52.063 26.194 26.902 1.00 0.00 C ATOM 346 O LEU A 22 52.642 26.344 25.827 1.00 0.00 O ATOM 347 CB LEU A 22 52.686 27.620 28.889 1.00 0.00 C ATOM 348 CG LEU A 22 52.322 28.897 29.664 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.255 28.998 30.881 1.00 0.00 C ATOM 350 CD2 LEU A 22 52.402 30.198 28.847 1.00 0.00 C ATOM 0 H LEU A 22 50.355 26.863 29.241 1.00 0.00 H new ATOM 0 HA LEU A 22 51.699 28.239 27.117 1.00 0.00 H new ATOM 0 HB2 LEU A 22 52.702 26.769 29.571 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.690 27.716 28.475 1.00 0.00 H new ATOM 0 HG LEU A 22 51.274 28.802 29.949 1.00 0.00 H new ATOM 0 HD11 LEU A 22 53.017 29.898 31.449 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.121 28.122 31.516 1.00 0.00 H new ATOM 0 HD13 LEU A 22 54.290 29.046 30.543 1.00 0.00 H new ATOM 0 HD21 LEU A 22 52.128 31.042 29.479 1.00 0.00 H new ATOM 0 HD22 LEU A 22 53.419 30.335 28.480 1.00 0.00 H new ATOM 0 HD23 LEU A 22 51.716 30.140 28.002 1.00 0.00 H new ATOM 362 N ASP A 23 51.649 24.979 27.303 1.00 0.00 N ATOM 363 CA ASP A 23 51.776 23.812 26.485 1.00 0.00 C ATOM 364 C ASP A 23 50.825 23.780 25.339 1.00 0.00 C ATOM 365 O ASP A 23 50.991 22.997 24.405 1.00 0.00 O ATOM 366 CB ASP A 23 51.512 22.509 27.259 1.00 0.00 C ATOM 367 CG ASP A 23 52.216 22.440 28.607 1.00 0.00 C ATOM 368 OD1 ASP A 23 53.365 21.924 28.649 1.00 0.00 O ATOM 369 OD2 ASP A 23 51.566 22.816 29.618 1.00 0.00 O ATOM 0 H ASP A 23 51.219 24.803 28.211 1.00 0.00 H new ATOM 0 HA ASP A 23 52.806 23.873 26.135 1.00 0.00 H new ATOM 0 HB2 ASP A 23 50.439 22.401 27.415 1.00 0.00 H new ATOM 0 HB3 ASP A 23 51.832 21.664 26.649 1.00 0.00 H new ATOM 374 N HIS A 24 49.758 24.597 25.382 1.00 0.00 N ATOM 375 CA HIS A 24 48.631 24.470 24.511 1.00 0.00 C ATOM 376 C HIS A 24 48.232 25.740 23.841 1.00 0.00 C ATOM 377 O HIS A 24 47.115 26.193 24.086 1.00 0.00 O ATOM 378 CB HIS A 24 47.444 23.903 25.307 1.00 0.00 C ATOM 379 CG HIS A 24 47.631 22.452 25.646 1.00 0.00 C ATOM 380 ND1 HIS A 24 47.994 21.985 26.881 1.00 0.00 N ATOM 381 CD2 HIS A 24 47.590 21.376 24.816 1.00 0.00 C ATOM 382 CE1 HIS A 24 48.173 20.679 26.814 1.00 0.00 C ATOM 383 NE2 HIS A 24 47.935 20.290 25.576 1.00 0.00 N ATOM 0 H HIS A 24 49.677 25.370 26.043 1.00 0.00 H new ATOM 0 HA HIS A 24 48.929 23.793 23.710 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.318 24.476 26.226 1.00 0.00 H new ATOM 0 HB3 HIS A 24 46.529 24.024 24.727 1.00 0.00 H new ATOM 0 HD2 HIS A 24 47.336 21.377 23.766 1.00 0.00 H new ATOM 0 HE1 HIS A 24 48.465 20.038 27.633 1.00 0.00 H new ATOM 0 HE2 HIS A 24 47.998 19.330 25.238 1.00 0.00 H new ATOM 392 N PRO A 25 48.988 26.369 22.991 1.00 0.00 N ATOM 393 CA PRO A 25 48.608 27.612 22.384 1.00 0.00 C ATOM 394 C PRO A 25 47.504 27.480 21.392 1.00 0.00 C ATOM 395 O PRO A 25 46.818 28.468 21.133 1.00 0.00 O ATOM 396 CB PRO A 25 49.890 28.126 21.736 1.00 0.00 C ATOM 397 CG PRO A 25 50.699 26.856 21.420 1.00 0.00 C ATOM 398 CD PRO A 25 50.333 25.961 22.614 1.00 0.00 C ATOM 0 HA PRO A 25 48.203 28.300 23.126 1.00 0.00 H new ATOM 0 HB2 PRO A 25 49.677 28.696 20.832 1.00 0.00 H new ATOM 0 HB3 PRO A 25 50.437 28.788 22.408 1.00 0.00 H new ATOM 0 HG2 PRO A 25 50.409 26.410 20.468 1.00 0.00 H new ATOM 0 HG3 PRO A 25 51.770 27.053 21.367 1.00 0.00 H new ATOM 0 HD2 PRO A 25 50.364 24.906 22.341 1.00 0.00 H new ATOM 0 HD3 PRO A 25 51.033 26.097 23.439 1.00 0.00 H new ATOM 406 N GLU A 26 47.259 26.293 20.808 1.00 0.00 N ATOM 407 CA GLU A 26 46.195 26.044 19.887 1.00 0.00 C ATOM 408 C GLU A 26 44.837 26.189 20.483 1.00 0.00 C ATOM 409 O GLU A 26 43.903 26.677 19.848 1.00 0.00 O ATOM 410 CB GLU A 26 46.338 24.673 19.205 1.00 0.00 C ATOM 411 CG GLU A 26 46.300 23.426 20.091 1.00 0.00 C ATOM 412 CD GLU A 26 47.500 23.184 20.995 1.00 0.00 C ATOM 413 OE1 GLU A 26 48.557 23.846 20.821 1.00 0.00 O ATOM 414 OE2 GLU A 26 47.398 22.315 21.902 1.00 0.00 O ATOM 0 H GLU A 26 47.831 25.468 20.987 1.00 0.00 H new ATOM 0 HA GLU A 26 46.288 26.824 19.131 1.00 0.00 H new ATOM 0 HB2 GLU A 26 45.542 24.582 18.466 1.00 0.00 H new ATOM 0 HB3 GLU A 26 47.282 24.667 18.660 1.00 0.00 H new ATOM 0 HG2 GLU A 26 45.410 23.483 20.718 1.00 0.00 H new ATOM 0 HG3 GLU A 26 46.181 22.556 19.446 1.00 0.00 H new ATOM 421 N ILE A 27 44.695 25.825 21.770 1.00 0.00 N ATOM 422 CA ILE A 27 43.483 25.828 22.529 1.00 0.00 C ATOM 423 C ILE A 27 43.021 27.210 22.837 1.00 0.00 C ATOM 424 O ILE A 27 41.832 27.462 23.027 1.00 0.00 O ATOM 425 CB ILE A 27 43.692 25.042 23.790 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.178 23.647 23.363 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.389 24.953 24.603 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.227 22.696 24.558 1.00 0.00 C ATOM 0 H ILE A 27 45.491 25.504 22.322 1.00 0.00 H new ATOM 0 HA ILE A 27 42.700 25.363 21.931 1.00 0.00 H new ATOM 0 HB ILE A 27 44.426 25.525 24.435 1.00 0.00 H new ATOM 0 HG12 ILE A 27 43.513 23.244 22.600 1.00 0.00 H new ATOM 0 HG13 ILE A 27 45.168 23.724 22.914 1.00 0.00 H new ATOM 0 HG21 ILE A 27 42.566 24.379 25.512 1.00 0.00 H new ATOM 0 HG22 ILE A 27 42.056 25.957 24.867 1.00 0.00 H new ATOM 0 HG23 ILE A 27 41.621 24.461 24.007 1.00 0.00 H new ATOM 0 HD11 ILE A 27 44.574 21.716 24.229 1.00 0.00 H new ATOM 0 HD12 ILE A 27 44.912 23.090 25.309 1.00 0.00 H new ATOM 0 HD13 ILE A 27 43.230 22.602 24.989 1.00 0.00 H new ATOM 440 N TYR A 28 43.946 28.187 22.824 1.00 0.00 N ATOM 441 CA TYR A 28 43.653 29.570 23.040 1.00 0.00 C ATOM 442 C TYR A 28 42.741 30.139 22.008 1.00 0.00 C ATOM 443 O TYR A 28 42.031 31.116 22.243 1.00 0.00 O ATOM 444 CB TYR A 28 44.964 30.365 23.156 1.00 0.00 C ATOM 445 CG TYR A 28 44.770 31.469 24.139 1.00 0.00 C ATOM 446 CD1 TYR A 28 44.690 31.155 25.474 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.531 32.760 23.728 1.00 0.00 C ATOM 448 CE1 TYR A 28 44.307 32.107 26.388 1.00 0.00 C ATOM 449 CE2 TYR A 28 44.152 33.720 24.637 1.00 0.00 C ATOM 450 CZ TYR A 28 44.018 33.382 25.963 1.00 0.00 C ATOM 451 OH TYR A 28 43.502 34.300 26.901 1.00 0.00 O ATOM 0 H TYR A 28 44.936 28.006 22.657 1.00 0.00 H new ATOM 0 HA TYR A 28 43.108 29.653 23.980 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.775 29.711 23.478 1.00 0.00 H new ATOM 0 HB3 TYR A 28 45.247 30.770 22.184 1.00 0.00 H new ATOM 0 HD1 TYR A 28 44.929 30.156 25.807 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.642 33.021 22.686 1.00 0.00 H new ATOM 0 HE1 TYR A 28 44.233 31.855 27.436 1.00 0.00 H new ATOM 0 HE2 TYR A 28 43.961 34.732 24.312 1.00 0.00 H new ATOM 0 HH TYR A 28 43.345 35.162 26.463 1.00 0.00 H new ATOM 461 N ARG A 29 42.698 29.529 20.810 1.00 0.00 N ATOM 462 CA ARG A 29 41.666 29.740 19.842 1.00 0.00 C ATOM 463 C ARG A 29 40.420 28.977 20.128 1.00 0.00 C ATOM 464 O ARG A 29 39.331 29.548 20.156 1.00 0.00 O ATOM 465 CB ARG A 29 42.201 29.409 18.437 1.00 0.00 C ATOM 466 CG ARG A 29 43.296 30.374 17.976 1.00 0.00 C ATOM 467 CD ARG A 29 42.770 31.667 17.352 1.00 0.00 C ATOM 468 NE ARG A 29 42.422 31.371 15.934 1.00 0.00 N ATOM 469 CZ ARG A 29 43.305 31.423 14.894 1.00 0.00 C ATOM 470 NH1 ARG A 29 44.611 31.803 15.023 1.00 0.00 N ATOM 471 NH2 ARG A 29 42.889 31.019 13.659 1.00 0.00 N ATOM 0 H ARG A 29 43.408 28.864 20.504 1.00 0.00 H new ATOM 0 HA ARG A 29 41.387 30.792 19.895 1.00 0.00 H new ATOM 0 HB2 ARG A 29 42.594 28.392 18.433 1.00 0.00 H new ATOM 0 HB3 ARG A 29 41.377 29.435 17.724 1.00 0.00 H new ATOM 0 HG2 ARG A 29 43.926 30.626 18.829 1.00 0.00 H new ATOM 0 HG3 ARG A 29 43.931 29.866 17.250 1.00 0.00 H new ATOM 0 HD2 ARG A 29 41.895 32.026 17.894 1.00 0.00 H new ATOM 0 HD3 ARG A 29 43.523 32.453 17.406 1.00 0.00 H new ATOM 0 HE ARG A 29 41.458 31.112 15.726 1.00 0.00 H new ATOM 0 HH11 ARG A 29 44.977 32.069 15.937 1.00 0.00 H new ATOM 0 HH12 ARG A 29 45.220 31.821 14.205 1.00 0.00 H new ATOM 0 HH21 ARG A 29 41.934 30.686 13.526 1.00 0.00 H new ATOM 0 HH22 ARG A 29 43.533 31.050 12.869 1.00 0.00 H new ATOM 485 N SER A 30 40.506 27.653 20.350 1.00 0.00 N ATOM 486 CA SER A 30 39.398 26.750 20.329 1.00 0.00 C ATOM 487 C SER A 30 38.502 26.820 21.517 1.00 0.00 C ATOM 488 O SER A 30 37.292 26.628 21.396 1.00 0.00 O ATOM 489 CB SER A 30 39.835 25.286 20.156 1.00 0.00 C ATOM 490 OG SER A 30 40.719 25.139 19.053 1.00 0.00 O ATOM 0 H SER A 30 41.392 27.190 20.554 1.00 0.00 H new ATOM 0 HA SER A 30 38.831 27.089 19.462 1.00 0.00 H new ATOM 0 HB2 SER A 30 40.325 24.940 21.066 1.00 0.00 H new ATOM 0 HB3 SER A 30 38.957 24.657 20.008 1.00 0.00 H new ATOM 0 HG SER A 30 40.982 24.199 18.968 1.00 0.00 H new ATOM 496 N PHE A 31 39.038 27.119 22.714 1.00 0.00 N ATOM 497 CA PHE A 31 38.292 27.406 23.900 1.00 0.00 C ATOM 498 C PHE A 31 37.250 28.455 23.717 1.00 0.00 C ATOM 499 O PHE A 31 36.063 28.229 23.948 1.00 0.00 O ATOM 500 CB PHE A 31 39.322 27.770 24.982 1.00 0.00 C ATOM 501 CG PHE A 31 38.826 28.386 26.246 1.00 0.00 C ATOM 502 CD1 PHE A 31 37.655 27.997 26.852 1.00 0.00 C ATOM 503 CD2 PHE A 31 39.580 29.377 26.829 1.00 0.00 C ATOM 504 CE1 PHE A 31 37.208 28.623 27.992 1.00 0.00 C ATOM 505 CE2 PHE A 31 39.128 30.025 27.954 1.00 0.00 C ATOM 506 CZ PHE A 31 37.942 29.648 28.540 1.00 0.00 C ATOM 0 H PHE A 31 40.046 27.163 22.862 1.00 0.00 H new ATOM 0 HA PHE A 31 37.711 26.532 24.193 1.00 0.00 H new ATOM 0 HB2 PHE A 31 39.865 26.862 25.244 1.00 0.00 H new ATOM 0 HB3 PHE A 31 40.044 28.456 24.538 1.00 0.00 H new ATOM 0 HD1 PHE A 31 37.078 27.189 26.427 1.00 0.00 H new ATOM 0 HD2 PHE A 31 40.534 29.648 26.400 1.00 0.00 H new ATOM 0 HE1 PHE A 31 36.284 28.310 28.455 1.00 0.00 H new ATOM 0 HE2 PHE A 31 39.706 30.832 28.379 1.00 0.00 H new ATOM 0 HZ PHE A 31 37.589 30.155 29.426 1.00 0.00 H new ATOM 516 N LEU A 32 37.649 29.658 23.269 1.00 0.00 N ATOM 517 CA LEU A 32 36.778 30.784 23.133 1.00 0.00 C ATOM 518 C LEU A 32 35.781 30.596 22.041 1.00 0.00 C ATOM 519 O LEU A 32 34.628 31.009 22.152 1.00 0.00 O ATOM 520 CB LEU A 32 37.526 32.089 22.812 1.00 0.00 C ATOM 521 CG LEU A 32 38.936 32.209 23.417 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.738 33.170 22.525 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.920 32.626 24.897 1.00 0.00 C ATOM 0 H LEU A 32 38.611 29.854 22.992 1.00 0.00 H new ATOM 0 HA LEU A 32 36.289 30.859 24.104 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.605 32.186 21.729 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.926 32.928 23.164 1.00 0.00 H new ATOM 0 HG LEU A 32 39.419 31.232 23.430 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.746 33.280 22.924 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.790 32.769 21.513 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.247 34.143 22.505 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.943 32.694 25.267 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.433 33.596 24.996 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.372 31.884 25.478 1.00 0.00 H new ATOM 535 N GLU A 33 36.196 29.944 20.941 1.00 0.00 N ATOM 536 CA GLU A 33 35.351 29.494 19.878 1.00 0.00 C ATOM 537 C GLU A 33 34.141 28.715 20.264 1.00 0.00 C ATOM 538 O GLU A 33 33.094 28.835 19.630 1.00 0.00 O ATOM 539 CB GLU A 33 36.150 28.694 18.836 1.00 0.00 C ATOM 540 CG GLU A 33 36.974 29.567 17.886 1.00 0.00 C ATOM 541 CD GLU A 33 36.146 30.072 16.714 1.00 0.00 C ATOM 542 OE1 GLU A 33 35.904 29.282 15.763 1.00 0.00 O ATOM 543 OE2 GLU A 33 35.738 31.265 16.725 1.00 0.00 O ATOM 0 H GLU A 33 37.178 29.718 20.784 1.00 0.00 H new ATOM 0 HA GLU A 33 34.969 30.427 19.463 1.00 0.00 H new ATOM 0 HB2 GLU A 33 36.818 28.006 19.354 1.00 0.00 H new ATOM 0 HB3 GLU A 33 35.460 28.087 18.250 1.00 0.00 H new ATOM 0 HG2 GLU A 33 37.381 30.416 18.435 1.00 0.00 H new ATOM 0 HG3 GLU A 33 37.822 28.994 17.511 1.00 0.00 H new ATOM 550 N ILE A 34 34.179 27.900 21.334 1.00 0.00 N ATOM 551 CA ILE A 34 33.047 27.240 21.907 1.00 0.00 C ATOM 552 C ILE A 34 32.177 28.213 22.625 1.00 0.00 C ATOM 553 O ILE A 34 30.957 28.212 22.468 1.00 0.00 O ATOM 554 CB ILE A 34 33.495 26.112 22.788 1.00 0.00 C ATOM 555 CG1 ILE A 34 34.208 25.037 21.948 1.00 0.00 C ATOM 556 CG2 ILE A 34 32.296 25.502 23.534 1.00 0.00 C ATOM 557 CD1 ILE A 34 35.033 24.062 22.786 1.00 0.00 C ATOM 0 H ILE A 34 35.048 27.691 21.826 1.00 0.00 H new ATOM 0 HA ILE A 34 32.443 26.808 21.109 1.00 0.00 H new ATOM 0 HB ILE A 34 34.195 26.502 23.526 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.465 24.478 21.380 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.861 25.525 21.224 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.640 24.685 24.168 1.00 0.00 H new ATOM 0 HG22 ILE A 34 31.824 26.267 24.151 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.574 25.121 22.812 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.508 23.331 22.131 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.799 24.611 23.334 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.381 23.547 23.492 1.00 0.00 H new ATOM 569 N LEU A 35 32.737 29.163 23.396 1.00 0.00 N ATOM 570 CA LEU A 35 31.976 30.186 24.044 1.00 0.00 C ATOM 571 C LEU A 35 31.346 31.146 23.095 1.00 0.00 C ATOM 572 O LEU A 35 30.304 31.745 23.359 1.00 0.00 O ATOM 573 CB LEU A 35 32.898 30.944 25.014 1.00 0.00 C ATOM 574 CG LEU A 35 33.796 30.060 25.896 1.00 0.00 C ATOM 575 CD1 LEU A 35 34.180 30.834 27.167 1.00 0.00 C ATOM 576 CD2 LEU A 35 33.173 28.789 26.498 1.00 0.00 C ATOM 0 H LEU A 35 33.740 29.221 23.573 1.00 0.00 H new ATOM 0 HA LEU A 35 31.158 29.699 24.574 1.00 0.00 H new ATOM 0 HB2 LEU A 35 33.533 31.615 24.436 1.00 0.00 H new ATOM 0 HB3 LEU A 35 32.282 31.568 25.662 1.00 0.00 H new ATOM 0 HG LEU A 35 34.591 29.789 25.202 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.817 30.210 27.795 1.00 0.00 H new ATOM 0 HD12 LEU A 35 34.718 31.741 26.892 1.00 0.00 H new ATOM 0 HD13 LEU A 35 33.278 31.101 27.717 1.00 0.00 H new ATOM 0 HD21 LEU A 35 33.920 28.265 27.095 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.329 29.062 27.131 1.00 0.00 H new ATOM 0 HD23 LEU A 35 32.828 28.137 25.695 1.00 0.00 H new ATOM 588 N HIS A 36 31.930 31.321 21.896 1.00 0.00 N ATOM 589 CA HIS A 36 31.391 32.102 20.825 1.00 0.00 C ATOM 590 C HIS A 36 30.264 31.423 20.126 1.00 0.00 C ATOM 591 O HIS A 36 29.374 32.096 19.606 1.00 0.00 O ATOM 592 CB HIS A 36 32.492 32.489 19.824 1.00 0.00 C ATOM 593 CG HIS A 36 32.284 33.836 19.197 1.00 0.00 C ATOM 594 ND1 HIS A 36 31.104 34.208 18.610 1.00 0.00 N ATOM 595 CD2 HIS A 36 33.083 34.936 19.208 1.00 0.00 C ATOM 596 CE1 HIS A 36 31.170 35.485 18.279 1.00 0.00 C ATOM 597 NE2 HIS A 36 32.354 35.947 18.637 1.00 0.00 N ATOM 0 H HIS A 36 32.826 30.895 21.661 1.00 0.00 H new ATOM 0 HA HIS A 36 30.985 33.008 21.274 1.00 0.00 H new ATOM 0 HB2 HIS A 36 33.455 32.479 20.334 1.00 0.00 H new ATOM 0 HB3 HIS A 36 32.539 31.735 19.039 1.00 0.00 H new ATOM 0 HD1 HIS A 36 30.303 33.597 18.453 1.00 0.00 H new ATOM 0 HD2 HIS A 36 34.091 35.001 19.590 1.00 0.00 H new ATOM 0 HE1 HIS A 36 30.389 36.054 17.798 1.00 0.00 H new ATOM 606 N THR A 37 30.224 30.079 20.138 1.00 0.00 N ATOM 607 CA THR A 37 29.122 29.255 19.751 1.00 0.00 C ATOM 608 C THR A 37 27.917 29.528 20.584 1.00 0.00 C ATOM 609 O THR A 37 26.789 29.538 20.096 1.00 0.00 O ATOM 610 CB THR A 37 29.473 27.796 19.726 1.00 0.00 C ATOM 611 OG1 THR A 37 29.530 27.306 18.394 1.00 0.00 O ATOM 612 CG2 THR A 37 28.510 26.856 20.471 1.00 0.00 C ATOM 0 H THR A 37 31.026 29.527 20.442 1.00 0.00 H new ATOM 0 HA THR A 37 28.874 29.523 18.724 1.00 0.00 H new ATOM 0 HB THR A 37 30.435 27.777 20.238 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.762 26.354 18.405 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.865 25.829 20.385 1.00 0.00 H new ATOM 0 HG22 THR A 37 28.468 27.138 21.523 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.514 26.934 20.034 1.00 0.00 H new ATOM 620 N TYR A 38 28.108 29.831 21.881 1.00 0.00 N ATOM 621 CA TYR A 38 27.089 30.356 22.734 1.00 0.00 C ATOM 622 C TYR A 38 26.754 31.764 22.378 1.00 0.00 C ATOM 623 O TYR A 38 25.633 32.049 21.957 1.00 0.00 O ATOM 624 CB TYR A 38 27.592 30.227 24.182 1.00 0.00 C ATOM 625 CG TYR A 38 27.011 31.150 25.197 1.00 0.00 C ATOM 626 CD1 TYR A 38 25.660 31.285 25.417 1.00 0.00 C ATOM 627 CD2 TYR A 38 27.896 31.970 25.858 1.00 0.00 C ATOM 628 CE1 TYR A 38 25.200 32.265 26.264 1.00 0.00 C ATOM 629 CE2 TYR A 38 27.436 32.970 26.681 1.00 0.00 C ATOM 630 CZ TYR A 38 26.084 33.118 26.882 1.00 0.00 C ATOM 631 OH TYR A 38 25.645 34.137 27.753 1.00 0.00 O ATOM 0 H TYR A 38 29.004 29.706 22.352 1.00 0.00 H new ATOM 0 HA TYR A 38 26.162 29.795 22.614 1.00 0.00 H new ATOM 0 HB2 TYR A 38 27.407 29.205 24.512 1.00 0.00 H new ATOM 0 HB3 TYR A 38 28.673 30.370 24.177 1.00 0.00 H new ATOM 0 HD1 TYR A 38 24.963 30.623 24.926 1.00 0.00 H new ATOM 0 HD2 TYR A 38 28.959 31.827 25.729 1.00 0.00 H new ATOM 0 HE1 TYR A 38 24.140 32.365 26.445 1.00 0.00 H new ATOM 0 HE2 TYR A 38 28.133 33.636 27.167 1.00 0.00 H new ATOM 0 HH TYR A 38 26.419 34.634 28.092 1.00 0.00 H new ATOM 641 N GLN A 39 27.730 32.681 22.499 1.00 0.00 N ATOM 642 CA GLN A 39 27.526 34.089 22.642 1.00 0.00 C ATOM 643 C GLN A 39 26.945 34.773 21.453 1.00 0.00 C ATOM 644 O GLN A 39 26.325 35.831 21.558 1.00 0.00 O ATOM 645 CB GLN A 39 28.839 34.729 23.123 1.00 0.00 C ATOM 646 CG GLN A 39 28.704 35.829 24.178 1.00 0.00 C ATOM 647 CD GLN A 39 28.183 37.164 23.665 1.00 0.00 C ATOM 648 OE1 GLN A 39 27.162 37.678 24.119 1.00 0.00 O ATOM 649 NE2 GLN A 39 28.923 37.798 22.717 1.00 0.00 N ATOM 0 H GLN A 39 28.717 32.425 22.497 1.00 0.00 H new ATOM 0 HA GLN A 39 26.748 34.229 23.393 1.00 0.00 H new ATOM 0 HB2 GLN A 39 29.476 33.942 23.527 1.00 0.00 H new ATOM 0 HB3 GLN A 39 29.355 35.145 22.258 1.00 0.00 H new ATOM 0 HG2 GLN A 39 28.037 35.475 24.964 1.00 0.00 H new ATOM 0 HG3 GLN A 39 29.679 35.991 24.637 1.00 0.00 H new ATOM 0 HE21 GLN A 39 29.767 37.358 22.351 1.00 0.00 H new ATOM 0 HE22 GLN A 39 28.634 38.713 22.372 1.00 0.00 H new ATOM 658 N LYS A 40 27.039 34.146 20.267 1.00 0.00 N ATOM 659 CA LYS A 40 26.357 34.449 19.047 1.00 0.00 C ATOM 660 C LYS A 40 24.896 34.722 19.170 1.00 0.00 C ATOM 661 O LYS A 40 24.323 35.521 18.430 1.00 0.00 O ATOM 662 CB LYS A 40 26.594 33.235 18.135 1.00 0.00 C ATOM 663 CG LYS A 40 25.962 33.377 16.749 1.00 0.00 C ATOM 664 CD LYS A 40 26.299 32.228 15.796 1.00 0.00 C ATOM 665 CE LYS A 40 25.758 32.463 14.385 1.00 0.00 C ATOM 666 NZ LYS A 40 26.050 31.305 13.510 1.00 0.00 N ATOM 0 H LYS A 40 27.658 33.343 20.154 1.00 0.00 H new ATOM 0 HA LYS A 40 26.756 35.385 18.656 1.00 0.00 H new ATOM 0 HB2 LYS A 40 27.667 33.080 18.022 1.00 0.00 H new ATOM 0 HB3 LYS A 40 26.193 32.344 18.618 1.00 0.00 H new ATOM 0 HG2 LYS A 40 24.879 33.440 16.858 1.00 0.00 H new ATOM 0 HG3 LYS A 40 26.293 34.315 16.303 1.00 0.00 H new ATOM 0 HD2 LYS A 40 27.381 32.102 15.751 1.00 0.00 H new ATOM 0 HD3 LYS A 40 25.886 31.299 16.190 1.00 0.00 H new ATOM 0 HE2 LYS A 40 24.682 32.631 14.427 1.00 0.00 H new ATOM 0 HE3 LYS A 40 26.205 33.364 13.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 25.674 31.486 12.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 27.079 31.162 13.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 25.603 30.452 13.902 1.00 0.00 H new ATOM 680 N GLU A 41 24.227 34.075 20.141 1.00 0.00 N ATOM 681 CA GLU A 41 22.862 34.257 20.526 1.00 0.00 C ATOM 682 C GLU A 41 22.419 35.664 20.736 1.00 0.00 C ATOM 683 O GLU A 41 21.367 36.065 20.241 1.00 0.00 O ATOM 684 CB GLU A 41 22.534 33.373 21.741 1.00 0.00 C ATOM 685 CG GLU A 41 23.202 33.708 23.076 1.00 0.00 C ATOM 686 CD GLU A 41 22.331 34.463 24.071 1.00 0.00 C ATOM 687 OE1 GLU A 41 21.350 35.153 23.686 1.00 0.00 O ATOM 688 OE2 GLU A 41 22.647 34.375 25.287 1.00 0.00 O ATOM 0 H GLU A 41 24.685 33.360 20.706 1.00 0.00 H new ATOM 0 HA GLU A 41 22.281 33.940 19.660 1.00 0.00 H new ATOM 0 HB2 GLU A 41 21.455 33.400 21.892 1.00 0.00 H new ATOM 0 HB3 GLU A 41 22.794 32.346 21.486 1.00 0.00 H new ATOM 0 HG2 GLU A 41 23.533 32.779 23.540 1.00 0.00 H new ATOM 0 HG3 GLU A 41 24.095 34.301 22.877 1.00 0.00 H new ATOM 695 N GLN A 42 23.234 36.485 21.423 1.00 0.00 N ATOM 696 CA GLN A 42 22.915 37.843 21.735 1.00 0.00 C ATOM 697 C GLN A 42 23.218 38.762 20.602 1.00 0.00 C ATOM 698 O GLN A 42 22.555 39.777 20.391 1.00 0.00 O ATOM 699 CB GLN A 42 23.657 38.267 23.014 1.00 0.00 C ATOM 700 CG GLN A 42 23.185 39.622 23.546 1.00 0.00 C ATOM 701 CD GLN A 42 23.703 40.061 24.908 1.00 0.00 C ATOM 702 OE1 GLN A 42 23.576 41.235 25.254 1.00 0.00 O ATOM 703 NE2 GLN A 42 24.275 39.145 25.734 1.00 0.00 N ATOM 0 H GLN A 42 24.146 36.193 21.773 1.00 0.00 H new ATOM 0 HA GLN A 42 21.841 37.911 21.909 1.00 0.00 H new ATOM 0 HB2 GLN A 42 23.511 37.508 23.783 1.00 0.00 H new ATOM 0 HB3 GLN A 42 24.727 38.313 22.811 1.00 0.00 H new ATOM 0 HG2 GLN A 42 23.463 40.384 22.819 1.00 0.00 H new ATOM 0 HG3 GLN A 42 22.096 39.605 23.590 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.372 38.176 25.431 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.607 39.427 26.656 1.00 0.00 H new ATOM 712 N LEU A 43 24.240 38.426 19.795 1.00 0.00 N ATOM 713 CA LEU A 43 24.765 39.253 18.752 1.00 0.00 C ATOM 714 C LEU A 43 23.881 39.409 17.563 1.00 0.00 C ATOM 715 O LEU A 43 23.940 40.429 16.879 1.00 0.00 O ATOM 716 CB LEU A 43 26.147 38.746 18.307 1.00 0.00 C ATOM 717 CG LEU A 43 27.216 38.749 19.415 1.00 0.00 C ATOM 718 CD1 LEU A 43 28.512 38.092 18.911 1.00 0.00 C ATOM 719 CD2 LEU A 43 27.519 40.165 19.931 1.00 0.00 C ATOM 0 H LEU A 43 24.725 37.532 19.874 1.00 0.00 H new ATOM 0 HA LEU A 43 24.841 40.246 19.195 1.00 0.00 H new ATOM 0 HB2 LEU A 43 26.042 37.731 17.924 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.497 39.364 17.480 1.00 0.00 H new ATOM 0 HG LEU A 43 26.812 38.173 20.248 1.00 0.00 H new ATOM 0 HD11 LEU A 43 29.258 38.102 19.706 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.308 37.062 18.618 1.00 0.00 H new ATOM 0 HD13 LEU A 43 28.890 38.646 18.052 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.279 40.113 20.711 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.884 40.781 19.109 1.00 0.00 H new ATOM 0 HD23 LEU A 43 26.610 40.606 20.339 1.00 0.00 H new ATOM 731 N HIS A 44 22.985 38.443 17.290 1.00 0.00 N ATOM 732 CA HIS A 44 21.932 38.595 16.334 1.00 0.00 C ATOM 733 C HIS A 44 20.953 39.637 16.753 1.00 0.00 C ATOM 734 O HIS A 44 20.956 40.754 16.238 1.00 0.00 O ATOM 735 CB HIS A 44 21.195 37.273 16.055 1.00 0.00 C ATOM 736 CG HIS A 44 21.666 36.519 14.847 1.00 0.00 C ATOM 737 ND1 HIS A 44 21.109 36.740 13.616 1.00 0.00 N ATOM 738 CD2 HIS A 44 22.518 35.468 14.702 1.00 0.00 C ATOM 739 CE1 HIS A 44 21.588 35.860 12.756 1.00 0.00 C ATOM 740 NE2 HIS A 44 22.432 35.070 13.394 1.00 0.00 N ATOM 0 H HIS A 44 22.993 37.531 17.747 1.00 0.00 H new ATOM 0 HA HIS A 44 22.413 38.915 15.410 1.00 0.00 H new ATOM 0 HB2 HIS A 44 21.297 36.628 16.928 1.00 0.00 H new ATOM 0 HB3 HIS A 44 20.132 37.486 15.938 1.00 0.00 H new ATOM 0 HD2 HIS A 44 23.141 35.032 15.469 1.00 0.00 H new ATOM 0 HE1 HIS A 44 21.333 35.797 11.708 1.00 0.00 H new ATOM 0 HE2 HIS A 44 22.939 34.288 12.979 1.00 0.00 H new ATOM 749 N THR A 45 20.077 39.310 17.718 1.00 0.00 N ATOM 750 CA THR A 45 19.022 40.158 18.182 1.00 0.00 C ATOM 751 C THR A 45 18.340 39.473 19.315 1.00 0.00 C ATOM 752 O THR A 45 18.371 38.248 19.429 1.00 0.00 O ATOM 753 CB THR A 45 18.032 40.568 17.133 1.00 0.00 C ATOM 754 OG1 THR A 45 17.095 41.528 17.596 1.00 0.00 O ATOM 755 CG2 THR A 45 17.246 39.373 16.565 1.00 0.00 C ATOM 0 H THR A 45 20.105 38.411 18.199 1.00 0.00 H new ATOM 0 HA THR A 45 19.480 41.095 18.498 1.00 0.00 H new ATOM 0 HB THR A 45 18.643 41.014 16.348 1.00 0.00 H new ATOM 0 HG1 THR A 45 16.477 41.758 16.871 1.00 0.00 H new ATOM 0 HG21 THR A 45 16.543 39.725 15.810 1.00 0.00 H new ATOM 0 HG22 THR A 45 17.939 38.664 16.113 1.00 0.00 H new ATOM 0 HG23 THR A 45 16.698 38.882 17.369 1.00 0.00 H new ATOM 763 N LYS A 46 17.710 40.242 20.222 1.00 0.00 N ATOM 764 CA LYS A 46 16.996 39.758 21.362 1.00 0.00 C ATOM 765 C LYS A 46 15.527 39.735 21.109 1.00 0.00 C ATOM 766 O LYS A 46 15.025 40.267 20.120 1.00 0.00 O ATOM 767 CB LYS A 46 17.269 40.673 22.568 1.00 0.00 C ATOM 768 CG LYS A 46 18.734 40.691 23.007 1.00 0.00 C ATOM 769 CD LYS A 46 18.980 41.756 24.078 1.00 0.00 C ATOM 770 CE LYS A 46 20.378 41.694 24.696 1.00 0.00 C ATOM 771 NZ LYS A 46 20.585 42.829 25.624 1.00 0.00 N ATOM 0 H LYS A 46 17.699 41.260 20.155 1.00 0.00 H new ATOM 0 HA LYS A 46 17.337 38.743 21.565 1.00 0.00 H new ATOM 0 HB2 LYS A 46 16.961 41.689 22.319 1.00 0.00 H new ATOM 0 HB3 LYS A 46 16.652 40.349 23.406 1.00 0.00 H new ATOM 0 HG2 LYS A 46 19.012 39.711 23.395 1.00 0.00 H new ATOM 0 HG3 LYS A 46 19.372 40.885 22.145 1.00 0.00 H new ATOM 0 HD2 LYS A 46 18.830 42.742 23.639 1.00 0.00 H new ATOM 0 HD3 LYS A 46 18.238 41.643 24.868 1.00 0.00 H new ATOM 0 HE2 LYS A 46 20.505 40.752 25.230 1.00 0.00 H new ATOM 0 HE3 LYS A 46 21.132 41.718 23.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 21.539 42.772 26.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 20.485 43.725 25.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 19.877 42.789 26.385 1.00 0.00 H new ATOM 785 N GLY A 47 14.743 39.116 22.009 1.00 0.00 N ATOM 786 CA GLY A 47 13.315 39.180 22.009 1.00 0.00 C ATOM 787 C GLY A 47 12.663 37.912 21.574 1.00 0.00 C ATOM 788 O GLY A 47 11.525 37.623 21.942 1.00 0.00 O ATOM 0 H GLY A 47 15.120 38.548 22.768 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.970 39.431 23.012 1.00 0.00 H new ATOM 0 HA3 GLY A 47 12.995 39.988 21.351 1.00 0.00 H new ATOM 792 N ARG A 48 13.357 37.128 20.731 1.00 0.00 N ATOM 793 CA ARG A 48 12.894 35.899 20.165 1.00 0.00 C ATOM 794 C ARG A 48 13.223 34.733 21.031 1.00 0.00 C ATOM 795 O ARG A 48 14.075 34.884 21.905 1.00 0.00 O ATOM 796 CB ARG A 48 13.552 35.711 18.788 1.00 0.00 C ATOM 797 CG ARG A 48 15.081 35.732 18.819 1.00 0.00 C ATOM 798 CD ARG A 48 15.730 35.468 17.458 1.00 0.00 C ATOM 799 NE ARG A 48 15.293 36.534 16.513 1.00 0.00 N ATOM 800 CZ ARG A 48 15.494 36.440 15.166 1.00 0.00 C ATOM 801 NH1 ARG A 48 16.226 35.429 14.612 1.00 0.00 N ATOM 802 NH2 ARG A 48 14.939 37.374 14.340 1.00 0.00 N ATOM 0 H ARG A 48 14.300 37.368 20.426 1.00 0.00 H new ATOM 0 HA ARG A 48 11.809 35.950 20.074 1.00 0.00 H new ATOM 0 HB2 ARG A 48 13.221 34.762 18.365 1.00 0.00 H new ATOM 0 HB3 ARG A 48 13.202 36.497 18.119 1.00 0.00 H new ATOM 0 HG2 ARG A 48 15.414 36.702 19.188 1.00 0.00 H new ATOM 0 HG3 ARG A 48 15.431 34.983 19.529 1.00 0.00 H new ATOM 0 HD2 ARG A 48 16.816 35.465 17.550 1.00 0.00 H new ATOM 0 HD3 ARG A 48 15.439 34.487 17.083 1.00 0.00 H new ATOM 0 HE ARG A 48 14.828 37.362 16.885 1.00 0.00 H new ATOM 0 HH11 ARG A 48 16.642 34.714 15.209 1.00 0.00 H new ATOM 0 HH12 ARG A 48 16.357 35.389 13.601 1.00 0.00 H new ATOM 0 HH21 ARG A 48 14.380 38.133 14.731 1.00 0.00 H new ATOM 0 HH22 ARG A 48 15.083 37.313 13.332 1.00 0.00 H new ATOM 816 N PRO A 49 12.658 33.572 20.877 1.00 0.00 N ATOM 817 CA PRO A 49 12.988 32.426 21.672 1.00 0.00 C ATOM 818 C PRO A 49 14.416 32.007 21.600 1.00 0.00 C ATOM 819 O PRO A 49 14.986 31.956 20.510 1.00 0.00 O ATOM 820 CB PRO A 49 12.067 31.324 21.155 1.00 0.00 C ATOM 821 CG PRO A 49 10.801 32.094 20.746 1.00 0.00 C ATOM 822 CD PRO A 49 11.407 33.379 20.159 1.00 0.00 C ATOM 0 HA PRO A 49 12.848 32.654 22.729 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.507 30.794 20.311 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.856 30.581 21.924 1.00 0.00 H new ATOM 0 HG2 PRO A 49 10.206 31.548 20.014 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.151 32.297 21.597 1.00 0.00 H new ATOM 0 HD2 PRO A 49 11.579 33.280 19.087 1.00 0.00 H new ATOM 0 HD3 PRO A 49 10.738 34.229 20.297 1.00 0.00 H new ATOM 830 N PHE A 50 15.028 31.739 22.767 1.00 0.00 N ATOM 831 CA PHE A 50 16.437 31.676 23.003 1.00 0.00 C ATOM 832 C PHE A 50 17.245 30.788 22.120 1.00 0.00 C ATOM 833 O PHE A 50 16.880 29.652 21.818 1.00 0.00 O ATOM 834 CB PHE A 50 16.689 31.327 24.480 1.00 0.00 C ATOM 835 CG PHE A 50 17.569 32.318 25.162 1.00 0.00 C ATOM 836 CD1 PHE A 50 17.167 33.628 25.272 1.00 0.00 C ATOM 837 CD2 PHE A 50 18.788 31.949 25.680 1.00 0.00 C ATOM 838 CE1 PHE A 50 17.981 34.568 25.858 1.00 0.00 C ATOM 839 CE2 PHE A 50 19.608 32.878 26.276 1.00 0.00 C ATOM 840 CZ PHE A 50 19.206 34.190 26.357 1.00 0.00 C ATOM 0 H PHE A 50 14.492 31.551 23.614 1.00 0.00 H new ATOM 0 HA PHE A 50 16.795 32.673 22.744 1.00 0.00 H new ATOM 0 HB2 PHE A 50 15.735 31.273 25.004 1.00 0.00 H new ATOM 0 HB3 PHE A 50 17.144 30.339 24.543 1.00 0.00 H new ATOM 0 HD1 PHE A 50 16.199 33.922 24.893 1.00 0.00 H new ATOM 0 HD2 PHE A 50 19.105 30.918 25.618 1.00 0.00 H new ATOM 0 HE1 PHE A 50 17.661 35.597 25.926 1.00 0.00 H new ATOM 0 HE2 PHE A 50 20.564 32.578 26.679 1.00 0.00 H new ATOM 0 HZ PHE A 50 19.853 34.925 26.813 1.00 0.00 H new ATOM 850 N ARG A 51 18.406 31.296 21.670 1.00 0.00 N ATOM 851 CA ARG A 51 19.367 30.594 20.877 1.00 0.00 C ATOM 852 C ARG A 51 20.500 30.091 21.705 1.00 0.00 C ATOM 853 O ARG A 51 21.169 29.138 21.310 1.00 0.00 O ATOM 854 CB ARG A 51 19.898 31.469 19.729 1.00 0.00 C ATOM 855 CG ARG A 51 19.221 31.222 18.379 1.00 0.00 C ATOM 856 CD ARG A 51 19.590 29.890 17.725 1.00 0.00 C ATOM 857 NE ARG A 51 19.073 29.902 16.328 1.00 0.00 N ATOM 858 CZ ARG A 51 17.919 29.310 15.901 1.00 0.00 C ATOM 859 NH1 ARG A 51 17.043 28.684 16.739 1.00 0.00 N ATOM 860 NH2 ARG A 51 17.658 29.309 14.561 1.00 0.00 N ATOM 0 H ARG A 51 18.690 32.254 21.872 1.00 0.00 H new ATOM 0 HA ARG A 51 18.852 29.736 20.445 1.00 0.00 H new ATOM 0 HB2 ARG A 51 19.771 32.517 19.999 1.00 0.00 H new ATOM 0 HB3 ARG A 51 20.969 31.295 19.622 1.00 0.00 H new ATOM 0 HG2 ARG A 51 18.140 31.259 18.515 1.00 0.00 H new ATOM 0 HG3 ARG A 51 19.485 32.033 17.700 1.00 0.00 H new ATOM 0 HD2 ARG A 51 20.671 29.750 17.730 1.00 0.00 H new ATOM 0 HD3 ARG A 51 19.159 29.059 18.283 1.00 0.00 H new ATOM 0 HE ARG A 51 19.629 30.395 15.630 1.00 0.00 H new ATOM 0 HH11 ARG A 51 17.236 28.642 17.740 1.00 0.00 H new ATOM 0 HH12 ARG A 51 16.195 28.258 16.365 1.00 0.00 H new ATOM 0 HH21 ARG A 51 18.316 29.742 13.913 1.00 0.00 H new ATOM 0 HH22 ARG A 51 16.805 28.875 14.208 1.00 0.00 H new ATOM 874 N GLY A 52 20.751 30.672 22.892 1.00 0.00 N ATOM 875 CA GLY A 52 21.826 30.310 23.762 1.00 0.00 C ATOM 876 C GLY A 52 21.631 29.063 24.553 1.00 0.00 C ATOM 877 O GLY A 52 21.888 29.032 25.755 1.00 0.00 O ATOM 0 H GLY A 52 20.177 31.430 23.262 1.00 0.00 H new ATOM 0 HA2 GLY A 52 22.731 30.200 23.164 1.00 0.00 H new ATOM 0 HA3 GLY A 52 22.000 31.133 24.455 1.00 0.00 H new ATOM 881 N MET A 53 21.257 27.988 23.837 1.00 0.00 N ATOM 882 CA MET A 53 21.412 26.592 24.107 1.00 0.00 C ATOM 883 C MET A 53 21.348 26.123 25.520 1.00 0.00 C ATOM 884 O MET A 53 20.485 26.515 26.305 1.00 0.00 O ATOM 885 CB MET A 53 22.642 26.121 23.313 1.00 0.00 C ATOM 886 CG MET A 53 23.976 26.741 23.733 1.00 0.00 C ATOM 887 SD MET A 53 25.367 26.320 22.639 1.00 0.00 S ATOM 888 CE MET A 53 26.439 27.034 23.920 1.00 0.00 C ATOM 0 H MET A 53 20.780 28.123 22.946 1.00 0.00 H new ATOM 0 HA MET A 53 20.504 26.095 23.766 1.00 0.00 H new ATOM 0 HB2 MET A 53 22.720 25.038 23.406 1.00 0.00 H new ATOM 0 HB3 MET A 53 22.477 26.339 22.258 1.00 0.00 H new ATOM 0 HG2 MET A 53 23.867 27.825 23.764 1.00 0.00 H new ATOM 0 HG3 MET A 53 24.213 26.416 24.746 1.00 0.00 H new ATOM 0 HE1 MET A 53 27.467 27.062 23.560 1.00 0.00 H new ATOM 0 HE2 MET A 53 26.107 28.047 24.149 1.00 0.00 H new ATOM 0 HE3 MET A 53 26.387 26.422 24.821 1.00 0.00 H new ATOM 898 N SER A 54 22.261 25.206 25.885 1.00 0.00 N ATOM 899 CA SER A 54 22.504 24.798 27.233 1.00 0.00 C ATOM 900 C SER A 54 23.791 25.376 27.713 1.00 0.00 C ATOM 901 O SER A 54 24.828 25.244 27.066 1.00 0.00 O ATOM 902 CB SER A 54 22.582 23.273 27.423 1.00 0.00 C ATOM 903 OG SER A 54 21.426 22.628 26.907 1.00 0.00 O ATOM 0 H SER A 54 22.857 24.727 25.209 1.00 0.00 H new ATOM 0 HA SER A 54 21.650 25.163 27.804 1.00 0.00 H new ATOM 0 HB2 SER A 54 23.470 22.887 26.923 1.00 0.00 H new ATOM 0 HB3 SER A 54 22.687 23.041 28.483 1.00 0.00 H new ATOM 0 HG SER A 54 21.504 21.660 27.040 1.00 0.00 H new ATOM 909 N GLU A 55 23.793 25.989 28.910 1.00 0.00 N ATOM 910 CA GLU A 55 24.945 26.476 29.604 1.00 0.00 C ATOM 911 C GLU A 55 25.921 25.384 29.877 1.00 0.00 C ATOM 912 O GLU A 55 27.135 25.552 29.775 1.00 0.00 O ATOM 913 CB GLU A 55 24.543 27.086 30.958 1.00 0.00 C ATOM 914 CG GLU A 55 23.453 28.160 30.965 1.00 0.00 C ATOM 915 CD GLU A 55 23.896 29.570 30.604 1.00 0.00 C ATOM 916 OE1 GLU A 55 24.819 30.115 31.266 1.00 0.00 O ATOM 917 OE2 GLU A 55 23.244 30.199 29.728 1.00 0.00 O ATOM 0 H GLU A 55 22.930 26.155 29.428 1.00 0.00 H new ATOM 0 HA GLU A 55 25.402 27.228 28.961 1.00 0.00 H new ATOM 0 HB2 GLU A 55 24.216 26.273 31.607 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.437 27.515 31.410 1.00 0.00 H new ATOM 0 HG2 GLU A 55 22.670 27.858 30.269 1.00 0.00 H new ATOM 0 HG3 GLU A 55 23.004 28.186 31.958 1.00 0.00 H new ATOM 924 N GLU A 56 25.422 24.169 30.164 1.00 0.00 N ATOM 925 CA GLU A 56 26.244 23.010 30.328 1.00 0.00 C ATOM 926 C GLU A 56 27.020 22.587 29.127 1.00 0.00 C ATOM 927 O GLU A 56 27.997 21.857 29.284 1.00 0.00 O ATOM 928 CB GLU A 56 25.447 21.790 30.820 1.00 0.00 C ATOM 929 CG GLU A 56 24.676 21.018 29.748 1.00 0.00 C ATOM 930 CD GLU A 56 24.120 19.692 30.243 1.00 0.00 C ATOM 931 OE1 GLU A 56 24.914 18.838 30.723 1.00 0.00 O ATOM 932 OE2 GLU A 56 22.885 19.476 30.119 1.00 0.00 O ATOM 0 H GLU A 56 24.426 23.987 30.285 1.00 0.00 H new ATOM 0 HA GLU A 56 26.960 23.344 31.079 1.00 0.00 H new ATOM 0 HB2 GLU A 56 26.137 21.103 31.309 1.00 0.00 H new ATOM 0 HB3 GLU A 56 24.739 22.125 31.579 1.00 0.00 H new ATOM 0 HG2 GLU A 56 23.854 21.636 29.386 1.00 0.00 H new ATOM 0 HG3 GLU A 56 25.334 20.834 28.899 1.00 0.00 H new ATOM 939 N GLU A 57 26.642 22.956 27.890 1.00 0.00 N ATOM 940 CA GLU A 57 27.263 22.411 26.724 1.00 0.00 C ATOM 941 C GLU A 57 28.508 23.166 26.404 1.00 0.00 C ATOM 942 O GLU A 57 29.509 22.629 25.934 1.00 0.00 O ATOM 943 CB GLU A 57 26.363 22.284 25.484 1.00 0.00 C ATOM 944 CG GLU A 57 26.602 23.303 24.367 1.00 0.00 C ATOM 945 CD GLU A 57 25.722 22.979 23.168 1.00 0.00 C ATOM 946 OE1 GLU A 57 24.471 22.934 23.303 1.00 0.00 O ATOM 947 OE2 GLU A 57 26.288 22.706 22.076 1.00 0.00 O ATOM 0 H GLU A 57 25.904 23.634 27.698 1.00 0.00 H new ATOM 0 HA GLU A 57 27.500 21.380 26.987 1.00 0.00 H new ATOM 0 HB2 GLU A 57 26.491 21.284 25.069 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.324 22.365 25.805 1.00 0.00 H new ATOM 0 HG2 GLU A 57 26.383 24.308 24.728 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.651 23.292 24.072 1.00 0.00 H new ATOM 954 N VAL A 58 28.473 24.485 26.670 1.00 0.00 N ATOM 955 CA VAL A 58 29.560 25.363 26.370 1.00 0.00 C ATOM 956 C VAL A 58 30.721 25.041 27.247 1.00 0.00 C ATOM 957 O VAL A 58 31.879 24.989 26.837 1.00 0.00 O ATOM 958 CB VAL A 58 29.046 26.771 26.390 1.00 0.00 C ATOM 959 CG1 VAL A 58 29.162 27.447 27.767 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.834 27.614 25.372 1.00 0.00 C ATOM 0 H VAL A 58 27.674 24.949 27.102 1.00 0.00 H new ATOM 0 HA VAL A 58 29.961 25.228 25.366 1.00 0.00 H new ATOM 0 HB VAL A 58 27.987 26.716 26.139 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.772 28.463 27.708 1.00 0.00 H new ATOM 0 HG12 VAL A 58 28.588 26.880 28.500 1.00 0.00 H new ATOM 0 HG13 VAL A 58 30.209 27.478 28.070 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.463 28.639 25.384 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.892 27.608 25.636 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.706 27.193 24.375 1.00 0.00 H new ATOM 970 N PHE A 59 30.367 24.657 28.487 1.00 0.00 N ATOM 971 CA PHE A 59 31.155 23.987 29.475 1.00 0.00 C ATOM 972 C PHE A 59 31.634 22.643 29.046 1.00 0.00 C ATOM 973 O PHE A 59 32.834 22.371 29.078 1.00 0.00 O ATOM 974 CB PHE A 59 30.280 23.935 30.739 1.00 0.00 C ATOM 975 CG PHE A 59 30.966 23.578 32.011 1.00 0.00 C ATOM 976 CD1 PHE A 59 31.178 22.262 32.349 1.00 0.00 C ATOM 977 CD2 PHE A 59 31.257 24.559 32.930 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.676 21.927 33.586 1.00 0.00 C ATOM 979 CE2 PHE A 59 31.739 24.234 34.176 1.00 0.00 C ATOM 980 CZ PHE A 59 31.944 22.915 34.504 1.00 0.00 C ATOM 0 H PHE A 59 29.424 24.838 28.832 1.00 0.00 H new ATOM 0 HA PHE A 59 32.082 24.530 29.657 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.809 24.910 30.868 1.00 0.00 H new ATOM 0 HB3 PHE A 59 29.480 23.215 30.570 1.00 0.00 H new ATOM 0 HD1 PHE A 59 30.951 21.484 31.636 1.00 0.00 H new ATOM 0 HD2 PHE A 59 31.105 25.596 32.670 1.00 0.00 H new ATOM 0 HE1 PHE A 59 31.856 20.892 33.836 1.00 0.00 H new ATOM 0 HE2 PHE A 59 31.956 25.011 34.894 1.00 0.00 H new ATOM 0 HZ PHE A 59 32.316 22.654 35.484 1.00 0.00 H new ATOM 990 N THR A 60 30.750 21.732 28.601 1.00 0.00 N ATOM 991 CA THR A 60 31.040 20.397 28.179 1.00 0.00 C ATOM 992 C THR A 60 32.054 20.261 27.095 1.00 0.00 C ATOM 993 O THR A 60 32.932 19.401 27.135 1.00 0.00 O ATOM 994 CB THR A 60 29.826 19.576 27.864 1.00 0.00 C ATOM 995 OG1 THR A 60 29.874 18.307 28.500 1.00 0.00 O ATOM 996 CG2 THR A 60 29.556 19.300 26.375 1.00 0.00 C ATOM 0 H THR A 60 29.755 21.947 28.532 1.00 0.00 H new ATOM 0 HA THR A 60 31.504 19.986 29.075 1.00 0.00 H new ATOM 0 HB THR A 60 29.021 20.209 28.238 1.00 0.00 H new ATOM 0 HG1 THR A 60 29.067 17.798 28.275 1.00 0.00 H new ATOM 0 HG21 THR A 60 28.653 18.698 26.274 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.423 20.245 25.848 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.401 18.761 25.946 1.00 0.00 H new ATOM 1004 N GLU A 61 31.992 21.129 26.069 1.00 0.00 N ATOM 1005 CA GLU A 61 32.910 21.093 24.974 1.00 0.00 C ATOM 1006 C GLU A 61 34.259 21.573 25.386 1.00 0.00 C ATOM 1007 O GLU A 61 35.243 20.878 25.136 1.00 0.00 O ATOM 1008 CB GLU A 61 32.313 21.788 23.738 1.00 0.00 C ATOM 1009 CG GLU A 61 31.175 21.004 23.081 1.00 0.00 C ATOM 1010 CD GLU A 61 31.672 19.815 22.272 1.00 0.00 C ATOM 1011 OE1 GLU A 61 32.422 20.048 21.285 1.00 0.00 O ATOM 1012 OE2 GLU A 61 31.283 18.652 22.556 1.00 0.00 O ATOM 0 H GLU A 61 31.293 21.868 25.999 1.00 0.00 H new ATOM 0 HA GLU A 61 33.071 20.060 24.665 1.00 0.00 H new ATOM 0 HB2 GLU A 61 31.944 22.772 24.028 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.103 21.947 23.005 1.00 0.00 H new ATOM 0 HG2 GLU A 61 30.489 20.653 23.852 1.00 0.00 H new ATOM 0 HG3 GLU A 61 30.609 21.670 22.430 1.00 0.00 H new ATOM 1019 N VAL A 62 34.365 22.691 26.125 1.00 0.00 N ATOM 1020 CA VAL A 62 35.554 23.219 26.720 1.00 0.00 C ATOM 1021 C VAL A 62 36.285 22.259 27.593 1.00 0.00 C ATOM 1022 O VAL A 62 37.513 22.246 27.674 1.00 0.00 O ATOM 1023 CB VAL A 62 35.161 24.427 27.518 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.258 24.956 28.457 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.800 25.530 26.508 1.00 0.00 C ATOM 0 H VAL A 62 33.551 23.273 26.322 1.00 0.00 H new ATOM 0 HA VAL A 62 36.246 23.459 25.913 1.00 0.00 H new ATOM 0 HB VAL A 62 34.332 24.141 28.165 1.00 0.00 H new ATOM 0 HG11 VAL A 62 35.887 25.829 28.994 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.531 24.180 29.172 1.00 0.00 H new ATOM 0 HG13 VAL A 62 37.134 25.235 27.872 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.506 26.432 27.044 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.665 25.746 25.881 1.00 0.00 H new ATOM 0 HG23 VAL A 62 33.973 25.194 25.883 1.00 0.00 H new ATOM 1035 N ALA A 63 35.536 21.350 28.242 1.00 0.00 N ATOM 1036 CA ALA A 63 36.006 20.394 29.195 1.00 0.00 C ATOM 1037 C ALA A 63 36.971 19.430 28.592 1.00 0.00 C ATOM 1038 O ALA A 63 37.909 18.970 29.242 1.00 0.00 O ATOM 1039 CB ALA A 63 34.850 19.560 29.771 1.00 0.00 C ATOM 0 H ALA A 63 34.530 21.279 28.089 1.00 0.00 H new ATOM 0 HA ALA A 63 36.493 20.978 29.976 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.243 18.843 30.492 1.00 0.00 H new ATOM 0 HB2 ALA A 63 34.137 20.219 30.266 1.00 0.00 H new ATOM 0 HB3 ALA A 63 34.350 19.025 28.964 1.00 0.00 H new ATOM 1045 N ASN A 64 36.785 19.117 27.298 1.00 0.00 N ATOM 1046 CA ASN A 64 37.670 18.210 26.635 1.00 0.00 C ATOM 1047 C ASN A 64 38.974 18.849 26.301 1.00 0.00 C ATOM 1048 O ASN A 64 40.011 18.190 26.248 1.00 0.00 O ATOM 1049 CB ASN A 64 37.151 17.635 25.307 1.00 0.00 C ATOM 1050 CG ASN A 64 35.673 17.283 25.398 1.00 0.00 C ATOM 1051 OD1 ASN A 64 35.243 16.323 26.035 1.00 0.00 O ATOM 1052 ND2 ASN A 64 34.871 18.142 24.712 1.00 0.00 N ATOM 0 H ASN A 64 36.032 19.486 26.717 1.00 0.00 H new ATOM 0 HA ASN A 64 37.765 17.405 27.364 1.00 0.00 H new ATOM 0 HB2 ASN A 64 37.306 18.361 24.509 1.00 0.00 H new ATOM 0 HB3 ASN A 64 37.724 16.745 25.045 1.00 0.00 H new ATOM 0 HD21 ASN A 64 33.860 18.005 24.710 1.00 0.00 H new ATOM 0 HD22 ASN A 64 35.281 18.923 24.200 1.00 0.00 H new ATOM 1059 N LEU A 65 38.959 20.172 26.056 1.00 0.00 N ATOM 1060 CA LEU A 65 40.098 20.960 25.700 1.00 0.00 C ATOM 1061 C LEU A 65 40.982 21.154 26.884 1.00 0.00 C ATOM 1062 O LEU A 65 42.207 21.219 26.798 1.00 0.00 O ATOM 1063 CB LEU A 65 39.724 22.350 25.159 1.00 0.00 C ATOM 1064 CG LEU A 65 39.048 22.369 23.777 1.00 0.00 C ATOM 1065 CD1 LEU A 65 37.641 21.751 23.825 1.00 0.00 C ATOM 1066 CD2 LEU A 65 38.925 23.805 23.239 1.00 0.00 C ATOM 0 H LEU A 65 38.102 20.722 26.110 1.00 0.00 H new ATOM 0 HA LEU A 65 40.608 20.408 24.910 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.058 22.831 25.875 1.00 0.00 H new ATOM 0 HB3 LEU A 65 40.629 22.955 25.109 1.00 0.00 H new ATOM 0 HG LEU A 65 39.681 21.777 23.116 1.00 0.00 H new ATOM 0 HD11 LEU A 65 37.196 21.782 22.831 1.00 0.00 H new ATOM 0 HD12 LEU A 65 37.710 20.716 24.159 1.00 0.00 H new ATOM 0 HD13 LEU A 65 37.019 22.316 24.519 1.00 0.00 H new ATOM 0 HD21 LEU A 65 38.444 23.787 22.261 1.00 0.00 H new ATOM 0 HD22 LEU A 65 38.326 24.401 23.927 1.00 0.00 H new ATOM 0 HD23 LEU A 65 39.918 24.245 23.147 1.00 0.00 H new ATOM 1078 N PHE A 66 40.338 21.259 28.061 1.00 0.00 N ATOM 1079 CA PHE A 66 40.908 21.638 29.316 1.00 0.00 C ATOM 1080 C PHE A 66 41.381 20.452 30.086 1.00 0.00 C ATOM 1081 O PHE A 66 42.061 20.589 31.102 1.00 0.00 O ATOM 1082 CB PHE A 66 39.849 22.347 30.175 1.00 0.00 C ATOM 1083 CG PHE A 66 39.768 23.816 29.937 1.00 0.00 C ATOM 1084 CD1 PHE A 66 39.770 24.366 28.677 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.686 24.658 31.021 1.00 0.00 C ATOM 1086 CE1 PHE A 66 39.759 25.730 28.501 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.650 26.023 30.861 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.704 26.559 29.597 1.00 0.00 C ATOM 0 H PHE A 66 39.340 21.063 28.139 1.00 0.00 H new ATOM 0 HA PHE A 66 41.751 22.294 29.100 1.00 0.00 H new ATOM 0 HB2 PHE A 66 38.874 21.901 29.975 1.00 0.00 H new ATOM 0 HB3 PHE A 66 40.070 22.170 31.228 1.00 0.00 H new ATOM 0 HD1 PHE A 66 39.780 23.718 27.813 1.00 0.00 H new ATOM 0 HD2 PHE A 66 39.649 24.240 32.016 1.00 0.00 H new ATOM 0 HE1 PHE A 66 39.793 26.148 27.506 1.00 0.00 H new ATOM 0 HE2 PHE A 66 39.580 26.670 31.723 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.703 27.631 29.464 1.00 0.00 H new ATOM 1098 N ARG A 67 40.996 19.248 29.628 1.00 0.00 N ATOM 1099 CA ARG A 67 41.063 17.979 30.285 1.00 0.00 C ATOM 1100 C ARG A 67 42.311 17.669 31.037 1.00 0.00 C ATOM 1101 O ARG A 67 43.439 17.861 30.585 1.00 0.00 O ATOM 1102 CB ARG A 67 40.722 16.921 29.222 1.00 0.00 C ATOM 1103 CG ARG A 67 40.177 15.580 29.720 1.00 0.00 C ATOM 1104 CD ARG A 67 41.226 14.576 30.201 1.00 0.00 C ATOM 1105 NE ARG A 67 40.497 13.330 30.570 1.00 0.00 N ATOM 1106 CZ ARG A 67 41.108 12.224 31.086 1.00 0.00 C ATOM 1107 NH1 ARG A 67 42.433 12.216 31.413 1.00 0.00 N ATOM 1108 NH2 ARG A 67 40.375 11.086 31.262 1.00 0.00 N ATOM 0 H ARG A 67 40.594 19.157 28.695 1.00 0.00 H new ATOM 0 HA ARG A 67 40.342 17.990 31.103 1.00 0.00 H new ATOM 0 HB2 ARG A 67 39.989 17.351 28.540 1.00 0.00 H new ATOM 0 HB3 ARG A 67 41.622 16.725 28.640 1.00 0.00 H new ATOM 0 HG2 ARG A 67 39.482 15.772 30.538 1.00 0.00 H new ATOM 0 HG3 ARG A 67 39.603 15.121 28.915 1.00 0.00 H new ATOM 0 HD2 ARG A 67 41.958 14.377 29.418 1.00 0.00 H new ATOM 0 HD3 ARG A 67 41.774 14.970 31.057 1.00 0.00 H new ATOM 0 HE ARG A 67 39.487 13.302 30.429 1.00 0.00 H new ATOM 0 HH11 ARG A 67 42.998 13.054 31.274 1.00 0.00 H new ATOM 0 HH12 ARG A 67 42.858 11.372 31.797 1.00 0.00 H new ATOM 0 HH21 ARG A 67 39.387 11.072 31.009 1.00 0.00 H new ATOM 0 HH22 ARG A 67 40.815 10.250 31.646 1.00 0.00 H new ATOM 1122 N GLY A 68 42.107 17.207 32.284 1.00 0.00 N ATOM 1123 CA GLY A 68 43.133 17.013 33.261 1.00 0.00 C ATOM 1124 C GLY A 68 43.133 18.110 34.269 1.00 0.00 C ATOM 1125 O GLY A 68 43.490 17.919 35.431 1.00 0.00 O ATOM 0 H GLY A 68 41.180 16.956 32.627 1.00 0.00 H new ATOM 0 HA2 GLY A 68 42.986 16.056 33.762 1.00 0.00 H new ATOM 0 HA3 GLY A 68 44.104 16.969 32.768 1.00 0.00 H new ATOM 1129 N GLN A 69 42.729 19.325 33.854 1.00 0.00 N ATOM 1130 CA GLN A 69 42.685 20.474 34.704 1.00 0.00 C ATOM 1131 C GLN A 69 41.296 20.745 35.171 1.00 0.00 C ATOM 1132 O GLN A 69 40.536 21.552 34.636 1.00 0.00 O ATOM 1133 CB GLN A 69 43.255 21.709 33.987 1.00 0.00 C ATOM 1134 CG GLN A 69 44.639 21.427 33.397 1.00 0.00 C ATOM 1135 CD GLN A 69 45.172 22.668 32.695 1.00 0.00 C ATOM 1136 OE1 GLN A 69 46.045 23.357 33.219 1.00 0.00 O ATOM 1137 NE2 GLN A 69 44.598 22.981 31.503 1.00 0.00 N ATOM 0 H GLN A 69 42.424 19.513 32.899 1.00 0.00 H new ATOM 0 HA GLN A 69 43.304 20.262 35.576 1.00 0.00 H new ATOM 0 HB2 GLN A 69 42.575 22.015 33.192 1.00 0.00 H new ATOM 0 HB3 GLN A 69 43.320 22.540 34.689 1.00 0.00 H new ATOM 0 HG2 GLN A 69 45.325 21.124 34.188 1.00 0.00 H new ATOM 0 HG3 GLN A 69 44.580 20.598 32.692 1.00 0.00 H new ATOM 0 HE21 GLN A 69 43.877 22.376 31.110 1.00 0.00 H new ATOM 0 HE22 GLN A 69 44.888 23.821 31.002 1.00 0.00 H new ATOM 1146 N GLU A 70 40.929 20.034 36.251 1.00 0.00 N ATOM 1147 CA GLU A 70 39.608 19.916 36.788 1.00 0.00 C ATOM 1148 C GLU A 70 39.221 21.135 37.553 1.00 0.00 C ATOM 1149 O GLU A 70 38.068 21.563 37.550 1.00 0.00 O ATOM 1150 CB GLU A 70 39.564 18.661 37.678 1.00 0.00 C ATOM 1151 CG GLU A 70 39.884 17.369 36.924 1.00 0.00 C ATOM 1152 CD GLU A 70 40.048 16.161 37.835 1.00 0.00 C ATOM 1153 OE1 GLU A 70 39.247 16.010 38.796 1.00 0.00 O ATOM 1154 OE2 GLU A 70 40.975 15.341 37.599 1.00 0.00 O ATOM 0 H GLU A 70 41.610 19.500 36.791 1.00 0.00 H new ATOM 0 HA GLU A 70 38.888 19.820 35.976 1.00 0.00 H new ATOM 0 HB2 GLU A 70 40.274 18.780 38.497 1.00 0.00 H new ATOM 0 HB3 GLU A 70 38.573 18.576 38.125 1.00 0.00 H new ATOM 0 HG2 GLU A 70 39.087 17.169 36.208 1.00 0.00 H new ATOM 0 HG3 GLU A 70 40.800 17.509 36.351 1.00 0.00 H new ATOM 1161 N ASP A 71 40.208 21.792 38.189 1.00 0.00 N ATOM 1162 CA ASP A 71 40.039 22.958 38.999 1.00 0.00 C ATOM 1163 C ASP A 71 39.630 24.165 38.227 1.00 0.00 C ATOM 1164 O ASP A 71 39.015 25.083 38.768 1.00 0.00 O ATOM 1165 CB ASP A 71 41.345 23.245 39.759 1.00 0.00 C ATOM 1166 CG ASP A 71 41.544 22.195 40.842 1.00 0.00 C ATOM 1167 OD1 ASP A 71 40.671 22.102 41.745 1.00 0.00 O ATOM 1168 OD2 ASP A 71 42.586 21.486 40.824 1.00 0.00 O ATOM 0 H ASP A 71 41.181 21.491 38.134 1.00 0.00 H new ATOM 0 HA ASP A 71 39.225 22.745 39.692 1.00 0.00 H new ATOM 0 HB2 ASP A 71 42.189 23.236 39.069 1.00 0.00 H new ATOM 0 HB3 ASP A 71 41.308 24.239 40.204 1.00 0.00 H new ATOM 1173 N LEU A 72 39.910 24.215 36.912 1.00 0.00 N ATOM 1174 CA LEU A 72 39.434 25.254 36.052 1.00 0.00 C ATOM 1175 C LEU A 72 37.956 25.196 35.872 1.00 0.00 C ATOM 1176 O LEU A 72 37.265 26.187 36.105 1.00 0.00 O ATOM 1177 CB LEU A 72 40.170 25.212 34.702 1.00 0.00 C ATOM 1178 CG LEU A 72 41.697 25.375 34.781 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.305 25.229 33.377 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.159 26.717 35.376 1.00 0.00 C ATOM 0 H LEU A 72 40.481 23.517 36.435 1.00 0.00 H new ATOM 0 HA LEU A 72 39.652 26.209 36.530 1.00 0.00 H new ATOM 0 HB2 LEU A 72 39.947 24.263 34.215 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.770 26.000 34.064 1.00 0.00 H new ATOM 0 HG LEU A 72 42.044 24.592 35.456 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.387 25.345 33.435 1.00 0.00 H new ATOM 0 HD12 LEU A 72 42.067 24.243 32.978 1.00 0.00 H new ATOM 0 HD13 LEU A 72 41.893 25.995 32.721 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.248 26.750 35.396 1.00 0.00 H new ATOM 0 HD22 LEU A 72 41.782 27.536 34.763 1.00 0.00 H new ATOM 0 HD23 LEU A 72 41.774 26.817 36.391 1.00 0.00 H new ATOM 1192 N LEU A 73 37.376 24.030 35.537 1.00 0.00 N ATOM 1193 CA LEU A 73 35.974 23.862 35.316 1.00 0.00 C ATOM 1194 C LEU A 73 35.163 24.020 36.556 1.00 0.00 C ATOM 1195 O LEU A 73 34.010 24.448 36.531 1.00 0.00 O ATOM 1196 CB LEU A 73 35.631 22.486 34.720 1.00 0.00 C ATOM 1197 CG LEU A 73 36.001 22.266 33.243 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.367 23.308 32.305 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.524 22.178 33.058 1.00 0.00 C ATOM 0 H LEU A 73 37.907 23.168 35.415 1.00 0.00 H new ATOM 0 HA LEU A 73 35.722 24.653 34.609 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.132 21.722 35.315 1.00 0.00 H new ATOM 0 HB3 LEU A 73 34.559 22.324 34.831 1.00 0.00 H new ATOM 0 HG LEU A 73 35.575 21.305 32.953 1.00 0.00 H new ATOM 0 HD11 LEU A 73 35.664 23.101 31.277 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.281 23.257 32.386 1.00 0.00 H new ATOM 0 HD13 LEU A 73 35.706 24.305 32.587 1.00 0.00 H new ATOM 0 HD21 LEU A 73 37.754 22.022 32.004 1.00 0.00 H new ATOM 0 HD22 LEU A 73 37.986 23.105 33.397 1.00 0.00 H new ATOM 0 HD23 LEU A 73 37.914 21.344 33.641 1.00 0.00 H new ATOM 1211 N SER A 74 35.769 23.715 37.718 1.00 0.00 N ATOM 1212 CA SER A 74 35.179 23.874 39.010 1.00 0.00 C ATOM 1213 C SER A 74 34.889 25.305 39.308 1.00 0.00 C ATOM 1214 O SER A 74 33.771 25.697 39.641 1.00 0.00 O ATOM 1215 CB SER A 74 36.049 23.322 40.151 1.00 0.00 C ATOM 1216 OG SER A 74 36.198 21.915 40.030 1.00 0.00 O ATOM 0 H SER A 74 36.716 23.339 37.757 1.00 0.00 H new ATOM 0 HA SER A 74 34.255 23.297 38.965 1.00 0.00 H new ATOM 0 HB2 SER A 74 37.029 23.800 40.133 1.00 0.00 H new ATOM 0 HB3 SER A 74 35.595 23.564 41.112 1.00 0.00 H new ATOM 0 HG SER A 74 36.776 21.712 39.265 1.00 0.00 H new ATOM 1222 N GLU A 75 35.901 26.176 39.140 1.00 0.00 N ATOM 1223 CA GLU A 75 35.785 27.591 39.308 1.00 0.00 C ATOM 1224 C GLU A 75 35.085 28.268 38.180 1.00 0.00 C ATOM 1225 O GLU A 75 34.590 29.382 38.339 1.00 0.00 O ATOM 1226 CB GLU A 75 37.141 28.213 39.684 1.00 0.00 C ATOM 1227 CG GLU A 75 37.653 27.621 41.000 1.00 0.00 C ATOM 1228 CD GLU A 75 38.914 28.294 41.521 1.00 0.00 C ATOM 1229 OE1 GLU A 75 39.903 28.415 40.749 1.00 0.00 O ATOM 1230 OE2 GLU A 75 38.963 28.651 42.728 1.00 0.00 O ATOM 0 H GLU A 75 36.841 25.880 38.876 1.00 0.00 H new ATOM 0 HA GLU A 75 35.122 27.767 40.155 1.00 0.00 H new ATOM 0 HB2 GLU A 75 37.865 28.030 38.890 1.00 0.00 H new ATOM 0 HB3 GLU A 75 37.039 29.294 39.780 1.00 0.00 H new ATOM 0 HG2 GLU A 75 36.870 27.702 41.754 1.00 0.00 H new ATOM 0 HG3 GLU A 75 37.850 26.558 40.858 1.00 0.00 H new ATOM 1237 N PHE A 76 34.965 27.627 37.003 1.00 0.00 N ATOM 1238 CA PHE A 76 34.150 28.077 35.918 1.00 0.00 C ATOM 1239 C PHE A 76 32.700 28.145 36.251 1.00 0.00 C ATOM 1240 O PHE A 76 31.930 28.921 35.685 1.00 0.00 O ATOM 1241 CB PHE A 76 34.372 27.180 34.688 1.00 0.00 C ATOM 1242 CG PHE A 76 33.933 27.676 33.353 1.00 0.00 C ATOM 1243 CD1 PHE A 76 33.742 29.007 33.065 1.00 0.00 C ATOM 1244 CD2 PHE A 76 33.767 26.760 32.342 1.00 0.00 C ATOM 1245 CE1 PHE A 76 33.404 29.414 31.795 1.00 0.00 C ATOM 1246 CE2 PHE A 76 33.425 27.150 31.069 1.00 0.00 C ATOM 1247 CZ PHE A 76 33.265 28.487 30.790 1.00 0.00 C ATOM 0 H PHE A 76 35.458 26.757 36.799 1.00 0.00 H new ATOM 0 HA PHE A 76 34.461 29.098 35.699 1.00 0.00 H new ATOM 0 HB2 PHE A 76 35.438 26.962 34.626 1.00 0.00 H new ATOM 0 HB3 PHE A 76 33.864 26.234 34.873 1.00 0.00 H new ATOM 0 HD1 PHE A 76 33.859 29.743 33.847 1.00 0.00 H new ATOM 0 HD2 PHE A 76 33.908 25.710 32.552 1.00 0.00 H new ATOM 0 HE1 PHE A 76 33.248 30.462 31.588 1.00 0.00 H new ATOM 0 HE2 PHE A 76 33.283 26.412 30.294 1.00 0.00 H new ATOM 0 HZ PHE A 76 33.031 28.807 29.785 1.00 0.00 H new ATOM 1257 N GLY A 77 32.262 27.377 37.264 1.00 0.00 N ATOM 1258 CA GLY A 77 30.934 27.348 37.793 1.00 0.00 C ATOM 1259 C GLY A 77 30.470 28.622 38.410 1.00 0.00 C ATOM 1260 O GLY A 77 29.265 28.828 38.542 1.00 0.00 O ATOM 0 H GLY A 77 32.883 26.729 37.748 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.246 27.079 36.991 1.00 0.00 H new ATOM 0 HA3 GLY A 77 30.875 26.558 38.541 1.00 0.00 H new ATOM 1264 N GLN A 78 31.371 29.547 38.785 1.00 0.00 N ATOM 1265 CA GLN A 78 30.994 30.779 39.407 1.00 0.00 C ATOM 1266 C GLN A 78 30.361 31.740 38.460 1.00 0.00 C ATOM 1267 O GLN A 78 29.586 32.611 38.852 1.00 0.00 O ATOM 1268 CB GLN A 78 32.216 31.424 40.082 1.00 0.00 C ATOM 1269 CG GLN A 78 33.194 32.155 39.159 1.00 0.00 C ATOM 1270 CD GLN A 78 34.431 32.601 39.926 1.00 0.00 C ATOM 1271 OE1 GLN A 78 34.420 33.589 40.659 1.00 0.00 O ATOM 1272 NE2 GLN A 78 35.543 31.837 39.761 1.00 0.00 N ATOM 0 H GLN A 78 32.377 29.439 38.655 1.00 0.00 H new ATOM 0 HA GLN A 78 30.241 30.538 40.157 1.00 0.00 H new ATOM 0 HB2 GLN A 78 31.859 32.131 40.831 1.00 0.00 H new ATOM 0 HB3 GLN A 78 32.764 30.646 40.613 1.00 0.00 H new ATOM 0 HG2 GLN A 78 33.486 31.499 38.339 1.00 0.00 H new ATOM 0 HG3 GLN A 78 32.704 33.022 38.715 1.00 0.00 H new ATOM 0 HE21 GLN A 78 35.517 31.024 39.145 1.00 0.00 H new ATOM 0 HE22 GLN A 78 36.404 32.076 40.253 1.00 0.00 H new ATOM 1281 N PHE A 79 30.663 31.585 37.159 1.00 0.00 N ATOM 1282 CA PHE A 79 30.149 32.388 36.094 1.00 0.00 C ATOM 1283 C PHE A 79 28.790 31.926 35.692 1.00 0.00 C ATOM 1284 O PHE A 79 27.955 32.710 35.247 1.00 0.00 O ATOM 1285 CB PHE A 79 31.056 32.335 34.853 1.00 0.00 C ATOM 1286 CG PHE A 79 32.416 32.860 35.166 1.00 0.00 C ATOM 1287 CD1 PHE A 79 32.680 34.208 35.108 1.00 0.00 C ATOM 1288 CD2 PHE A 79 33.435 32.000 35.501 1.00 0.00 C ATOM 1289 CE1 PHE A 79 33.945 34.684 35.367 1.00 0.00 C ATOM 1290 CE2 PHE A 79 34.699 32.465 35.777 1.00 0.00 C ATOM 1291 CZ PHE A 79 34.954 33.815 35.706 1.00 0.00 C ATOM 0 H PHE A 79 31.301 30.859 36.833 1.00 0.00 H new ATOM 0 HA PHE A 79 30.107 33.411 36.468 1.00 0.00 H new ATOM 0 HB2 PHE A 79 31.131 31.308 34.496 1.00 0.00 H new ATOM 0 HB3 PHE A 79 30.612 32.920 34.048 1.00 0.00 H new ATOM 0 HD1 PHE A 79 31.889 34.899 34.857 1.00 0.00 H new ATOM 0 HD2 PHE A 79 33.239 30.939 35.548 1.00 0.00 H new ATOM 0 HE1 PHE A 79 34.145 35.743 35.304 1.00 0.00 H new ATOM 0 HE2 PHE A 79 35.485 31.776 36.047 1.00 0.00 H new ATOM 0 HZ PHE A 79 35.944 34.191 35.916 1.00 0.00 H new ATOM 1301 N LEU A 80 28.522 30.616 35.840 1.00 0.00 N ATOM 1302 CA LEU A 80 27.281 30.021 35.452 1.00 0.00 C ATOM 1303 C LEU A 80 26.222 30.139 36.494 1.00 0.00 C ATOM 1304 O LEU A 80 26.553 30.181 37.678 1.00 0.00 O ATOM 1305 CB LEU A 80 27.499 28.540 35.096 1.00 0.00 C ATOM 1306 CG LEU A 80 28.375 28.347 33.846 1.00 0.00 C ATOM 1307 CD1 LEU A 80 28.513 26.836 33.599 1.00 0.00 C ATOM 1308 CD2 LEU A 80 27.803 29.027 32.590 1.00 0.00 C ATOM 0 H LEU A 80 29.186 29.953 36.240 1.00 0.00 H new ATOM 0 HA LEU A 80 26.928 30.572 34.580 1.00 0.00 H new ATOM 0 HB2 LEU A 80 27.964 28.033 35.941 1.00 0.00 H new ATOM 0 HB3 LEU A 80 26.532 28.065 34.933 1.00 0.00 H new ATOM 0 HG LEU A 80 29.340 28.818 34.033 1.00 0.00 H new ATOM 0 HD11 LEU A 80 29.130 26.666 32.717 1.00 0.00 H new ATOM 0 HD12 LEU A 80 28.981 26.367 34.465 1.00 0.00 H new ATOM 0 HD13 LEU A 80 27.526 26.402 33.440 1.00 0.00 H new ATOM 0 HD21 LEU A 80 28.470 28.852 31.746 1.00 0.00 H new ATOM 0 HD22 LEU A 80 26.820 28.613 32.368 1.00 0.00 H new ATOM 0 HD23 LEU A 80 27.714 30.099 32.765 1.00 0.00 H new ATOM 1320 N PRO A 81 24.961 30.208 36.190 1.00 0.00 N ATOM 1321 CA PRO A 81 23.930 30.236 37.187 1.00 0.00 C ATOM 1322 C PRO A 81 23.655 28.892 37.766 1.00 0.00 C ATOM 1323 O PRO A 81 23.769 27.873 37.085 1.00 0.00 O ATOM 1324 CB PRO A 81 22.709 30.769 36.441 1.00 0.00 C ATOM 1325 CG PRO A 81 22.905 30.258 35.005 1.00 0.00 C ATOM 1326 CD PRO A 81 24.431 30.356 34.843 1.00 0.00 C ATOM 0 HA PRO A 81 24.215 30.851 38.040 1.00 0.00 H new ATOM 0 HB2 PRO A 81 21.781 30.397 36.875 1.00 0.00 H new ATOM 0 HB3 PRO A 81 22.663 31.857 36.475 1.00 0.00 H new ATOM 0 HG2 PRO A 81 22.545 29.236 34.882 1.00 0.00 H new ATOM 0 HG3 PRO A 81 22.376 30.872 34.276 1.00 0.00 H new ATOM 0 HD2 PRO A 81 24.809 29.576 34.182 1.00 0.00 H new ATOM 0 HD3 PRO A 81 24.721 31.312 34.407 1.00 0.00 H new ATOM 1334 N GLU A 82 23.272 28.838 39.054 1.00 0.00 N ATOM 1335 CA GLU A 82 22.904 27.624 39.715 1.00 0.00 C ATOM 1336 C GLU A 82 21.534 27.159 39.360 1.00 0.00 C ATOM 1337 O GLU A 82 21.333 25.983 39.060 1.00 0.00 O ATOM 1338 CB GLU A 82 23.153 27.696 41.230 1.00 0.00 C ATOM 1339 CG GLU A 82 22.393 28.744 42.045 1.00 0.00 C ATOM 1340 CD GLU A 82 20.982 28.330 42.435 1.00 0.00 C ATOM 1341 OE1 GLU A 82 20.819 27.247 43.057 1.00 0.00 O ATOM 1342 OE2 GLU A 82 20.031 29.099 42.127 1.00 0.00 O ATOM 0 H GLU A 82 23.217 29.662 39.653 1.00 0.00 H new ATOM 0 HA GLU A 82 23.569 26.848 39.336 1.00 0.00 H new ATOM 0 HB2 GLU A 82 22.922 26.717 41.651 1.00 0.00 H new ATOM 0 HB3 GLU A 82 24.219 27.866 41.383 1.00 0.00 H new ATOM 0 HG2 GLU A 82 22.958 28.963 42.951 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.342 29.668 41.469 1.00 0.00 H new ATOM 1349 N ALA A 83 20.554 28.080 39.370 1.00 0.00 N ATOM 1350 CA ALA A 83 19.197 27.863 38.975 1.00 0.00 C ATOM 1351 C ALA A 83 18.601 29.216 38.791 1.00 0.00 C ATOM 1352 O ALA A 83 18.200 29.586 37.689 1.00 0.00 O ATOM 1353 CB ALA A 83 18.405 27.042 40.006 1.00 0.00 C ATOM 0 H ALA A 83 20.722 29.039 39.674 1.00 0.00 H new ATOM 0 HA ALA A 83 19.159 27.277 38.057 1.00 0.00 H new ATOM 0 HB1 ALA A 83 17.382 26.907 39.655 1.00 0.00 H new ATOM 0 HB2 ALA A 83 18.876 26.067 40.134 1.00 0.00 H new ATOM 0 HB3 ALA A 83 18.395 27.568 40.960 1.00 0.00 H new ATOM 1359 N LYS A 84 18.572 30.029 39.863 1.00 0.00 N ATOM 1360 CA LYS A 84 18.119 31.383 39.791 1.00 0.00 C ATOM 1361 C LYS A 84 18.560 32.151 40.990 1.00 0.00 C ATOM 1362 O LYS A 84 17.774 32.498 41.872 1.00 0.00 O ATOM 1363 CB LYS A 84 16.593 31.465 39.618 1.00 0.00 C ATOM 1364 CG LYS A 84 16.080 32.820 39.130 1.00 0.00 C ATOM 1365 CD LYS A 84 14.591 32.752 38.784 1.00 0.00 C ATOM 1366 CE LYS A 84 13.984 34.050 38.249 1.00 0.00 C ATOM 1367 NZ LYS A 84 14.608 34.456 36.969 1.00 0.00 N ATOM 0 H LYS A 84 18.868 29.741 40.795 1.00 0.00 H new ATOM 0 HA LYS A 84 18.571 31.834 38.907 1.00 0.00 H new ATOM 0 HB2 LYS A 84 16.279 30.696 38.912 1.00 0.00 H new ATOM 0 HB3 LYS A 84 16.119 31.234 40.572 1.00 0.00 H new ATOM 0 HG2 LYS A 84 16.244 33.573 39.900 1.00 0.00 H new ATOM 0 HG3 LYS A 84 16.647 33.133 38.253 1.00 0.00 H new ATOM 0 HD2 LYS A 84 14.443 31.968 38.041 1.00 0.00 H new ATOM 0 HD3 LYS A 84 14.041 32.454 39.676 1.00 0.00 H new ATOM 0 HE2 LYS A 84 12.911 33.919 38.106 1.00 0.00 H new ATOM 0 HE3 LYS A 84 14.113 34.843 38.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 14.127 35.302 36.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 15.614 34.670 37.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 14.522 33.682 36.280 1.00 0.00 H new ATOM 1381 N ARG A 85 19.869 32.445 41.074 1.00 0.00 N ATOM 1382 CA ARG A 85 20.480 33.107 42.185 1.00 0.00 C ATOM 1383 C ARG A 85 20.231 34.609 42.214 1.00 0.00 C ATOM 1384 O ARG A 85 19.801 35.144 43.270 1.00 0.00 O ATOM 1385 CB ARG A 85 21.995 32.846 42.206 1.00 0.00 C ATOM 1386 CG ARG A 85 22.501 32.144 43.467 1.00 0.00 C ATOM 1387 CD ARG A 85 22.172 32.870 44.773 1.00 0.00 C ATOM 1388 NE ARG A 85 22.928 32.180 45.855 1.00 0.00 N ATOM 1389 CZ ARG A 85 23.905 32.756 46.614 1.00 0.00 C ATOM 1390 NH1 ARG A 85 24.375 34.017 46.382 1.00 0.00 N ATOM 1391 NH2 ARG A 85 24.434 32.015 47.631 1.00 0.00 N ATOM 1392 OXT ARG A 85 20.461 35.297 41.184 1.00 0.00 O ATOM 0 H ARG A 85 20.532 32.211 40.335 1.00 0.00 H new ATOM 0 HA ARG A 85 20.009 32.685 43.073 1.00 0.00 H new ATOM 0 HB2 ARG A 85 22.259 32.241 41.338 1.00 0.00 H new ATOM 0 HB3 ARG A 85 22.516 33.798 42.101 1.00 0.00 H new ATOM 0 HG2 ARG A 85 22.074 31.142 43.506 1.00 0.00 H new ATOM 0 HG3 ARG A 85 23.582 32.027 43.393 1.00 0.00 H new ATOM 0 HD2 ARG A 85 22.456 33.921 44.713 1.00 0.00 H new ATOM 0 HD3 ARG A 85 21.101 32.841 44.972 1.00 0.00 H new ATOM 0 HE ARG A 85 22.698 31.204 46.043 1.00 0.00 H new ATOM 0 HH11 ARG A 85 23.994 34.570 45.614 1.00 0.00 H new ATOM 0 HH12 ARG A 85 25.107 34.406 46.977 1.00 0.00 H new ATOM 0 HH21 ARG A 85 24.097 31.067 47.800 1.00 0.00 H new ATOM 0 HH22 ARG A 85 25.166 32.409 48.222 1.00 0.00 H new TER 1406 ARG A 85 ATOM 1407 N VAL B 198 24.330 44.179 33.725 1.00 0.00 N ATOM 1408 CA VAL B 198 25.642 44.076 34.402 1.00 0.00 C ATOM 1409 C VAL B 198 25.744 42.899 35.310 1.00 0.00 C ATOM 1410 O VAL B 198 25.401 42.953 36.490 1.00 0.00 O ATOM 1411 CB VAL B 198 25.974 45.401 35.022 1.00 0.00 C ATOM 1412 CG1 VAL B 198 24.921 45.913 36.021 1.00 0.00 C ATOM 1413 CG2 VAL B 198 27.375 45.406 35.655 1.00 0.00 C ATOM 0 HA VAL B 198 26.418 43.864 33.667 1.00 0.00 H new ATOM 0 HB VAL B 198 25.967 46.105 34.190 1.00 0.00 H new ATOM 0 HG11 VAL B 198 25.238 46.875 36.423 1.00 0.00 H new ATOM 0 HG12 VAL B 198 23.964 46.029 35.513 1.00 0.00 H new ATOM 0 HG13 VAL B 198 24.814 45.197 36.836 1.00 0.00 H new ATOM 0 HG21 VAL B 198 27.573 46.385 36.092 1.00 0.00 H new ATOM 0 HG22 VAL B 198 27.425 44.644 36.433 1.00 0.00 H new ATOM 0 HG23 VAL B 198 28.121 45.192 34.889 1.00 0.00 H new ATOM 1425 N ARG B 199 26.193 41.739 34.798 1.00 0.00 N ATOM 1426 CA ARG B 199 26.452 40.572 35.583 1.00 0.00 C ATOM 1427 C ARG B 199 27.657 39.878 35.047 1.00 0.00 C ATOM 1428 O ARG B 199 28.342 40.386 34.160 1.00 0.00 O ATOM 1429 CB ARG B 199 25.287 39.568 35.574 1.00 0.00 C ATOM 1430 CG ARG B 199 23.973 40.084 36.165 1.00 0.00 C ATOM 1431 CD ARG B 199 22.982 38.954 36.448 1.00 0.00 C ATOM 1432 NE ARG B 199 21.702 39.574 36.893 1.00 0.00 N ATOM 1433 CZ ARG B 199 21.229 39.528 38.172 1.00 0.00 C ATOM 1434 NH1 ARG B 199 22.019 39.241 39.249 1.00 0.00 N ATOM 1435 NH2 ARG B 199 19.901 39.752 38.394 1.00 0.00 N ATOM 0 H ARG B 199 26.382 41.609 33.804 1.00 0.00 H new ATOM 0 HA ARG B 199 26.598 40.911 36.609 1.00 0.00 H new ATOM 0 HB2 ARG B 199 25.106 39.256 34.545 1.00 0.00 H new ATOM 0 HB3 ARG B 199 25.591 38.679 36.127 1.00 0.00 H new ATOM 0 HG2 ARG B 199 24.180 40.623 37.089 1.00 0.00 H new ATOM 0 HG3 ARG B 199 23.521 40.796 35.475 1.00 0.00 H new ATOM 0 HD2 ARG B 199 22.824 38.351 35.554 1.00 0.00 H new ATOM 0 HD3 ARG B 199 23.372 38.287 37.217 1.00 0.00 H new ATOM 0 HE ARG B 199 21.143 40.065 36.196 1.00 0.00 H new ATOM 0 HH11 ARG B 199 23.012 39.049 39.116 1.00 0.00 H new ATOM 0 HH12 ARG B 199 21.616 39.219 40.186 1.00 0.00 H new ATOM 0 HH21 ARG B 199 19.279 39.950 37.610 1.00 0.00 H new ATOM 0 HH22 ARG B 199 19.530 39.721 39.344 1.00 0.00 H new ATOM 1449 N MET B 200 27.959 38.661 35.533 1.00 0.00 N ATOM 1450 CA MET B 200 28.909 37.771 34.941 1.00 0.00 C ATOM 1451 C MET B 200 28.400 37.148 33.687 1.00 0.00 C ATOM 1452 O MET B 200 28.318 37.794 32.643 1.00 0.00 O ATOM 1453 CB MET B 200 29.368 36.684 35.928 1.00 0.00 C ATOM 1454 CG MET B 200 30.295 37.167 37.045 1.00 0.00 C ATOM 1455 SD MET B 200 30.732 35.794 38.153 1.00 0.00 S ATOM 1456 CE MET B 200 32.535 35.998 38.243 1.00 0.00 C ATOM 0 H MET B 200 27.523 38.281 36.373 1.00 0.00 H new ATOM 0 HA MET B 200 29.772 38.384 34.680 1.00 0.00 H new ATOM 0 HB2 MET B 200 28.486 36.231 36.380 1.00 0.00 H new ATOM 0 HB3 MET B 200 29.878 35.900 35.368 1.00 0.00 H new ATOM 0 HG2 MET B 200 31.200 37.596 36.614 1.00 0.00 H new ATOM 0 HG3 MET B 200 29.807 37.959 37.613 1.00 0.00 H new ATOM 0 HE1 MET B 200 33.021 35.056 37.990 1.00 0.00 H new ATOM 0 HE2 MET B 200 32.850 36.769 37.539 1.00 0.00 H new ATOM 0 HE3 MET B 200 32.818 36.292 39.254 1.00 0.00 H new ATOM 1466 N ASN B 201 28.063 35.847 33.734 1.00 0.00 N ATOM 1467 CA ASN B 201 27.762 34.979 32.637 1.00 0.00 C ATOM 1468 C ASN B 201 28.992 34.652 31.864 1.00 0.00 C ATOM 1469 O ASN B 201 30.081 35.129 32.179 1.00 0.00 O ATOM 1470 CB ASN B 201 26.601 35.448 31.744 1.00 0.00 C ATOM 1471 CG ASN B 201 25.413 35.909 32.577 1.00 0.00 C ATOM 1472 OD1 ASN B 201 25.067 35.321 33.601 1.00 0.00 O ATOM 1473 ND2 ASN B 201 24.749 37.003 32.118 1.00 0.00 N ATOM 0 H ASN B 201 27.995 35.358 34.626 1.00 0.00 H new ATOM 0 HA ASN B 201 27.387 34.057 33.081 1.00 0.00 H new ATOM 0 HB2 ASN B 201 26.938 36.264 31.105 1.00 0.00 H new ATOM 0 HB3 ASN B 201 26.293 34.635 31.087 1.00 0.00 H new ATOM 0 HD21 ASN B 201 23.939 37.358 32.626 1.00 0.00 H new ATOM 0 HD22 ASN B 201 25.061 37.468 31.266 1.00 0.00 H new ATOM 1480 N ILE B 202 28.922 33.817 30.812 1.00 0.00 N ATOM 1481 CA ILE B 202 30.055 33.487 30.004 1.00 0.00 C ATOM 1482 C ILE B 202 30.478 34.582 29.086 1.00 0.00 C ATOM 1483 O ILE B 202 31.629 34.652 28.658 1.00 0.00 O ATOM 1484 CB ILE B 202 29.890 32.140 29.365 1.00 0.00 C ATOM 1485 CG1 ILE B 202 30.368 31.110 30.403 1.00 0.00 C ATOM 1486 CG2 ILE B 202 30.623 31.996 28.021 1.00 0.00 C ATOM 1487 CD1 ILE B 202 30.251 29.643 29.995 1.00 0.00 C ATOM 0 H ILE B 202 28.059 33.361 30.516 1.00 0.00 H new ATOM 0 HA ILE B 202 30.915 33.393 30.667 1.00 0.00 H new ATOM 0 HB ILE B 202 28.844 31.983 29.101 1.00 0.00 H new ATOM 0 HG12 ILE B 202 31.412 31.319 30.638 1.00 0.00 H new ATOM 0 HG13 ILE B 202 29.799 31.258 31.321 1.00 0.00 H new ATOM 0 HG21 ILE B 202 30.457 30.996 27.621 1.00 0.00 H new ATOM 0 HG22 ILE B 202 30.242 32.736 27.317 1.00 0.00 H new ATOM 0 HG23 ILE B 202 31.691 32.154 28.170 1.00 0.00 H new ATOM 0 HD11 ILE B 202 30.617 29.010 30.804 1.00 0.00 H new ATOM 0 HD12 ILE B 202 29.207 29.404 29.791 1.00 0.00 H new ATOM 0 HD13 ILE B 202 30.845 29.466 29.099 1.00 0.00 H new ATOM 1499 N GLN B 203 29.588 35.545 28.789 1.00 0.00 N ATOM 1500 CA GLN B 203 29.852 36.696 27.982 1.00 0.00 C ATOM 1501 C GLN B 203 31.042 37.517 28.342 1.00 0.00 C ATOM 1502 O GLN B 203 31.646 38.179 27.500 1.00 0.00 O ATOM 1503 CB GLN B 203 28.607 37.600 27.973 1.00 0.00 C ATOM 1504 CG GLN B 203 28.307 38.293 29.304 1.00 0.00 C ATOM 1505 CD GLN B 203 27.079 39.191 29.244 1.00 0.00 C ATOM 1506 OE1 GLN B 203 26.066 38.955 29.900 1.00 0.00 O ATOM 1507 NE2 GLN B 203 27.198 40.304 28.473 1.00 0.00 N ATOM 0 H GLN B 203 28.628 35.518 29.132 1.00 0.00 H new ATOM 0 HA GLN B 203 30.091 36.286 27.001 1.00 0.00 H new ATOM 0 HB2 GLN B 203 28.734 38.362 27.204 1.00 0.00 H new ATOM 0 HB3 GLN B 203 27.742 37.001 27.689 1.00 0.00 H new ATOM 0 HG2 GLN B 203 28.160 37.537 30.076 1.00 0.00 H new ATOM 0 HG3 GLN B 203 29.171 38.888 29.600 1.00 0.00 H new ATOM 0 HE21 GLN B 203 28.053 40.467 27.942 1.00 0.00 H new ATOM 0 HE22 GLN B 203 26.432 40.976 28.425 1.00 0.00 H new ATOM 1516 N MET B 204 31.437 37.504 29.629 1.00 0.00 N ATOM 1517 CA MET B 204 32.556 38.206 30.174 1.00 0.00 C ATOM 1518 C MET B 204 33.878 37.645 29.778 1.00 0.00 C ATOM 1519 O MET B 204 34.841 38.394 29.615 1.00 0.00 O ATOM 1520 CB MET B 204 32.446 38.249 31.708 1.00 0.00 C ATOM 1521 CG MET B 204 31.278 39.111 32.189 1.00 0.00 C ATOM 1522 SD MET B 204 31.567 40.901 32.053 1.00 0.00 S ATOM 1523 CE MET B 204 31.870 41.054 33.837 1.00 0.00 C ATOM 0 H MET B 204 30.938 36.964 30.336 1.00 0.00 H new ATOM 0 HA MET B 204 32.517 39.212 29.755 1.00 0.00 H new ATOM 0 HB2 MET B 204 32.325 37.235 32.089 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.375 38.637 32.125 1.00 0.00 H new ATOM 0 HG2 MET B 204 30.389 38.853 31.613 1.00 0.00 H new ATOM 0 HG3 MET B 204 31.065 38.867 33.230 1.00 0.00 H new ATOM 0 HE1 MET B 204 32.209 42.065 34.063 1.00 0.00 H new ATOM 0 HE2 MET B 204 30.948 40.850 34.381 1.00 0.00 H new ATOM 0 HE3 MET B 204 32.635 40.339 34.139 1.00 0.00 H new ATOM 1533 N LEU B 205 33.995 36.325 29.549 1.00 0.00 N ATOM 1534 CA LEU B 205 35.193 35.689 29.095 1.00 0.00 C ATOM 1535 C LEU B 205 35.727 36.221 27.809 1.00 0.00 C ATOM 1536 O LEU B 205 36.935 36.361 27.619 1.00 0.00 O ATOM 1537 CB LEU B 205 35.064 34.161 28.977 1.00 0.00 C ATOM 1538 CG LEU B 205 35.297 33.377 30.279 1.00 0.00 C ATOM 1539 CD1 LEU B 205 35.099 31.868 30.058 1.00 0.00 C ATOM 1540 CD2 LEU B 205 36.710 33.628 30.827 1.00 0.00 C ATOM 0 H LEU B 205 33.222 35.673 29.686 1.00 0.00 H new ATOM 0 HA LEU B 205 35.906 35.932 29.883 1.00 0.00 H new ATOM 0 HB2 LEU B 205 34.067 33.925 28.604 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.775 33.810 28.229 1.00 0.00 H new ATOM 0 HG LEU B 205 34.564 33.730 31.005 1.00 0.00 H new ATOM 0 HD11 LEU B 205 35.270 31.338 30.995 1.00 0.00 H new ATOM 0 HD12 LEU B 205 34.081 31.681 29.715 1.00 0.00 H new ATOM 0 HD13 LEU B 205 35.805 31.515 29.307 1.00 0.00 H new ATOM 0 HD21 LEU B 205 36.849 33.062 31.748 1.00 0.00 H new ATOM 0 HD22 LEU B 205 37.448 33.309 30.091 1.00 0.00 H new ATOM 0 HD23 LEU B 205 36.837 34.691 31.032 1.00 0.00 H new ATOM 1552 N LEU B 206 34.822 36.574 26.880 1.00 0.00 N ATOM 1553 CA LEU B 206 35.191 36.936 25.546 1.00 0.00 C ATOM 1554 C LEU B 206 35.638 38.357 25.526 1.00 0.00 C ATOM 1555 O LEU B 206 36.337 38.815 24.623 1.00 0.00 O ATOM 1556 CB LEU B 206 34.061 36.547 24.579 1.00 0.00 C ATOM 1557 CG LEU B 206 33.415 35.195 24.924 1.00 0.00 C ATOM 1558 CD1 LEU B 206 32.479 34.700 23.808 1.00 0.00 C ATOM 1559 CD2 LEU B 206 34.399 34.064 25.268 1.00 0.00 C ATOM 0 H LEU B 206 33.818 36.609 27.057 1.00 0.00 H new ATOM 0 HA LEU B 206 36.055 36.378 25.185 1.00 0.00 H new ATOM 0 HB2 LEU B 206 33.296 37.323 24.592 1.00 0.00 H new ATOM 0 HB3 LEU B 206 34.456 36.506 23.564 1.00 0.00 H new ATOM 0 HG LEU B 206 32.852 35.417 25.830 1.00 0.00 H new ATOM 0 HD11 LEU B 206 32.045 33.742 24.095 1.00 0.00 H new ATOM 0 HD12 LEU B 206 31.682 35.427 23.652 1.00 0.00 H new ATOM 0 HD13 LEU B 206 33.046 34.580 22.885 1.00 0.00 H new ATOM 0 HD21 LEU B 206 33.843 33.155 25.496 1.00 0.00 H new ATOM 0 HD22 LEU B 206 35.057 33.884 24.418 1.00 0.00 H new ATOM 0 HD23 LEU B 206 34.995 34.351 26.134 1.00 0.00 H new ATOM 1571 N GLU B 207 35.271 39.108 26.580 1.00 0.00 N ATOM 1572 CA GLU B 207 35.748 40.434 26.822 1.00 0.00 C ATOM 1573 C GLU B 207 37.081 40.396 27.487 1.00 0.00 C ATOM 1574 O GLU B 207 38.033 41.045 27.057 1.00 0.00 O ATOM 1575 CB GLU B 207 34.753 41.277 27.637 1.00 0.00 C ATOM 1576 CG GLU B 207 33.325 41.218 27.091 1.00 0.00 C ATOM 1577 CD GLU B 207 32.636 42.574 27.062 1.00 0.00 C ATOM 1578 OE1 GLU B 207 33.110 43.453 26.291 1.00 0.00 O ATOM 1579 OE2 GLU B 207 31.603 42.775 27.754 1.00 0.00 O ATOM 0 H GLU B 207 34.617 38.779 27.290 1.00 0.00 H new ATOM 0 HA GLU B 207 35.851 40.920 25.852 1.00 0.00 H new ATOM 0 HB2 GLU B 207 34.755 40.931 28.671 1.00 0.00 H new ATOM 0 HB3 GLU B 207 35.089 42.314 27.648 1.00 0.00 H new ATOM 0 HG2 GLU B 207 33.346 40.807 26.082 1.00 0.00 H new ATOM 0 HG3 GLU B 207 32.738 40.533 27.702 1.00 0.00 H new ATOM 1586 N ALA B 208 37.208 39.592 28.558 1.00 0.00 N ATOM 1587 CA ALA B 208 38.401 39.371 29.315 1.00 0.00 C ATOM 1588 C ALA B 208 39.555 38.863 28.522 1.00 0.00 C ATOM 1589 O ALA B 208 40.674 39.356 28.664 1.00 0.00 O ATOM 1590 CB ALA B 208 38.091 38.402 30.469 1.00 0.00 C ATOM 0 H ALA B 208 36.418 39.058 28.920 1.00 0.00 H new ATOM 0 HA ALA B 208 38.713 40.347 29.687 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.996 38.228 31.051 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.324 38.835 31.111 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.733 37.456 30.063 1.00 0.00 H new ATOM 1596 N ALA B 209 39.330 37.894 27.619 1.00 0.00 N ATOM 1597 CA ALA B 209 40.303 37.399 26.695 1.00 0.00 C ATOM 1598 C ALA B 209 40.817 38.430 25.749 1.00 0.00 C ATOM 1599 O ALA B 209 42.024 38.530 25.539 1.00 0.00 O ATOM 1600 CB ALA B 209 39.728 36.195 25.932 1.00 0.00 C ATOM 0 H ALA B 209 38.425 37.432 27.528 1.00 0.00 H new ATOM 0 HA ALA B 209 41.166 37.090 27.285 1.00 0.00 H new ATOM 0 HB1 ALA B 209 40.472 35.821 25.229 1.00 0.00 H new ATOM 0 HB2 ALA B 209 39.468 35.407 26.639 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.836 36.502 25.386 1.00 0.00 H new ATOM 1606 N ASP B 210 39.946 39.280 25.177 1.00 0.00 N ATOM 1607 CA ASP B 210 40.307 40.343 24.291 1.00 0.00 C ATOM 1608 C ASP B 210 41.084 41.414 24.977 1.00 0.00 C ATOM 1609 O ASP B 210 42.119 41.862 24.487 1.00 0.00 O ATOM 1610 CB ASP B 210 39.014 40.904 23.674 1.00 0.00 C ATOM 1611 CG ASP B 210 39.297 41.589 22.345 1.00 0.00 C ATOM 1612 OD1 ASP B 210 39.708 40.861 21.401 1.00 0.00 O ATOM 1613 OD2 ASP B 210 39.097 42.826 22.209 1.00 0.00 O ATOM 0 H ASP B 210 38.941 39.223 25.340 1.00 0.00 H new ATOM 0 HA ASP B 210 40.963 39.953 23.512 1.00 0.00 H new ATOM 0 HB2 ASP B 210 38.297 40.096 23.526 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.556 41.614 24.363 1.00 0.00 H new ATOM 1618 N TYR B 211 40.652 41.822 26.183 1.00 0.00 N ATOM 1619 CA TYR B 211 41.334 42.696 27.086 1.00 0.00 C ATOM 1620 C TYR B 211 42.719 42.246 27.405 1.00 0.00 C ATOM 1621 O TYR B 211 43.682 42.994 27.241 1.00 0.00 O ATOM 1622 CB TYR B 211 40.450 42.836 28.337 1.00 0.00 C ATOM 1623 CG TYR B 211 41.082 43.490 29.517 1.00 0.00 C ATOM 1624 CD1 TYR B 211 41.156 44.859 29.627 1.00 0.00 C ATOM 1625 CD2 TYR B 211 41.578 42.705 30.531 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.703 45.436 30.748 1.00 0.00 C ATOM 1627 CE2 TYR B 211 42.095 43.278 31.670 1.00 0.00 C ATOM 1628 CZ TYR B 211 42.158 44.647 31.779 1.00 0.00 C ATOM 1629 OH TYR B 211 42.680 45.252 32.942 1.00 0.00 O ATOM 0 H TYR B 211 39.753 41.515 26.555 1.00 0.00 H new ATOM 0 HA TYR B 211 41.479 43.669 26.617 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.560 43.404 28.066 1.00 0.00 H new ATOM 0 HB3 TYR B 211 40.116 41.842 28.634 1.00 0.00 H new ATOM 0 HD1 TYR B 211 40.783 45.483 28.829 1.00 0.00 H new ATOM 0 HD2 TYR B 211 41.562 41.630 30.433 1.00 0.00 H new ATOM 0 HE1 TYR B 211 41.776 46.511 30.820 1.00 0.00 H new ATOM 0 HE2 TYR B 211 42.450 42.654 32.477 1.00 0.00 H new ATOM 0 HH TYR B 211 42.957 44.558 33.576 1.00 0.00 H new ATOM 1639 N LEU B 212 42.905 40.990 27.848 1.00 0.00 N ATOM 1640 CA LEU B 212 44.192 40.464 28.184 1.00 0.00 C ATOM 1641 C LEU B 212 45.100 40.270 27.019 1.00 0.00 C ATOM 1642 O LEU B 212 46.323 40.317 27.147 1.00 0.00 O ATOM 1643 CB LEU B 212 44.045 39.145 28.963 1.00 0.00 C ATOM 1644 CG LEU B 212 44.140 39.306 30.489 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.745 37.959 31.116 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.528 39.765 30.966 1.00 0.00 C ATOM 0 H LEU B 212 42.143 40.324 27.976 1.00 0.00 H new ATOM 0 HA LEU B 212 44.664 41.222 28.809 1.00 0.00 H new ATOM 0 HB2 LEU B 212 43.084 38.693 28.715 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.818 38.452 28.632 1.00 0.00 H new ATOM 0 HG LEU B 212 43.462 40.098 30.808 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.800 38.033 32.202 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.727 37.705 30.821 1.00 0.00 H new ATOM 0 HD13 LEU B 212 44.427 37.183 30.770 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.527 39.859 32.052 1.00 0.00 H new ATOM 0 HD22 LEU B 212 46.277 39.032 30.666 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.766 40.730 30.519 1.00 0.00 H new ATOM 1658 N GLU B 213 44.540 40.094 25.809 1.00 0.00 N ATOM 1659 CA GLU B 213 45.247 40.058 24.566 1.00 0.00 C ATOM 1660 C GLU B 213 45.760 41.402 24.183 1.00 0.00 C ATOM 1661 O GLU B 213 46.934 41.565 23.850 1.00 0.00 O ATOM 1662 CB GLU B 213 44.300 39.403 23.547 1.00 0.00 C ATOM 1663 CG GLU B 213 44.615 39.651 22.071 1.00 0.00 C ATOM 1664 CD GLU B 213 43.922 38.662 21.145 1.00 0.00 C ATOM 1665 OE1 GLU B 213 43.962 37.431 21.410 1.00 0.00 O ATOM 1666 OE2 GLU B 213 43.354 39.107 20.112 1.00 0.00 O ATOM 0 H GLU B 213 43.534 39.970 25.692 1.00 0.00 H new ATOM 0 HA GLU B 213 46.157 39.461 24.627 1.00 0.00 H new ATOM 0 HB2 GLU B 213 44.302 38.327 23.721 1.00 0.00 H new ATOM 0 HB3 GLU B 213 43.288 39.756 23.745 1.00 0.00 H new ATOM 0 HG2 GLU B 213 44.312 40.664 21.805 1.00 0.00 H new ATOM 0 HG3 GLU B 213 45.693 39.590 21.919 1.00 0.00 H new ATOM 1673 N ARG B 214 44.919 42.446 24.293 1.00 0.00 N ATOM 1674 CA ARG B 214 45.240 43.830 24.131 1.00 0.00 C ATOM 1675 C ARG B 214 46.276 44.344 25.071 1.00 0.00 C ATOM 1676 O ARG B 214 47.135 45.144 24.705 1.00 0.00 O ATOM 1677 CB ARG B 214 43.925 44.612 24.285 1.00 0.00 C ATOM 1678 CG ARG B 214 43.939 45.986 23.613 1.00 0.00 C ATOM 1679 CD ARG B 214 42.578 46.683 23.689 1.00 0.00 C ATOM 1680 NE ARG B 214 42.676 47.966 22.938 1.00 0.00 N ATOM 1681 CZ ARG B 214 42.844 49.188 23.522 1.00 0.00 C ATOM 1682 NH1 ARG B 214 43.146 49.328 24.846 1.00 0.00 N ATOM 1683 NH2 ARG B 214 42.692 50.317 22.769 1.00 0.00 N ATOM 0 H ARG B 214 43.933 42.308 24.514 1.00 0.00 H new ATOM 0 HA ARG B 214 45.688 43.963 23.147 1.00 0.00 H new ATOM 0 HB2 ARG B 214 43.111 44.021 23.865 1.00 0.00 H new ATOM 0 HB3 ARG B 214 43.712 44.740 25.346 1.00 0.00 H new ATOM 0 HG2 ARG B 214 44.693 46.613 24.089 1.00 0.00 H new ATOM 0 HG3 ARG B 214 44.230 45.874 22.568 1.00 0.00 H new ATOM 0 HD2 ARG B 214 41.801 46.049 23.261 1.00 0.00 H new ATOM 0 HD3 ARG B 214 42.302 46.869 24.727 1.00 0.00 H new ATOM 0 HE ARG B 214 42.613 47.929 21.921 1.00 0.00 H new ATOM 0 HH11 ARG B 214 43.254 48.502 25.435 1.00 0.00 H new ATOM 0 HH12 ARG B 214 43.264 50.259 25.247 1.00 0.00 H new ATOM 0 HH21 ARG B 214 42.455 50.242 21.780 1.00 0.00 H new ATOM 0 HH22 ARG B 214 42.815 51.235 23.196 1.00 0.00 H new ATOM 1697 N ARG B 215 46.284 43.852 26.324 1.00 0.00 N ATOM 1698 CA ARG B 215 47.253 44.131 27.338 1.00 0.00 C ATOM 1699 C ARG B 215 48.671 43.897 26.946 1.00 0.00 C ATOM 1700 O ARG B 215 49.569 44.632 27.355 1.00 0.00 O ATOM 1701 CB ARG B 215 46.966 43.363 28.639 1.00 0.00 C ATOM 1702 CG ARG B 215 45.926 44.011 29.555 1.00 0.00 C ATOM 1703 CD ARG B 215 46.351 45.333 30.199 1.00 0.00 C ATOM 1704 NE ARG B 215 47.583 45.065 30.992 1.00 0.00 N ATOM 1705 CZ ARG B 215 48.650 45.909 31.103 1.00 0.00 C ATOM 1706 NH1 ARG B 215 48.655 47.170 30.582 1.00 0.00 N ATOM 1707 NH2 ARG B 215 49.758 45.456 31.759 1.00 0.00 N ATOM 0 H ARG B 215 45.559 43.213 26.650 1.00 0.00 H new ATOM 0 HA ARG B 215 47.143 45.204 27.497 1.00 0.00 H new ATOM 0 HB2 ARG B 215 46.628 42.359 28.384 1.00 0.00 H new ATOM 0 HB3 ARG B 215 47.899 43.254 29.193 1.00 0.00 H new ATOM 0 HG2 ARG B 215 45.016 44.183 28.979 1.00 0.00 H new ATOM 0 HG3 ARG B 215 45.674 43.305 30.347 1.00 0.00 H new ATOM 0 HD2 ARG B 215 46.542 46.088 29.436 1.00 0.00 H new ATOM 0 HD3 ARG B 215 45.559 45.720 30.840 1.00 0.00 H new ATOM 0 HE ARG B 215 47.633 44.178 31.493 1.00 0.00 H new ATOM 0 HH11 ARG B 215 47.836 47.519 30.083 1.00 0.00 H new ATOM 0 HH12 ARG B 215 49.477 47.764 30.691 1.00 0.00 H new ATOM 0 HH21 ARG B 215 49.771 44.513 32.148 1.00 0.00 H new ATOM 0 HH22 ARG B 215 50.573 46.060 31.860 1.00 0.00 H new ATOM 1721 N GLU B 216 48.940 42.886 26.101 1.00 0.00 N ATOM 1722 CA GLU B 216 50.254 42.560 25.642 1.00 0.00 C ATOM 1723 C GLU B 216 50.849 43.571 24.722 1.00 0.00 C ATOM 1724 O GLU B 216 52.061 43.781 24.703 1.00 0.00 O ATOM 1725 CB GLU B 216 50.259 41.177 24.970 1.00 0.00 C ATOM 1726 CG GLU B 216 49.685 40.092 25.883 1.00 0.00 C ATOM 1727 CD GLU B 216 49.935 38.686 25.356 1.00 0.00 C ATOM 1728 OE1 GLU B 216 51.085 38.189 25.493 1.00 0.00 O ATOM 1729 OE2 GLU B 216 48.979 38.057 24.828 1.00 0.00 O ATOM 0 H GLU B 216 48.217 42.274 25.724 1.00 0.00 H new ATOM 0 HA GLU B 216 50.882 42.552 26.533 1.00 0.00 H new ATOM 0 HB2 GLU B 216 49.678 41.220 24.049 1.00 0.00 H new ATOM 0 HB3 GLU B 216 51.279 40.913 24.691 1.00 0.00 H new ATOM 0 HG2 GLU B 216 50.126 40.187 26.875 1.00 0.00 H new ATOM 0 HG3 GLU B 216 48.612 40.248 25.995 1.00 0.00 H new ATOM 1736 N ARG B 217 50.009 44.282 23.948 1.00 0.00 N ATOM 1737 CA ARG B 217 50.380 45.387 23.121 1.00 0.00 C ATOM 1738 C ARG B 217 50.508 46.625 23.941 1.00 0.00 C ATOM 1739 O ARG B 217 51.413 47.437 23.753 1.00 0.00 O ATOM 1740 CB ARG B 217 49.289 45.524 22.044 1.00 0.00 C ATOM 1741 CG ARG B 217 49.279 46.822 21.234 1.00 0.00 C ATOM 1742 CD ARG B 217 50.452 47.013 20.270 1.00 0.00 C ATOM 1743 NE ARG B 217 50.487 48.439 19.840 1.00 0.00 N ATOM 1744 CZ ARG B 217 49.554 49.055 19.056 1.00 0.00 C ATOM 1745 NH1 ARG B 217 48.532 48.376 18.458 1.00 0.00 N ATOM 1746 NH2 ARG B 217 49.627 50.404 18.867 1.00 0.00 N ATOM 0 H ARG B 217 49.012 44.072 23.898 1.00 0.00 H new ATOM 0 HA ARG B 217 51.350 45.226 22.650 1.00 0.00 H new ATOM 0 HB2 ARG B 217 49.391 44.691 21.349 1.00 0.00 H new ATOM 0 HB3 ARG B 217 48.318 45.418 22.528 1.00 0.00 H new ATOM 0 HG2 ARG B 217 48.352 46.864 20.662 1.00 0.00 H new ATOM 0 HG3 ARG B 217 49.263 47.662 21.929 1.00 0.00 H new ATOM 0 HD2 ARG B 217 51.389 46.741 20.756 1.00 0.00 H new ATOM 0 HD3 ARG B 217 50.341 46.360 19.405 1.00 0.00 H new ATOM 0 HE ARG B 217 51.275 49.003 20.158 1.00 0.00 H new ATOM 0 HH11 ARG B 217 48.444 47.368 18.589 1.00 0.00 H new ATOM 0 HH12 ARG B 217 47.857 48.876 17.880 1.00 0.00 H new ATOM 0 HH21 ARG B 217 50.373 50.941 19.309 1.00 0.00 H new ATOM 0 HH22 ARG B 217 48.936 50.875 18.283 1.00 0.00 H new ATOM 1760 N GLU B 218 49.606 46.821 24.919 1.00 0.00 N ATOM 1761 CA GLU B 218 49.606 47.907 25.850 1.00 0.00 C ATOM 1762 C GLU B 218 50.843 48.028 26.673 1.00 0.00 C ATOM 1763 O GLU B 218 51.427 49.105 26.783 1.00 0.00 O ATOM 1764 CB GLU B 218 48.370 47.774 26.755 1.00 0.00 C ATOM 1765 CG GLU B 218 47.969 49.125 27.350 1.00 0.00 C ATOM 1766 CD GLU B 218 46.691 49.038 28.173 1.00 0.00 C ATOM 1767 OE1 GLU B 218 46.740 48.543 29.330 1.00 0.00 O ATOM 1768 OE2 GLU B 218 45.616 49.463 27.671 1.00 0.00 O ATOM 0 H GLU B 218 48.827 46.180 25.069 1.00 0.00 H new ATOM 0 HA GLU B 218 49.575 48.824 25.262 1.00 0.00 H new ATOM 0 HB2 GLU B 218 47.538 47.366 26.181 1.00 0.00 H new ATOM 0 HB3 GLU B 218 48.579 47.068 27.559 1.00 0.00 H new ATOM 0 HG2 GLU B 218 48.778 49.497 27.978 1.00 0.00 H new ATOM 0 HG3 GLU B 218 47.832 49.847 26.545 1.00 0.00 H new ATOM 1775 N ALA B 219 51.316 46.905 27.240 1.00 0.00 N ATOM 1776 CA ALA B 219 52.481 46.764 28.058 1.00 0.00 C ATOM 1777 C ALA B 219 53.780 47.169 27.452 1.00 0.00 C ATOM 1778 O ALA B 219 54.752 47.425 28.161 1.00 0.00 O ATOM 1779 CB ALA B 219 52.572 45.305 28.535 1.00 0.00 C ATOM 0 H ALA B 219 50.837 46.013 27.113 1.00 0.00 H new ATOM 0 HA ALA B 219 52.338 47.471 28.875 1.00 0.00 H new ATOM 0 HB1 ALA B 219 53.456 45.181 29.160 1.00 0.00 H new ATOM 0 HB2 ALA B 219 51.682 45.054 29.112 1.00 0.00 H new ATOM 0 HB3 ALA B 219 52.643 44.644 27.671 1.00 0.00 H new ATOM 1785 N GLU B 220 53.856 47.257 26.111 1.00 0.00 N ATOM 1786 CA GLU B 220 55.020 47.683 25.399 1.00 0.00 C ATOM 1787 C GLU B 220 55.346 49.122 25.609 1.00 0.00 C ATOM 1788 O GLU B 220 56.512 49.510 25.652 1.00 0.00 O ATOM 1789 CB GLU B 220 54.872 47.493 23.880 1.00 0.00 C ATOM 1790 CG GLU B 220 54.572 46.069 23.411 1.00 0.00 C ATOM 1791 CD GLU B 220 54.709 45.976 21.898 1.00 0.00 C ATOM 1792 OE1 GLU B 220 54.046 46.770 21.179 1.00 0.00 O ATOM 1793 OE2 GLU B 220 55.516 45.142 21.409 1.00 0.00 O ATOM 0 H GLU B 220 53.075 47.022 25.499 1.00 0.00 H new ATOM 0 HA GLU B 220 55.817 47.057 25.800 1.00 0.00 H new ATOM 0 HB2 GLU B 220 54.074 48.147 23.528 1.00 0.00 H new ATOM 0 HB3 GLU B 220 55.792 47.827 23.400 1.00 0.00 H new ATOM 0 HG2 GLU B 220 55.257 45.369 23.889 1.00 0.00 H new ATOM 0 HG3 GLU B 220 53.563 45.784 23.711 1.00 0.00 H new ATOM 1800 N HIS B 221 54.310 49.969 25.732 1.00 0.00 N ATOM 1801 CA HIS B 221 54.434 51.390 25.824 1.00 0.00 C ATOM 1802 C HIS B 221 53.909 51.916 27.152 1.00 0.00 C ATOM 1803 O HIS B 221 54.285 51.370 28.224 1.00 0.00 O ATOM 1804 CB HIS B 221 53.738 52.075 24.635 1.00 0.00 C ATOM 1805 CG HIS B 221 52.300 51.683 24.461 1.00 0.00 C ATOM 1806 ND1 HIS B 221 51.861 50.749 23.559 1.00 0.00 N ATOM 1807 CD2 HIS B 221 51.196 52.149 25.103 1.00 0.00 C ATOM 1808 CE1 HIS B 221 50.546 50.656 23.642 1.00 0.00 C ATOM 1809 NE2 HIS B 221 50.120 51.491 24.570 1.00 0.00 N ATOM 1810 OXT HIS B 221 53.131 52.906 27.169 1.00 0.00 O ATOM 0 H HIS B 221 53.342 49.649 25.769 1.00 0.00 H new ATOM 0 HA HIS B 221 55.495 51.634 25.781 1.00 0.00 H new ATOM 0 HB2 HIS B 221 53.796 53.155 24.767 1.00 0.00 H new ATOM 0 HB3 HIS B 221 54.282 51.836 23.721 1.00 0.00 H new ATOM 0 HD2 HIS B 221 51.172 52.895 25.884 1.00 0.00 H new ATOM 0 HE1 HIS B 221 49.923 50.004 23.048 1.00 0.00 H new ATOM 0 HE2 HIS B 221 49.147 51.625 24.846 1.00 0.00 H new TER 1819 HIS B 221