USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1088 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 2 ASN : amide:sc= -0.638 X(o=-0.64,f=-1) USER MOD Set 1.2: B 4 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 13 THR OG1 : rot -76:sc= -0.507 USER MOD Set 2.2: A 14 SER OG : rot 180:sc= -0.134 USER MOD Single : A 2 ASN : amide:sc= -0.299 K(o=-0.3,f=-5.2!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 78:sc= 0.876 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 89:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -144:sc= 0.0395 (180deg=-0.622) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 49 ASN : amide:sc= -0.0447 K(o=-0.045,f=-1.4) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 171:sc= -0.154 (180deg=-0.17) USER MOD Single : B 1 MET N :NH3+ 155:sc= 0.0848 (180deg=0.00599) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.028) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 THR OG1 : rot 83:sc= 0.968 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot 92:sc= 0.00532 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= -0.0375 X(o=-0.038,f=0.27) USER MOD Single : B 49 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : B 75 LYS NZ :NH3+ -171:sc= 0.00439 (180deg=0.000189) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ASN A 2 -10.050 8.666 -1.854 1.00 0.00 N ATOM 20 CA ASN A 2 -9.298 9.662 -2.688 1.00 0.00 C ATOM 21 C ASN A 2 -8.000 10.223 -2.023 1.00 0.00 C ATOM 22 O ASN A 2 -7.062 10.557 -2.746 1.00 0.00 O ATOM 23 CB ASN A 2 -10.072 10.827 -3.352 1.00 0.00 C ATOM 24 CG ASN A 2 -11.008 11.660 -2.459 1.00 0.00 C ATOM 25 OD1 ASN A 2 -10.631 12.120 -1.389 1.00 0.00 O ATOM 26 ND2 ASN A 2 -12.246 11.853 -2.876 1.00 0.00 N ATOM 0 HA ASN A 2 -9.044 8.994 -3.511 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -9.343 11.504 -3.798 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -10.665 10.414 -4.168 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -12.899 12.390 -2.305 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -12.550 11.465 -3.769 1.00 0.00 H new ATOM 33 N LYS A 3 -8.006 10.316 -0.682 1.00 0.00 N ATOM 34 CA LYS A 3 -6.946 10.869 0.233 1.00 0.00 C ATOM 35 C LYS A 3 -7.560 11.859 1.286 1.00 0.00 C ATOM 36 O LYS A 3 -7.016 12.018 2.380 1.00 0.00 O ATOM 37 CB LYS A 3 -5.622 11.418 -0.379 1.00 0.00 C ATOM 38 CG LYS A 3 -4.440 11.539 0.613 1.00 0.00 C ATOM 39 CD LYS A 3 -3.066 11.719 -0.061 1.00 0.00 C ATOM 40 CE LYS A 3 -1.915 11.739 0.964 1.00 0.00 C ATOM 41 NZ LYS A 3 -0.603 11.876 0.309 1.00 0.00 N ATOM 0 H LYS A 3 -8.810 9.984 -0.149 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.584 9.963 0.719 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -5.322 10.766 -1.200 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.818 12.401 -0.808 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.621 12.386 1.275 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.412 10.646 1.238 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.903 10.910 -0.773 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -3.061 12.649 -0.629 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -2.062 12.565 1.660 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -1.934 10.821 1.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.146 11.886 1.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.452 11.075 -0.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.575 12.765 -0.230 1.00 0.00 H new ATOM 54 N THR A 4 -8.665 12.537 0.943 1.00 0.00 N ATOM 55 CA THR A 4 -9.493 13.375 1.793 1.00 0.00 C ATOM 56 C THR A 4 -10.664 12.554 2.422 1.00 0.00 C ATOM 57 O THR A 4 -11.045 12.865 3.554 1.00 0.00 O ATOM 58 CB THR A 4 -9.947 14.490 0.832 1.00 0.00 C ATOM 59 OG1 THR A 4 -8.856 15.327 0.446 1.00 0.00 O ATOM 60 CG2 THR A 4 -10.995 15.350 1.479 1.00 0.00 C ATOM 0 H THR A 4 -9.022 12.505 -0.012 1.00 0.00 H new ATOM 0 HA THR A 4 -8.981 13.784 2.664 1.00 0.00 H new ATOM 0 HB THR A 4 -10.354 14.000 -0.052 1.00 0.00 H new ATOM 0 HG1 THR A 4 -9.178 16.023 -0.165 1.00 0.00 H new ATOM 0 HG21 THR A 4 -11.303 16.132 0.785 1.00 0.00 H new ATOM 0 HG22 THR A 4 -11.857 14.737 1.742 1.00 0.00 H new ATOM 0 HG23 THR A 4 -10.586 15.806 2.381 1.00 0.00 H new ATOM 68 N GLU A 5 -11.267 11.563 1.713 1.00 0.00 N ATOM 69 CA GLU A 5 -12.154 10.554 2.387 1.00 0.00 C ATOM 70 C GLU A 5 -11.394 9.765 3.525 1.00 0.00 C ATOM 71 O GLU A 5 -12.016 9.270 4.468 1.00 0.00 O ATOM 72 CB GLU A 5 -12.789 9.577 1.367 1.00 0.00 C ATOM 73 CG GLU A 5 -13.615 10.177 0.210 1.00 0.00 C ATOM 74 CD GLU A 5 -14.871 10.938 0.645 1.00 0.00 C ATOM 75 OE1 GLU A 5 -15.942 10.389 0.899 1.00 0.00 O ATOM 76 OE2 GLU A 5 -14.656 12.291 0.720 1.00 0.00 O ATOM 0 H GLU A 5 -11.166 11.435 0.706 1.00 0.00 H new ATOM 0 HA GLU A 5 -12.961 11.114 2.859 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -11.987 8.981 0.931 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -13.433 8.891 1.917 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -12.978 10.852 -0.361 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -13.910 9.372 -0.463 1.00 0.00 H new ATOM 84 N LEU A 6 -10.044 9.708 3.415 1.00 0.00 N ATOM 85 CA LEU A 6 -9.117 9.354 4.501 1.00 0.00 C ATOM 86 C LEU A 6 -9.252 10.284 5.737 1.00 0.00 C ATOM 87 O LEU A 6 -9.507 9.780 6.820 1.00 0.00 O ATOM 88 CB LEU A 6 -7.652 9.434 3.952 1.00 0.00 C ATOM 89 CG LEU A 6 -6.744 8.249 4.309 1.00 0.00 C ATOM 90 CD1 LEU A 6 -5.334 8.447 3.722 1.00 0.00 C ATOM 91 CD2 LEU A 6 -6.697 7.986 5.825 1.00 0.00 C ATOM 0 H LEU A 6 -9.563 9.914 2.539 1.00 0.00 H new ATOM 0 HA LEU A 6 -9.364 8.345 4.832 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.694 9.522 2.866 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.192 10.348 4.328 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.177 7.357 3.856 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -4.707 7.596 3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.399 8.526 2.637 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -4.896 9.360 4.126 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -6.042 7.139 6.027 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.315 8.870 6.336 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -7.701 7.763 6.187 1.00 0.00 H new ATOM 103 N ILE A 7 -9.113 11.615 5.560 1.00 0.00 N ATOM 104 CA ILE A 7 -9.215 12.657 6.628 1.00 0.00 C ATOM 105 C ILE A 7 -10.542 12.546 7.434 1.00 0.00 C ATOM 106 O ILE A 7 -10.503 12.527 8.666 1.00 0.00 O ATOM 107 CB ILE A 7 -9.010 14.094 6.017 1.00 0.00 C ATOM 108 CG1 ILE A 7 -7.739 14.207 5.122 1.00 0.00 C ATOM 109 CG2 ILE A 7 -8.984 15.199 7.099 1.00 0.00 C ATOM 110 CD1 ILE A 7 -7.671 15.407 4.177 1.00 0.00 C ATOM 0 H ILE A 7 -8.920 12.017 4.643 1.00 0.00 H new ATOM 0 HA ILE A 7 -8.413 12.480 7.344 1.00 0.00 H new ATOM 0 HB ILE A 7 -9.881 14.250 5.380 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -6.865 14.236 5.773 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -7.661 13.298 4.525 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -8.840 16.170 6.624 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.928 15.198 7.643 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -8.165 15.010 7.793 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -6.740 15.372 3.610 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -8.516 15.377 3.489 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -7.708 16.329 4.757 1.00 0.00 H new ATOM 122 N ASN A 8 -11.687 12.452 6.730 1.00 0.00 N ATOM 123 CA ASN A 8 -13.003 12.205 7.381 1.00 0.00 C ATOM 124 C ASN A 8 -13.149 10.810 8.076 1.00 0.00 C ATOM 125 O ASN A 8 -13.975 10.701 8.983 1.00 0.00 O ATOM 126 CB ASN A 8 -14.171 12.464 6.391 1.00 0.00 C ATOM 127 CG ASN A 8 -14.294 13.911 5.862 1.00 0.00 C ATOM 128 OD1 ASN A 8 -14.614 14.838 6.605 1.00 0.00 O ATOM 129 ND2 ASN A 8 -14.042 14.130 4.579 1.00 0.00 N ATOM 0 H ASN A 8 -11.735 12.542 5.715 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.053 12.927 8.196 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.056 11.794 5.539 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.106 12.196 6.883 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -14.113 15.074 4.199 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -13.777 13.354 3.972 1.00 0.00 H new ATOM 136 N ALA A 9 -12.376 9.768 7.690 1.00 0.00 N ATOM 137 CA ALA A 9 -12.293 8.492 8.456 1.00 0.00 C ATOM 138 C ALA A 9 -11.644 8.633 9.847 1.00 0.00 C ATOM 139 O ALA A 9 -12.123 8.068 10.826 1.00 0.00 O ATOM 140 CB ALA A 9 -11.369 7.479 7.728 1.00 0.00 C ATOM 0 H ALA A 9 -11.797 9.782 6.850 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.332 8.173 8.543 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.320 6.553 8.302 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -11.769 7.270 6.736 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.368 7.901 7.635 1.00 0.00 H new ATOM 146 N VAL A 10 -10.523 9.363 9.888 1.00 0.00 N ATOM 147 CA VAL A 10 -9.673 9.565 11.069 1.00 0.00 C ATOM 148 C VAL A 10 -10.346 10.408 12.116 1.00 0.00 C ATOM 149 O VAL A 10 -10.476 10.012 13.275 1.00 0.00 O ATOM 150 CB VAL A 10 -8.237 10.055 10.737 1.00 0.00 C ATOM 151 CG1 VAL A 10 -7.229 9.473 11.706 1.00 0.00 C ATOM 152 CG2 VAL A 10 -7.811 9.686 9.324 1.00 0.00 C ATOM 0 H VAL A 10 -10.168 9.850 9.065 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.536 8.573 11.500 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.261 11.141 10.824 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.231 9.831 11.452 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -7.479 9.783 12.721 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.251 8.385 11.644 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -6.800 10.051 9.142 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.832 8.602 9.209 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.495 10.140 8.607 1.00 0.00 H new ATOM 162 N ALA A 11 -10.793 11.565 11.632 1.00 0.00 N ATOM 163 CA ALA A 11 -11.580 12.473 12.439 1.00 0.00 C ATOM 164 C ALA A 11 -12.974 11.946 12.888 1.00 0.00 C ATOM 165 O ALA A 11 -13.450 12.398 13.933 1.00 0.00 O ATOM 166 CB ALA A 11 -11.619 13.820 11.713 1.00 0.00 C ATOM 0 H ALA A 11 -10.619 11.890 10.681 1.00 0.00 H new ATOM 0 HA ALA A 11 -11.089 12.585 13.406 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.206 14.530 12.295 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.604 14.199 11.595 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.075 13.691 10.731 1.00 0.00 H new ATOM 172 N GLU A 12 -13.605 10.994 12.149 1.00 0.00 N ATOM 173 CA GLU A 12 -14.831 10.308 12.631 1.00 0.00 C ATOM 174 C GLU A 12 -14.493 9.206 13.680 1.00 0.00 C ATOM 175 O GLU A 12 -15.121 9.205 14.743 1.00 0.00 O ATOM 176 CB GLU A 12 -15.693 9.807 11.440 1.00 0.00 C ATOM 177 CG GLU A 12 -17.073 9.198 11.778 1.00 0.00 C ATOM 178 CD GLU A 12 -18.063 10.181 12.413 1.00 0.00 C ATOM 179 OE1 GLU A 12 -18.253 10.260 13.626 1.00 0.00 O ATOM 180 OE2 GLU A 12 -18.700 10.955 11.477 1.00 0.00 O ATOM 0 H GLU A 12 -13.288 10.688 11.229 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.451 11.030 13.163 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.850 10.644 10.760 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.117 9.058 10.896 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -17.513 8.798 10.865 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.929 8.358 12.457 1.00 0.00 H new ATOM 188 N THR A 13 -13.523 8.299 13.417 1.00 0.00 N ATOM 189 CA THR A 13 -13.113 7.253 14.415 1.00 0.00 C ATOM 190 C THR A 13 -12.398 7.667 15.737 1.00 0.00 C ATOM 191 O THR A 13 -12.355 6.893 16.700 1.00 0.00 O ATOM 192 CB THR A 13 -12.231 6.150 13.760 1.00 0.00 C ATOM 193 OG1 THR A 13 -11.034 6.766 13.324 1.00 0.00 O ATOM 194 CG2 THR A 13 -12.795 5.348 12.581 1.00 0.00 C ATOM 0 H THR A 13 -13.009 8.260 12.537 1.00 0.00 H new ATOM 0 HA THR A 13 -14.103 6.920 14.727 1.00 0.00 H new ATOM 0 HB THR A 13 -12.125 5.404 14.548 1.00 0.00 H new ATOM 0 HG1 THR A 13 -11.209 7.280 12.508 1.00 0.00 H new ATOM 0 HG21 THR A 13 -12.053 4.623 12.246 1.00 0.00 H new ATOM 0 HG22 THR A 13 -13.697 4.824 12.896 1.00 0.00 H new ATOM 0 HG23 THR A 13 -13.036 6.026 11.762 1.00 0.00 H new ATOM 202 N SER A 14 -11.833 8.864 15.732 1.00 0.00 N ATOM 203 CA SER A 14 -10.976 9.388 16.832 1.00 0.00 C ATOM 204 C SER A 14 -11.463 10.694 17.513 1.00 0.00 C ATOM 205 O SER A 14 -11.227 10.852 18.716 1.00 0.00 O ATOM 206 CB SER A 14 -9.538 9.621 16.297 1.00 0.00 C ATOM 207 OG SER A 14 -9.005 8.484 15.624 1.00 0.00 O ATOM 0 H SER A 14 -11.946 9.523 14.962 1.00 0.00 H new ATOM 0 HA SER A 14 -11.021 8.620 17.604 1.00 0.00 H new ATOM 0 HB2 SER A 14 -9.543 10.471 15.615 1.00 0.00 H new ATOM 0 HB3 SER A 14 -8.885 9.884 17.129 1.00 0.00 H new ATOM 0 HG SER A 14 -8.100 8.686 15.307 1.00 0.00 H new ATOM 213 N GLY A 15 -12.079 11.638 16.772 1.00 0.00 N ATOM 214 CA GLY A 15 -12.417 12.979 17.310 1.00 0.00 C ATOM 215 C GLY A 15 -11.220 13.921 17.571 1.00 0.00 C ATOM 216 O GLY A 15 -11.118 14.542 18.632 1.00 0.00 O ATOM 0 H GLY A 15 -12.354 11.500 15.799 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -13.095 13.469 16.612 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -12.962 12.848 18.245 1.00 0.00 H new ATOM 220 N LEU A 16 -10.354 14.028 16.557 1.00 0.00 N ATOM 221 CA LEU A 16 -9.187 14.937 16.522 1.00 0.00 C ATOM 222 C LEU A 16 -9.710 16.270 15.891 1.00 0.00 C ATOM 223 O LEU A 16 -10.639 16.913 16.394 1.00 0.00 O ATOM 224 CB LEU A 16 -7.871 14.151 16.142 1.00 0.00 C ATOM 225 CG LEU A 16 -7.966 13.231 14.910 1.00 0.00 C ATOM 226 CD1 LEU A 16 -8.655 13.801 13.723 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.989 12.109 14.495 1.00 0.00 C ATOM 0 H LEU A 16 -10.443 13.470 15.708 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.756 15.324 17.445 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.076 14.876 15.969 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.571 13.548 16.999 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.543 12.594 15.580 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.662 13.066 12.918 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.680 14.060 13.987 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.129 14.696 13.392 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.339 11.645 13.573 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -5.997 12.531 14.335 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -6.941 11.358 15.284 1.00 0.00 H new ATOM 239 N SER A 17 -9.077 16.656 14.808 1.00 0.00 N ATOM 240 CA SER A 17 -9.489 17.764 13.912 1.00 0.00 C ATOM 241 C SER A 17 -9.390 17.294 12.433 1.00 0.00 C ATOM 242 O SER A 17 -8.644 16.383 12.088 1.00 0.00 O ATOM 243 CB SER A 17 -8.648 19.032 14.146 1.00 0.00 C ATOM 244 OG SER A 17 -8.722 19.481 15.495 1.00 0.00 O ATOM 0 H SER A 17 -8.220 16.200 14.495 1.00 0.00 H new ATOM 0 HA SER A 17 -10.522 18.027 14.139 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.608 18.830 13.888 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.993 19.824 13.481 1.00 0.00 H new ATOM 0 HG SER A 17 -8.174 20.286 15.602 1.00 0.00 H new ATOM 250 N LYS A 18 -10.126 17.937 11.516 1.00 0.00 N ATOM 251 CA LYS A 18 -9.956 17.715 10.042 1.00 0.00 C ATOM 252 C LYS A 18 -8.512 18.117 9.588 1.00 0.00 C ATOM 253 O LYS A 18 -7.857 17.331 8.910 1.00 0.00 O ATOM 254 CB LYS A 18 -11.117 18.400 9.274 1.00 0.00 C ATOM 255 CG LYS A 18 -11.291 17.905 7.823 1.00 0.00 C ATOM 256 CD LYS A 18 -12.573 18.416 7.145 1.00 0.00 C ATOM 257 CE LYS A 18 -12.710 17.905 5.699 1.00 0.00 C ATOM 258 NZ LYS A 18 -13.966 18.363 5.079 1.00 0.00 N ATOM 0 H LYS A 18 -10.848 18.618 11.751 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.032 16.656 9.795 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -12.047 18.232 9.818 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -10.945 19.476 9.261 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -10.429 18.221 7.235 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.298 16.815 7.819 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.440 18.098 7.724 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.572 19.506 7.145 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -11.863 18.253 5.108 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -12.676 16.816 5.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -14.025 18.001 4.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -14.774 18.010 5.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.986 19.403 5.063 1.00 0.00 H new ATOM 271 N LYS A 19 -7.990 19.272 10.047 1.00 0.00 N ATOM 272 CA LYS A 19 -6.554 19.646 9.911 1.00 0.00 C ATOM 273 C LYS A 19 -5.587 18.640 10.630 1.00 0.00 C ATOM 274 O LYS A 19 -4.549 18.331 10.040 1.00 0.00 O ATOM 275 CB LYS A 19 -6.296 21.093 10.413 1.00 0.00 C ATOM 276 CG LYS A 19 -6.972 22.198 9.568 1.00 0.00 C ATOM 277 CD LYS A 19 -6.669 23.618 10.082 1.00 0.00 C ATOM 278 CE LYS A 19 -7.347 24.709 9.233 1.00 0.00 C ATOM 279 NZ LYS A 19 -7.032 26.058 9.736 1.00 0.00 N ATOM 0 H LYS A 19 -8.548 19.979 10.525 1.00 0.00 H new ATOM 0 HA LYS A 19 -6.332 19.597 8.845 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -6.647 21.175 11.442 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -5.221 21.272 10.428 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -6.638 22.113 8.534 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -8.050 22.040 9.569 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.004 23.706 11.116 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.591 23.779 10.081 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.021 24.620 8.197 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -8.427 24.559 9.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -7.504 26.769 9.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -7.366 26.149 10.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -6.003 26.209 9.705 1.00 0.00 H new ATOM 292 N ASP A 20 -5.898 18.115 11.850 1.00 0.00 N ATOM 293 CA ASP A 20 -5.055 17.054 12.498 1.00 0.00 C ATOM 294 C ASP A 20 -5.083 15.668 11.780 1.00 0.00 C ATOM 295 O ASP A 20 -4.071 14.969 11.808 1.00 0.00 O ATOM 296 CB ASP A 20 -5.393 16.872 14.003 1.00 0.00 C ATOM 297 CG ASP A 20 -4.760 17.931 14.916 1.00 0.00 C ATOM 298 OD1 ASP A 20 -5.368 18.915 15.337 1.00 0.00 O ATOM 299 OD2 ASP A 20 -3.448 17.650 15.204 1.00 0.00 O ATOM 0 H ASP A 20 -6.709 18.399 12.399 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.039 17.435 12.399 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.475 16.899 14.128 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.060 15.885 14.323 1.00 0.00 H new ATOM 305 N ALA A 21 -6.211 15.272 11.165 1.00 0.00 N ATOM 306 CA ALA A 21 -6.330 14.045 10.341 1.00 0.00 C ATOM 307 C ALA A 21 -5.566 14.129 8.986 1.00 0.00 C ATOM 308 O ALA A 21 -4.955 13.136 8.592 1.00 0.00 O ATOM 309 CB ALA A 21 -7.822 13.721 10.191 1.00 0.00 C ATOM 0 H ALA A 21 -7.082 15.800 11.224 1.00 0.00 H new ATOM 0 HA ALA A 21 -5.834 13.218 10.849 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.940 12.821 9.588 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.260 13.558 11.176 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.328 14.554 9.703 1.00 0.00 H new ATOM 315 N THR A 22 -5.558 15.297 8.303 1.00 0.00 N ATOM 316 CA THR A 22 -4.732 15.565 7.091 1.00 0.00 C ATOM 317 C THR A 22 -3.202 15.388 7.343 1.00 0.00 C ATOM 318 O THR A 22 -2.501 14.706 6.588 1.00 0.00 O ATOM 319 CB THR A 22 -5.067 16.996 6.565 1.00 0.00 C ATOM 320 OG1 THR A 22 -6.453 17.310 6.617 1.00 0.00 O ATOM 321 CG2 THR A 22 -4.651 17.154 5.110 1.00 0.00 C ATOM 0 H THR A 22 -6.131 16.094 8.578 1.00 0.00 H new ATOM 0 HA THR A 22 -4.984 14.823 6.333 1.00 0.00 H new ATOM 0 HB THR A 22 -4.516 17.666 7.225 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.702 17.539 7.537 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.896 18.160 4.769 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.577 16.991 5.019 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.182 16.424 4.499 1.00 0.00 H new ATOM 329 N LYS A 23 -2.729 16.006 8.437 1.00 0.00 N ATOM 330 CA LYS A 23 -1.360 15.833 8.972 1.00 0.00 C ATOM 331 C LYS A 23 -1.017 14.363 9.304 1.00 0.00 C ATOM 332 O LYS A 23 -0.041 13.858 8.772 1.00 0.00 O ATOM 333 CB LYS A 23 -1.246 16.626 10.305 1.00 0.00 C ATOM 334 CG LYS A 23 -1.182 18.163 10.176 1.00 0.00 C ATOM 335 CD LYS A 23 -1.177 18.866 11.548 1.00 0.00 C ATOM 336 CE LYS A 23 -1.219 20.399 11.430 1.00 0.00 C ATOM 337 NZ LYS A 23 -1.241 21.039 12.758 1.00 0.00 N ATOM 0 H LYS A 23 -3.294 16.653 8.988 1.00 0.00 H new ATOM 0 HA LYS A 23 -0.676 16.185 8.200 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.100 16.369 10.931 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.353 16.288 10.830 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -0.284 18.442 9.624 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -2.035 18.512 9.594 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -2.035 18.527 12.128 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -0.283 18.572 12.099 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.350 20.747 10.871 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -2.102 20.698 10.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -1.269 22.072 12.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -2.083 20.725 13.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -0.386 20.772 13.286 1.00 0.00 H new ATOM 350 N ALA A 24 -1.828 13.731 10.166 1.00 0.00 N ATOM 351 CA ALA A 24 -1.701 12.329 10.619 1.00 0.00 C ATOM 352 C ALA A 24 -1.610 11.229 9.534 1.00 0.00 C ATOM 353 O ALA A 24 -0.899 10.240 9.699 1.00 0.00 O ATOM 354 CB ALA A 24 -2.849 12.108 11.590 1.00 0.00 C ATOM 0 H ALA A 24 -2.629 14.201 10.588 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.720 12.214 11.081 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.816 11.085 11.966 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.760 12.804 12.424 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.796 12.275 11.078 1.00 0.00 H new ATOM 360 N VAL A 25 -2.316 11.435 8.418 1.00 0.00 N ATOM 361 CA VAL A 25 -2.149 10.685 7.146 1.00 0.00 C ATOM 362 C VAL A 25 -0.695 10.912 6.628 1.00 0.00 C ATOM 363 O VAL A 25 0.058 9.942 6.556 1.00 0.00 O ATOM 364 CB VAL A 25 -3.282 11.297 6.237 1.00 0.00 C ATOM 365 CG1 VAL A 25 -2.985 11.258 4.720 1.00 0.00 C ATOM 366 CG2 VAL A 25 -4.628 10.636 6.550 1.00 0.00 C ATOM 0 H VAL A 25 -3.044 12.147 8.362 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.254 9.601 7.201 1.00 0.00 H new ATOM 0 HB VAL A 25 -3.322 12.357 6.488 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -3.819 11.700 4.175 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.076 11.822 4.513 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.851 10.224 4.402 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.402 11.068 5.915 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.560 9.565 6.361 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.881 10.805 7.597 1.00 0.00 H new ATOM 376 N ASP A 26 -0.290 12.169 6.336 1.00 0.00 N ATOM 377 CA ASP A 26 1.143 12.488 6.006 1.00 0.00 C ATOM 378 C ASP A 26 2.133 12.535 7.244 1.00 0.00 C ATOM 379 O ASP A 26 3.102 13.295 7.323 1.00 0.00 O ATOM 380 CB ASP A 26 1.162 13.829 5.242 1.00 0.00 C ATOM 381 CG ASP A 26 0.530 13.817 3.840 1.00 0.00 C ATOM 382 OD1 ASP A 26 1.110 13.394 2.840 1.00 0.00 O ATOM 383 OD2 ASP A 26 -0.745 14.323 3.840 1.00 0.00 O ATOM 0 H ASP A 26 -0.914 12.976 6.319 1.00 0.00 H new ATOM 0 HA ASP A 26 1.522 11.665 5.400 1.00 0.00 H new ATOM 0 HB2 ASP A 26 0.645 14.575 5.845 1.00 0.00 H new ATOM 0 HB3 ASP A 26 2.197 14.156 5.149 1.00 0.00 H new ATOM 389 N ALA A 27 1.804 11.687 8.212 1.00 0.00 N ATOM 390 CA ALA A 27 2.536 11.386 9.456 1.00 0.00 C ATOM 391 C ALA A 27 2.864 9.869 9.501 1.00 0.00 C ATOM 392 O ALA A 27 4.018 9.495 9.727 1.00 0.00 O ATOM 393 CB ALA A 27 1.775 11.937 10.661 1.00 0.00 C ATOM 0 H ALA A 27 0.945 11.141 8.149 1.00 0.00 H new ATOM 0 HA ALA A 27 3.500 11.893 9.488 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.325 11.709 11.574 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.669 13.017 10.562 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.787 11.479 10.708 1.00 0.00 H new ATOM 399 N VAL A 28 1.850 9.008 9.241 1.00 0.00 N ATOM 400 CA VAL A 28 2.032 7.566 8.916 1.00 0.00 C ATOM 401 C VAL A 28 2.874 7.487 7.609 1.00 0.00 C ATOM 402 O VAL A 28 4.065 7.183 7.657 1.00 0.00 O ATOM 403 CB VAL A 28 0.636 6.862 8.695 1.00 0.00 C ATOM 404 CG1 VAL A 28 0.709 5.386 8.290 1.00 0.00 C ATOM 405 CG2 VAL A 28 -0.240 6.859 9.905 1.00 0.00 C ATOM 0 H VAL A 28 0.871 9.295 9.250 1.00 0.00 H new ATOM 0 HA VAL A 28 2.535 7.057 9.738 1.00 0.00 H new ATOM 0 HB VAL A 28 0.230 7.473 7.889 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.300 4.993 8.162 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.256 5.293 7.352 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.223 4.820 9.067 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.180 6.358 9.673 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.262 6.331 10.716 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.442 7.886 10.210 1.00 0.00 H new ATOM 415 N PHE A 29 2.200 7.878 6.511 1.00 0.00 N ATOM 416 CA PHE A 29 2.672 7.815 5.107 1.00 0.00 C ATOM 417 C PHE A 29 3.955 8.600 4.771 1.00 0.00 C ATOM 418 O PHE A 29 4.579 8.244 3.773 1.00 0.00 O ATOM 419 CB PHE A 29 1.490 8.107 4.129 1.00 0.00 C ATOM 420 CG PHE A 29 0.270 7.179 4.294 1.00 0.00 C ATOM 421 CD1 PHE A 29 0.433 5.791 4.231 1.00 0.00 C ATOM 422 CD2 PHE A 29 -0.958 7.700 4.703 1.00 0.00 C ATOM 423 CE1 PHE A 29 -0.576 4.942 4.658 1.00 0.00 C ATOM 424 CE2 PHE A 29 -1.960 6.856 5.162 1.00 0.00 C ATOM 425 CZ PHE A 29 -1.752 5.479 5.164 1.00 0.00 C ATOM 0 H PHE A 29 1.260 8.268 6.579 1.00 0.00 H new ATOM 0 HA PHE A 29 3.009 6.788 4.964 1.00 0.00 H new ATOM 0 HB2 PHE A 29 1.166 9.138 4.270 1.00 0.00 H new ATOM 0 HB3 PHE A 29 1.855 8.025 3.105 1.00 0.00 H new ATOM 0 HD1 PHE A 29 1.353 5.377 3.846 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -1.130 8.765 4.662 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -0.448 3.871 4.598 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -2.895 7.265 5.515 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.512 4.823 5.563 1.00 0.00 H new ATOM 435 N ASP A 30 4.359 9.609 5.575 1.00 0.00 N ATOM 436 CA ASP A 30 5.681 10.283 5.413 1.00 0.00 C ATOM 437 C ASP A 30 6.887 9.446 5.932 1.00 0.00 C ATOM 438 O ASP A 30 7.952 9.436 5.310 1.00 0.00 O ATOM 439 CB ASP A 30 5.642 11.663 6.107 1.00 0.00 C ATOM 440 CG ASP A 30 6.660 12.707 5.618 1.00 0.00 C ATOM 441 OD1 ASP A 30 7.516 12.499 4.757 1.00 0.00 O ATOM 442 OD2 ASP A 30 6.496 13.906 6.262 1.00 0.00 O ATOM 0 H ASP A 30 3.796 9.978 6.341 1.00 0.00 H new ATOM 0 HA ASP A 30 5.845 10.398 4.342 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.642 12.078 5.984 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.795 11.512 7.176 1.00 0.00 H new ATOM 448 N SER A 31 6.705 8.780 7.082 1.00 0.00 N ATOM 449 CA SER A 31 7.693 7.802 7.623 1.00 0.00 C ATOM 450 C SER A 31 7.817 6.491 6.780 1.00 0.00 C ATOM 451 O SER A 31 8.893 5.895 6.771 1.00 0.00 O ATOM 452 CB SER A 31 7.385 7.442 9.086 1.00 0.00 C ATOM 453 OG SER A 31 7.278 8.602 9.903 1.00 0.00 O ATOM 0 H SER A 31 5.878 8.895 7.669 1.00 0.00 H new ATOM 0 HA SER A 31 8.654 8.313 7.562 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.454 6.877 9.133 1.00 0.00 H new ATOM 0 HB3 SER A 31 8.171 6.795 9.475 1.00 0.00 H new ATOM 0 HG SER A 31 6.351 8.921 9.898 1.00 0.00 H new ATOM 459 N ILE A 32 6.749 6.052 6.072 1.00 0.00 N ATOM 460 CA ILE A 32 6.730 4.886 5.149 1.00 0.00 C ATOM 461 C ILE A 32 7.522 5.241 3.900 1.00 0.00 C ATOM 462 O ILE A 32 8.500 4.565 3.641 1.00 0.00 O ATOM 463 CB ILE A 32 5.289 4.415 4.799 1.00 0.00 C ATOM 464 CG1 ILE A 32 4.422 4.511 6.064 1.00 0.00 C ATOM 465 CG2 ILE A 32 5.369 3.020 4.152 1.00 0.00 C ATOM 466 CD1 ILE A 32 3.115 3.815 6.235 1.00 0.00 C ATOM 0 H ILE A 32 5.842 6.516 6.128 1.00 0.00 H new ATOM 0 HA ILE A 32 7.195 4.039 5.653 1.00 0.00 H new ATOM 0 HB ILE A 32 4.802 5.051 4.060 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.052 4.182 6.890 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.224 5.572 6.217 1.00 0.00 H new ATOM 0 HG21 ILE A 32 4.365 2.677 3.901 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.971 3.074 3.245 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.827 2.320 4.851 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.705 4.047 7.218 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.421 4.150 5.464 1.00 0.00 H new ATOM 0 HD13 ILE A 32 3.262 2.738 6.148 1.00 0.00 H new ATOM 478 N THR A 33 7.147 6.282 3.150 1.00 0.00 N ATOM 479 CA THR A 33 7.989 6.740 2.000 1.00 0.00 C ATOM 480 C THR A 33 9.474 7.056 2.363 1.00 0.00 C ATOM 481 O THR A 33 10.326 6.811 1.519 1.00 0.00 O ATOM 482 CB THR A 33 7.329 7.940 1.275 1.00 0.00 C ATOM 483 OG1 THR A 33 8.076 8.334 0.129 1.00 0.00 O ATOM 484 CG2 THR A 33 7.101 9.162 2.177 1.00 0.00 C ATOM 0 H THR A 33 6.294 6.821 3.298 1.00 0.00 H new ATOM 0 HA THR A 33 8.036 5.887 1.323 1.00 0.00 H new ATOM 0 HB THR A 33 6.348 7.576 0.969 1.00 0.00 H new ATOM 0 HG1 THR A 33 7.632 9.092 -0.306 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.636 9.960 1.598 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.448 8.886 3.005 1.00 0.00 H new ATOM 0 HG23 THR A 33 8.057 9.508 2.569 1.00 0.00 H new ATOM 492 N GLU A 34 9.784 7.571 3.573 1.00 0.00 N ATOM 493 CA GLU A 34 11.183 7.653 4.073 1.00 0.00 C ATOM 494 C GLU A 34 11.783 6.238 4.363 1.00 0.00 C ATOM 495 O GLU A 34 12.975 6.056 4.114 1.00 0.00 O ATOM 496 CB GLU A 34 11.250 8.635 5.275 1.00 0.00 C ATOM 497 CG GLU A 34 12.649 8.943 5.855 1.00 0.00 C ATOM 498 CD GLU A 34 13.623 9.602 4.871 1.00 0.00 C ATOM 499 OE1 GLU A 34 14.453 8.972 4.217 1.00 0.00 O ATOM 500 OE2 GLU A 34 13.456 10.962 4.805 1.00 0.00 O ATOM 0 H GLU A 34 9.089 7.937 4.224 1.00 0.00 H new ATOM 0 HA GLU A 34 11.825 8.063 3.294 1.00 0.00 H new ATOM 0 HB2 GLU A 34 10.796 9.577 4.968 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.633 8.231 6.077 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.532 9.595 6.720 1.00 0.00 H new ATOM 0 HG3 GLU A 34 13.091 8.013 6.214 1.00 0.00 H new ATOM 508 N ALA A 35 10.993 5.244 4.847 1.00 0.00 N ATOM 509 CA ALA A 35 11.414 3.824 4.907 1.00 0.00 C ATOM 510 C ALA A 35 11.737 3.255 3.497 1.00 0.00 C ATOM 511 O ALA A 35 12.874 2.881 3.236 1.00 0.00 O ATOM 512 CB ALA A 35 10.314 2.951 5.598 1.00 0.00 C ATOM 0 H ALA A 35 10.051 5.406 5.204 1.00 0.00 H new ATOM 0 HA ALA A 35 12.327 3.784 5.500 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.642 1.912 5.632 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.147 3.312 6.613 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.386 3.020 5.031 1.00 0.00 H new ATOM 518 N LEU A 36 10.772 3.288 2.570 1.00 0.00 N ATOM 519 CA LEU A 36 10.876 2.759 1.187 1.00 0.00 C ATOM 520 C LEU A 36 11.977 3.443 0.370 1.00 0.00 C ATOM 521 O LEU A 36 12.869 2.761 -0.143 1.00 0.00 O ATOM 522 CB LEU A 36 9.473 2.787 0.551 1.00 0.00 C ATOM 523 CG LEU A 36 8.349 2.158 1.458 1.00 0.00 C ATOM 524 CD1 LEU A 36 7.039 1.911 0.754 1.00 0.00 C ATOM 525 CD2 LEU A 36 8.726 0.832 2.144 1.00 0.00 C ATOM 0 H LEU A 36 9.858 3.698 2.761 1.00 0.00 H new ATOM 0 HA LEU A 36 11.207 1.721 1.205 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.208 3.820 0.324 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.504 2.250 -0.397 1.00 0.00 H new ATOM 0 HG LEU A 36 8.237 2.942 2.207 1.00 0.00 H new ATOM 0 HD11 LEU A 36 6.326 1.477 1.455 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.647 2.854 0.374 1.00 0.00 H new ATOM 0 HD13 LEU A 36 7.196 1.223 -0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.887 0.482 2.745 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.967 0.086 1.387 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.592 0.988 2.787 1.00 0.00 H new ATOM 537 N ARG A 37 11.971 4.787 0.335 1.00 0.00 N ATOM 538 CA ARG A 37 13.051 5.551 -0.302 1.00 0.00 C ATOM 539 C ARG A 37 14.471 5.270 0.296 1.00 0.00 C ATOM 540 O ARG A 37 15.434 5.288 -0.476 1.00 0.00 O ATOM 541 CB ARG A 37 12.708 7.058 -0.219 1.00 0.00 C ATOM 542 CG ARG A 37 13.651 8.054 -0.923 1.00 0.00 C ATOM 543 CD ARG A 37 13.331 9.488 -0.473 1.00 0.00 C ATOM 544 NE ARG A 37 14.129 10.497 -1.214 1.00 0.00 N ATOM 545 CZ ARG A 37 13.664 11.285 -2.205 1.00 0.00 C ATOM 546 NH1 ARG A 37 12.411 11.263 -2.654 1.00 0.00 N ATOM 547 NH2 ARG A 37 14.506 12.133 -2.767 1.00 0.00 N ATOM 0 H ARG A 37 11.232 5.362 0.739 1.00 0.00 H new ATOM 0 HA ARG A 37 13.111 5.224 -1.340 1.00 0.00 H new ATOM 0 HB2 ARG A 37 11.708 7.196 -0.631 1.00 0.00 H new ATOM 0 HB3 ARG A 37 12.659 7.332 0.835 1.00 0.00 H new ATOM 0 HG2 ARG A 37 14.688 7.813 -0.689 1.00 0.00 H new ATOM 0 HG3 ARG A 37 13.541 7.970 -2.004 1.00 0.00 H new ATOM 0 HD2 ARG A 37 12.269 9.686 -0.622 1.00 0.00 H new ATOM 0 HD3 ARG A 37 13.527 9.585 0.595 1.00 0.00 H new ATOM 0 HE ARG A 37 15.109 10.603 -0.952 1.00 0.00 H new ATOM 0 HH11 ARG A 37 11.733 10.620 -2.244 1.00 0.00 H new ATOM 0 HH12 ARG A 37 12.128 11.889 -3.408 1.00 0.00 H new ATOM 0 HH21 ARG A 37 15.474 12.177 -2.449 1.00 0.00 H new ATOM 0 HH22 ARG A 37 14.188 12.744 -3.519 1.00 0.00 H new ATOM 560 N LYS A 38 14.596 5.024 1.629 1.00 0.00 N ATOM 561 CA LYS A 38 15.921 4.768 2.264 1.00 0.00 C ATOM 562 C LYS A 38 16.219 3.253 2.569 1.00 0.00 C ATOM 563 O LYS A 38 17.085 2.960 3.400 1.00 0.00 O ATOM 564 CB LYS A 38 16.020 5.710 3.501 1.00 0.00 C ATOM 565 CG LYS A 38 17.445 6.001 4.030 1.00 0.00 C ATOM 566 CD LYS A 38 17.523 7.016 5.193 1.00 0.00 C ATOM 567 CE LYS A 38 17.060 6.519 6.580 1.00 0.00 C ATOM 568 NZ LYS A 38 15.597 6.544 6.763 1.00 0.00 N ATOM 0 H LYS A 38 13.809 4.997 2.277 1.00 0.00 H new ATOM 0 HA LYS A 38 16.719 5.002 1.559 1.00 0.00 H new ATOM 0 HB2 LYS A 38 15.549 6.660 3.246 1.00 0.00 H new ATOM 0 HB3 LYS A 38 15.437 5.273 4.311 1.00 0.00 H new ATOM 0 HG2 LYS A 38 17.892 5.062 4.358 1.00 0.00 H new ATOM 0 HG3 LYS A 38 18.053 6.372 3.204 1.00 0.00 H new ATOM 0 HD2 LYS A 38 18.555 7.355 5.280 1.00 0.00 H new ATOM 0 HD3 LYS A 38 16.923 7.886 4.926 1.00 0.00 H new ATOM 0 HE2 LYS A 38 17.418 5.500 6.729 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.524 7.136 7.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 15.374 6.803 7.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 15.178 7.244 6.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 15.205 5.603 6.556 1.00 0.00 H new ATOM 581 N GLY A 39 15.552 2.285 1.898 1.00 0.00 N ATOM 582 CA GLY A 39 15.757 0.830 2.150 1.00 0.00 C ATOM 583 C GLY A 39 15.455 0.281 3.574 1.00 0.00 C ATOM 584 O GLY A 39 16.252 -0.490 4.112 1.00 0.00 O ATOM 0 H GLY A 39 14.862 2.482 1.173 1.00 0.00 H new ATOM 0 HA2 GLY A 39 15.137 0.279 1.442 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.795 0.594 1.916 1.00 0.00 H new ATOM 588 N ASP A 40 14.305 0.673 4.147 1.00 0.00 N ATOM 589 CA ASP A 40 13.866 0.273 5.517 1.00 0.00 C ATOM 590 C ASP A 40 12.524 -0.499 5.484 1.00 0.00 C ATOM 591 O ASP A 40 11.616 -0.184 4.704 1.00 0.00 O ATOM 592 CB ASP A 40 13.817 1.427 6.553 1.00 0.00 C ATOM 593 CG ASP A 40 15.088 2.278 6.690 1.00 0.00 C ATOM 594 OD1 ASP A 40 16.039 1.970 7.407 1.00 0.00 O ATOM 595 OD2 ASP A 40 15.036 3.406 5.916 1.00 0.00 O ATOM 0 H ASP A 40 13.638 1.284 3.676 1.00 0.00 H new ATOM 0 HA ASP A 40 14.652 -0.395 5.870 1.00 0.00 H new ATOM 0 HB2 ASP A 40 12.991 2.087 6.290 1.00 0.00 H new ATOM 0 HB3 ASP A 40 13.585 1.000 7.529 1.00 0.00 H new ATOM 601 N LYS A 41 12.413 -1.508 6.375 1.00 0.00 N ATOM 602 CA LYS A 41 11.176 -2.308 6.527 1.00 0.00 C ATOM 603 C LYS A 41 10.267 -1.603 7.566 1.00 0.00 C ATOM 604 O LYS A 41 10.642 -1.333 8.712 1.00 0.00 O ATOM 605 CB LYS A 41 11.380 -3.763 7.022 1.00 0.00 C ATOM 606 CG LYS A 41 12.423 -4.624 6.279 1.00 0.00 C ATOM 607 CD LYS A 41 12.502 -6.066 6.825 1.00 0.00 C ATOM 608 CE LYS A 41 13.521 -6.975 6.108 1.00 0.00 C ATOM 609 NZ LYS A 41 14.925 -6.615 6.387 1.00 0.00 N ATOM 0 H LYS A 41 13.167 -1.789 7.002 1.00 0.00 H new ATOM 0 HA LYS A 41 10.747 -2.372 5.527 1.00 0.00 H new ATOM 0 HB2 LYS A 41 11.662 -3.725 8.074 1.00 0.00 H new ATOM 0 HB3 LYS A 41 10.419 -4.275 6.968 1.00 0.00 H new ATOM 0 HG2 LYS A 41 12.174 -4.655 5.218 1.00 0.00 H new ATOM 0 HG3 LYS A 41 13.403 -4.154 6.363 1.00 0.00 H new ATOM 0 HD2 LYS A 41 12.756 -6.025 7.884 1.00 0.00 H new ATOM 0 HD3 LYS A 41 11.515 -6.522 6.751 1.00 0.00 H new ATOM 0 HE2 LYS A 41 13.351 -8.008 6.411 1.00 0.00 H new ATOM 0 HE3 LYS A 41 13.348 -6.926 5.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 15.558 -7.263 5.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 15.102 -5.639 6.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 15.106 -6.688 7.409 1.00 0.00 H new ATOM 622 N VAL A 42 9.038 -1.373 7.128 1.00 0.00 N ATOM 623 CA VAL A 42 7.947 -0.783 7.885 1.00 0.00 C ATOM 624 C VAL A 42 7.124 -1.972 8.400 1.00 0.00 C ATOM 625 O VAL A 42 6.952 -3.008 7.746 1.00 0.00 O ATOM 626 CB VAL A 42 7.119 0.018 6.852 1.00 0.00 C ATOM 627 CG1 VAL A 42 5.958 0.754 7.458 1.00 0.00 C ATOM 628 CG2 VAL A 42 7.897 1.135 6.189 1.00 0.00 C ATOM 0 H VAL A 42 8.760 -1.609 6.175 1.00 0.00 H new ATOM 0 HA VAL A 42 8.257 -0.142 8.710 1.00 0.00 H new ATOM 0 HB VAL A 42 6.815 -0.763 6.155 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.422 1.294 6.677 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.285 0.042 7.935 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.324 1.461 8.202 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.254 1.653 5.477 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.241 1.839 6.947 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.757 0.718 5.665 1.00 0.00 H new ATOM 638 N GLN A 43 6.609 -1.754 9.597 1.00 0.00 N ATOM 639 CA GLN A 43 5.832 -2.796 10.318 1.00 0.00 C ATOM 640 C GLN A 43 4.519 -2.236 10.946 1.00 0.00 C ATOM 641 O GLN A 43 4.483 -1.151 11.528 1.00 0.00 O ATOM 642 CB GLN A 43 6.755 -3.750 11.140 1.00 0.00 C ATOM 643 CG GLN A 43 7.805 -4.535 10.316 1.00 0.00 C ATOM 644 CD GLN A 43 8.711 -5.526 11.060 1.00 0.00 C ATOM 645 OE1 GLN A 43 8.510 -5.880 12.223 1.00 0.00 O ATOM 646 NE2 GLN A 43 9.747 -5.990 10.371 1.00 0.00 N ATOM 0 H GLN A 43 6.704 -0.874 10.105 1.00 0.00 H new ATOM 0 HA GLN A 43 5.401 -3.508 9.614 1.00 0.00 H new ATOM 0 HB2 GLN A 43 7.277 -3.161 11.894 1.00 0.00 H new ATOM 0 HB3 GLN A 43 6.127 -4.465 11.672 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.276 -5.086 9.538 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.445 -3.810 9.813 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.897 -5.686 9.409 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.392 -6.651 10.804 1.00 0.00 H new ATOM 655 N LEU A 44 3.425 -2.996 10.734 1.00 0.00 N ATOM 656 CA LEU A 44 2.059 -2.744 11.267 1.00 0.00 C ATOM 657 C LEU A 44 1.574 -4.198 11.554 1.00 0.00 C ATOM 658 O LEU A 44 1.360 -4.982 10.621 1.00 0.00 O ATOM 659 CB LEU A 44 1.074 -2.037 10.284 1.00 0.00 C ATOM 660 CG LEU A 44 1.424 -0.597 9.812 1.00 0.00 C ATOM 661 CD1 LEU A 44 0.829 -0.307 8.418 1.00 0.00 C ATOM 662 CD2 LEU A 44 0.944 0.469 10.813 1.00 0.00 C ATOM 0 H LEU A 44 3.465 -3.840 10.163 1.00 0.00 H new ATOM 0 HA LEU A 44 2.084 -2.060 12.115 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.978 -2.665 9.398 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.094 -2.004 10.759 1.00 0.00 H new ATOM 0 HG LEU A 44 2.511 -0.544 9.752 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.090 0.707 8.115 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.232 -1.017 7.696 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.256 -0.406 8.458 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.209 1.460 10.444 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.138 0.401 10.926 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.421 0.302 11.779 1.00 0.00 H new ATOM 674 N ILE A 45 1.422 -4.585 12.835 1.00 0.00 N ATOM 675 CA ILE A 45 1.130 -6.005 13.234 1.00 0.00 C ATOM 676 C ILE A 45 -0.234 -6.659 12.910 1.00 0.00 C ATOM 677 O ILE A 45 -0.324 -7.833 12.533 1.00 0.00 O ATOM 678 CB ILE A 45 1.731 -6.319 14.645 1.00 0.00 C ATOM 679 CG1 ILE A 45 1.867 -7.829 14.991 1.00 0.00 C ATOM 680 CG2 ILE A 45 0.961 -5.600 15.775 1.00 0.00 C ATOM 681 CD1 ILE A 45 2.840 -8.622 14.104 1.00 0.00 C ATOM 0 H ILE A 45 1.494 -3.943 13.625 1.00 0.00 H new ATOM 0 HA ILE A 45 1.669 -6.575 12.477 1.00 0.00 H new ATOM 0 HB ILE A 45 2.747 -5.929 14.578 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.191 -7.919 16.028 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.882 -8.290 14.923 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.412 -5.846 16.736 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.007 -4.522 15.618 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.080 -5.924 15.769 1.00 0.00 H new ATOM 0 HD11 ILE A 45 2.862 -9.663 14.428 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.510 -8.572 13.066 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.839 -8.195 14.188 1.00 0.00 H new ATOM 693 N GLY A 46 -1.253 -5.849 13.065 1.00 0.00 N ATOM 694 CA GLY A 46 -2.626 -6.211 12.646 1.00 0.00 C ATOM 695 C GLY A 46 -3.016 -5.860 11.186 1.00 0.00 C ATOM 696 O GLY A 46 -4.209 -5.952 10.881 1.00 0.00 O ATOM 0 H GLY A 46 -1.177 -4.921 13.481 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -2.754 -7.284 12.785 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.329 -5.717 13.316 1.00 0.00 H new ATOM 700 N PHE A 47 -2.066 -5.489 10.285 1.00 0.00 N ATOM 701 CA PHE A 47 -2.411 -4.986 8.937 1.00 0.00 C ATOM 702 C PHE A 47 -1.343 -5.092 7.811 1.00 0.00 C ATOM 703 O PHE A 47 -1.749 -5.423 6.692 1.00 0.00 O ATOM 704 CB PHE A 47 -2.798 -3.486 9.107 1.00 0.00 C ATOM 705 CG PHE A 47 -3.561 -2.935 7.889 1.00 0.00 C ATOM 706 CD1 PHE A 47 -4.926 -3.193 7.720 1.00 0.00 C ATOM 707 CD2 PHE A 47 -2.844 -2.322 6.853 1.00 0.00 C ATOM 708 CE1 PHE A 47 -5.550 -2.864 6.521 1.00 0.00 C ATOM 709 CE2 PHE A 47 -3.473 -2.026 5.648 1.00 0.00 C ATOM 710 CZ PHE A 47 -4.818 -2.318 5.479 1.00 0.00 C ATOM 0 H PHE A 47 -1.064 -5.530 10.471 1.00 0.00 H new ATOM 0 HA PHE A 47 -3.207 -5.643 8.586 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.413 -3.371 10.000 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.895 -2.896 9.264 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.494 -3.647 8.519 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -1.801 -2.079 6.990 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -6.610 -3.035 6.402 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.914 -1.569 4.845 1.00 0.00 H new ATOM 0 HZ PHE A 47 -5.297 -2.119 4.532 1.00 0.00 H new ATOM 720 N GLY A 48 -0.066 -4.704 8.023 1.00 0.00 N ATOM 721 CA GLY A 48 0.886 -4.593 6.906 1.00 0.00 C ATOM 722 C GLY A 48 2.373 -4.358 7.183 1.00 0.00 C ATOM 723 O GLY A 48 2.752 -3.453 7.926 1.00 0.00 O ATOM 0 H GLY A 48 0.319 -4.468 8.938 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.807 -5.510 6.321 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.543 -3.778 6.269 1.00 0.00 H new ATOM 727 N ASN A 49 3.213 -5.136 6.483 1.00 0.00 N ATOM 728 CA ASN A 49 4.687 -4.988 6.531 1.00 0.00 C ATOM 729 C ASN A 49 5.141 -4.493 5.127 1.00 0.00 C ATOM 730 O ASN A 49 5.299 -5.294 4.200 1.00 0.00 O ATOM 731 CB ASN A 49 5.334 -6.320 7.013 1.00 0.00 C ATOM 732 CG ASN A 49 6.879 -6.398 7.076 1.00 0.00 C ATOM 733 OD1 ASN A 49 7.622 -5.546 6.587 1.00 0.00 O ATOM 734 ND2 ASN A 49 7.398 -7.457 7.676 1.00 0.00 N ATOM 0 H ASN A 49 2.897 -5.885 5.867 1.00 0.00 H new ATOM 0 HA ASN A 49 5.021 -4.247 7.258 1.00 0.00 H new ATOM 0 HB2 ASN A 49 4.948 -6.537 8.009 1.00 0.00 H new ATOM 0 HB3 ASN A 49 4.986 -7.117 6.356 1.00 0.00 H new ATOM 0 HD21 ASN A 49 8.411 -7.566 7.733 1.00 0.00 H new ATOM 0 HD22 ASN A 49 6.785 -8.164 8.082 1.00 0.00 H new ATOM 741 N PHE A 50 5.362 -3.171 4.974 1.00 0.00 N ATOM 742 CA PHE A 50 5.881 -2.597 3.699 1.00 0.00 C ATOM 743 C PHE A 50 7.419 -2.738 3.668 1.00 0.00 C ATOM 744 O PHE A 50 8.092 -2.540 4.683 1.00 0.00 O ATOM 745 CB PHE A 50 5.614 -1.085 3.439 1.00 0.00 C ATOM 746 CG PHE A 50 4.207 -0.531 3.493 1.00 0.00 C ATOM 747 CD1 PHE A 50 3.578 -0.382 4.735 1.00 0.00 C ATOM 748 CD2 PHE A 50 3.667 0.091 2.362 1.00 0.00 C ATOM 749 CE1 PHE A 50 2.383 0.316 4.829 1.00 0.00 C ATOM 750 CE2 PHE A 50 2.473 0.793 2.464 1.00 0.00 C ATOM 751 CZ PHE A 50 1.824 0.868 3.688 1.00 0.00 C ATOM 0 H PHE A 50 5.193 -2.480 5.705 1.00 0.00 H new ATOM 0 HA PHE A 50 5.339 -3.160 2.939 1.00 0.00 H new ATOM 0 HB2 PHE A 50 6.208 -0.525 4.162 1.00 0.00 H new ATOM 0 HB3 PHE A 50 6.013 -0.854 2.451 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.024 -0.811 5.620 1.00 0.00 H new ATOM 0 HD2 PHE A 50 4.177 0.025 1.412 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.892 0.428 5.784 1.00 0.00 H new ATOM 0 HE2 PHE A 50 2.052 1.278 1.596 1.00 0.00 H new ATOM 0 HZ PHE A 50 0.867 1.365 3.752 1.00 0.00 H new ATOM 761 N GLU A 51 7.976 -3.043 2.490 1.00 0.00 N ATOM 762 CA GLU A 51 9.448 -3.100 2.315 1.00 0.00 C ATOM 763 C GLU A 51 9.796 -3.065 0.817 1.00 0.00 C ATOM 764 O GLU A 51 9.123 -3.674 -0.017 1.00 0.00 O ATOM 765 CB GLU A 51 10.134 -4.283 3.069 1.00 0.00 C ATOM 766 CG GLU A 51 9.669 -5.710 2.693 1.00 0.00 C ATOM 767 CD GLU A 51 10.307 -6.792 3.567 1.00 0.00 C ATOM 768 OE1 GLU A 51 11.337 -7.390 3.259 1.00 0.00 O ATOM 769 OE2 GLU A 51 9.599 -7.012 4.721 1.00 0.00 O ATOM 0 H GLU A 51 7.443 -3.254 1.646 1.00 0.00 H new ATOM 0 HA GLU A 51 9.865 -2.212 2.791 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.208 -4.219 2.897 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.974 -4.144 4.138 1.00 0.00 H new ATOM 0 HG2 GLU A 51 8.584 -5.769 2.784 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.913 -5.903 1.648 1.00 0.00 H new ATOM 777 N VAL A 52 10.891 -2.369 0.477 1.00 0.00 N ATOM 778 CA VAL A 52 11.270 -2.092 -0.911 1.00 0.00 C ATOM 779 C VAL A 52 12.076 -3.263 -1.571 1.00 0.00 C ATOM 780 O VAL A 52 12.651 -4.102 -0.865 1.00 0.00 O ATOM 781 CB VAL A 52 11.938 -0.670 -0.770 1.00 0.00 C ATOM 782 CG1 VAL A 52 13.461 -0.718 -0.874 1.00 0.00 C ATOM 783 CG2 VAL A 52 11.285 0.353 -1.705 1.00 0.00 C ATOM 0 H VAL A 52 11.540 -1.982 1.162 1.00 0.00 H new ATOM 0 HA VAL A 52 10.463 -2.051 -1.643 1.00 0.00 H new ATOM 0 HB VAL A 52 11.743 -0.320 0.244 1.00 0.00 H new ATOM 0 HG11 VAL A 52 13.865 0.289 -0.770 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.860 -1.353 -0.083 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.747 -1.125 -1.844 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.770 1.321 -1.581 1.00 0.00 H new ATOM 0 HG22 VAL A 52 11.393 0.023 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 52 10.226 0.444 -1.462 1.00 0.00 H new ATOM 793 N ARG A 53 12.145 -3.283 -2.919 1.00 0.00 N ATOM 794 CA ARG A 53 12.952 -4.306 -3.650 1.00 0.00 C ATOM 795 C ARG A 53 13.857 -3.602 -4.692 1.00 0.00 C ATOM 796 O ARG A 53 13.357 -3.148 -5.723 1.00 0.00 O ATOM 797 CB ARG A 53 12.062 -5.402 -4.318 1.00 0.00 C ATOM 798 CG ARG A 53 12.751 -6.758 -4.592 1.00 0.00 C ATOM 799 CD ARG A 53 13.018 -7.622 -3.341 1.00 0.00 C ATOM 800 NE ARG A 53 13.726 -8.886 -3.674 1.00 0.00 N ATOM 801 CZ ARG A 53 13.130 -10.041 -4.035 1.00 0.00 C ATOM 802 NH1 ARG A 53 11.812 -10.195 -4.148 1.00 0.00 N ATOM 803 NH2 ARG A 53 13.900 -11.081 -4.293 1.00 0.00 N ATOM 0 H ARG A 53 11.663 -2.617 -3.523 1.00 0.00 H new ATOM 0 HA ARG A 53 13.577 -4.826 -2.924 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.197 -5.579 -3.679 1.00 0.00 H new ATOM 0 HB3 ARG A 53 11.686 -5.010 -5.263 1.00 0.00 H new ATOM 0 HG2 ARG A 53 12.132 -7.329 -5.283 1.00 0.00 H new ATOM 0 HG3 ARG A 53 13.700 -6.571 -5.094 1.00 0.00 H new ATOM 0 HD2 ARG A 53 13.612 -7.052 -2.627 1.00 0.00 H new ATOM 0 HD3 ARG A 53 12.071 -7.855 -2.853 1.00 0.00 H new ATOM 0 HE ARG A 53 14.745 -8.879 -3.626 1.00 0.00 H new ATOM 0 HH11 ARG A 53 11.189 -9.411 -3.957 1.00 0.00 H new ATOM 0 HH12 ARG A 53 11.426 -11.097 -4.426 1.00 0.00 H new ATOM 0 HH21 ARG A 53 14.914 -10.996 -4.217 1.00 0.00 H new ATOM 0 HH22 ARG A 53 13.482 -11.969 -4.569 1.00 0.00 H new ATOM 1134 N LYS A 75 14.535 0.859 -6.615 1.00 0.00 N ATOM 1135 CA LYS A 75 13.849 0.379 -5.375 1.00 0.00 C ATOM 1136 C LYS A 75 12.313 0.440 -5.595 1.00 0.00 C ATOM 1137 O LYS A 75 11.746 1.514 -5.811 1.00 0.00 O ATOM 1138 CB LYS A 75 14.233 1.041 -4.029 1.00 0.00 C ATOM 1139 CG LYS A 75 15.649 1.642 -3.887 1.00 0.00 C ATOM 1140 CD LYS A 75 15.918 2.184 -2.465 1.00 0.00 C ATOM 1141 CE LYS A 75 17.290 2.858 -2.268 1.00 0.00 C ATOM 1142 NZ LYS A 75 18.420 1.908 -2.314 1.00 0.00 N ATOM 0 HA LYS A 75 14.214 -0.640 -5.244 1.00 0.00 H new ATOM 0 HB2 LYS A 75 13.513 1.835 -3.832 1.00 0.00 H new ATOM 0 HB3 LYS A 75 14.108 0.295 -3.244 1.00 0.00 H new ATOM 0 HG2 LYS A 75 16.390 0.880 -4.129 1.00 0.00 H new ATOM 0 HG3 LYS A 75 15.773 2.448 -4.610 1.00 0.00 H new ATOM 0 HD2 LYS A 75 15.138 2.903 -2.214 1.00 0.00 H new ATOM 0 HD3 LYS A 75 15.831 1.360 -1.757 1.00 0.00 H new ATOM 0 HE2 LYS A 75 17.429 3.615 -3.040 1.00 0.00 H new ATOM 0 HE3 LYS A 75 17.298 3.376 -1.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 19.313 2.423 -2.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 18.309 1.199 -1.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 18.436 1.431 -3.238 1.00 0.00 H new ATOM 1155 N VAL A 76 11.664 -0.729 -5.544 1.00 0.00 N ATOM 1156 CA VAL A 76 10.257 -0.922 -5.876 1.00 0.00 C ATOM 1157 C VAL A 76 9.414 -0.964 -4.573 1.00 0.00 C ATOM 1158 O VAL A 76 9.760 -1.736 -3.680 1.00 0.00 O ATOM 1159 CB VAL A 76 10.281 -2.235 -6.730 1.00 0.00 C ATOM 1160 CG1 VAL A 76 9.755 -3.498 -6.055 1.00 0.00 C ATOM 1161 CG2 VAL A 76 9.596 -2.050 -8.056 1.00 0.00 C ATOM 0 H VAL A 76 12.125 -1.594 -5.260 1.00 0.00 H new ATOM 0 HA VAL A 76 9.781 -0.123 -6.445 1.00 0.00 H new ATOM 0 HB VAL A 76 11.348 -2.409 -6.869 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.824 -4.337 -6.748 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.350 -3.711 -5.167 1.00 0.00 H new ATOM 0 HG13 VAL A 76 8.714 -3.350 -5.767 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.634 -2.983 -8.618 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.556 -1.767 -7.892 1.00 0.00 H new ATOM 0 HG23 VAL A 76 10.101 -1.266 -8.620 1.00 0.00 H new ATOM 1171 N PRO A 77 8.292 -0.241 -4.420 1.00 0.00 N ATOM 1172 CA PRO A 77 7.505 -0.275 -3.174 1.00 0.00 C ATOM 1173 C PRO A 77 6.448 -1.392 -3.171 1.00 0.00 C ATOM 1174 O PRO A 77 5.744 -1.663 -4.151 1.00 0.00 O ATOM 1175 CB PRO A 77 6.891 1.129 -3.184 1.00 0.00 C ATOM 1176 CG PRO A 77 6.691 1.442 -4.674 1.00 0.00 C ATOM 1177 CD PRO A 77 7.810 0.709 -5.421 1.00 0.00 C ATOM 0 HA PRO A 77 8.088 -0.499 -2.280 1.00 0.00 H new ATOM 0 HB2 PRO A 77 5.946 1.154 -2.641 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.551 1.856 -2.709 1.00 0.00 H new ATOM 0 HG2 PRO A 77 5.711 1.106 -5.014 1.00 0.00 H new ATOM 0 HG3 PRO A 77 6.740 2.516 -4.856 1.00 0.00 H new ATOM 0 HD2 PRO A 77 7.439 0.205 -6.313 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.596 1.391 -5.744 1.00 0.00 H new ATOM 1185 N ALA A 78 6.389 -2.016 -1.998 1.00 0.00 N ATOM 1186 CA ALA A 78 5.541 -3.182 -1.751 1.00 0.00 C ATOM 1187 C ALA A 78 4.936 -3.094 -0.330 1.00 0.00 C ATOM 1188 O ALA A 78 5.408 -2.392 0.568 1.00 0.00 O ATOM 1189 CB ALA A 78 6.459 -4.392 -1.982 1.00 0.00 C ATOM 0 H ALA A 78 6.932 -1.726 -1.185 1.00 0.00 H new ATOM 0 HA ALA A 78 4.676 -3.255 -2.410 1.00 0.00 H new ATOM 0 HB1 ALA A 78 5.898 -5.312 -1.816 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.833 -4.375 -3.006 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.299 -4.349 -1.288 1.00 0.00 H new ATOM 1195 N PHE A 79 3.844 -3.839 -0.192 1.00 0.00 N ATOM 1196 CA PHE A 79 3.009 -3.905 1.033 1.00 0.00 C ATOM 1197 C PHE A 79 2.597 -5.405 1.148 1.00 0.00 C ATOM 1198 O PHE A 79 1.935 -5.996 0.287 1.00 0.00 O ATOM 1199 CB PHE A 79 1.819 -2.929 0.918 1.00 0.00 C ATOM 1200 CG PHE A 79 0.580 -3.195 1.798 1.00 0.00 C ATOM 1201 CD1 PHE A 79 0.510 -2.702 3.102 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -0.455 -4.010 1.315 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -0.567 -3.036 3.916 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -1.516 -4.366 2.142 1.00 0.00 C ATOM 1205 CZ PHE A 79 -1.563 -3.891 3.447 1.00 0.00 C ATOM 0 H PHE A 79 3.494 -4.435 -0.942 1.00 0.00 H new ATOM 0 HA PHE A 79 3.527 -3.593 1.939 1.00 0.00 H new ATOM 0 HB2 PHE A 79 2.184 -1.928 1.148 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.494 -2.919 -0.122 1.00 0.00 H new ATOM 0 HD1 PHE A 79 1.293 -2.061 3.479 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.428 -4.363 0.295 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.632 -2.631 4.915 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -2.300 -5.009 1.771 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.372 -4.185 4.099 1.00 0.00 H new ATOM 1215 N LYS A 80 2.986 -5.953 2.287 1.00 0.00 N ATOM 1216 CA LYS A 80 2.504 -7.280 2.790 1.00 0.00 C ATOM 1217 C LYS A 80 1.151 -7.032 3.505 1.00 0.00 C ATOM 1218 O LYS A 80 0.987 -5.958 4.090 1.00 0.00 O ATOM 1219 CB LYS A 80 3.529 -7.936 3.748 1.00 0.00 C ATOM 1220 CG LYS A 80 4.824 -8.420 3.046 1.00 0.00 C ATOM 1221 CD LYS A 80 5.959 -8.883 3.982 1.00 0.00 C ATOM 1222 CE LYS A 80 5.629 -10.115 4.848 1.00 0.00 C ATOM 1223 NZ LYS A 80 6.786 -10.531 5.660 1.00 0.00 N ATOM 0 H LYS A 80 3.653 -5.504 2.914 1.00 0.00 H new ATOM 0 HA LYS A 80 2.380 -7.974 1.959 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.795 -7.220 4.526 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.057 -8.784 4.244 1.00 0.00 H new ATOM 0 HG2 LYS A 80 4.568 -9.244 2.380 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.201 -7.610 2.421 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.838 -9.107 3.378 1.00 0.00 H new ATOM 0 HD3 LYS A 80 6.227 -8.056 4.640 1.00 0.00 H new ATOM 0 HE2 LYS A 80 4.788 -9.886 5.502 1.00 0.00 H new ATOM 0 HE3 LYS A 80 5.319 -10.939 4.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 6.529 -11.362 6.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.581 -10.773 5.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.066 -9.752 6.290 1.00 0.00 H new ATOM 1236 N PRO A 81 0.146 -7.951 3.505 1.00 0.00 N ATOM 1237 CA PRO A 81 -1.059 -7.779 4.357 1.00 0.00 C ATOM 1238 C PRO A 81 -0.812 -8.166 5.858 1.00 0.00 C ATOM 1239 O PRO A 81 -1.729 -8.648 6.522 1.00 0.00 O ATOM 1240 CB PRO A 81 -2.034 -8.705 3.601 1.00 0.00 C ATOM 1241 CG PRO A 81 -1.182 -9.853 3.059 1.00 0.00 C ATOM 1242 CD PRO A 81 0.130 -9.176 2.677 1.00 0.00 C ATOM 0 HA PRO A 81 -1.417 -6.756 4.471 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.814 -9.077 4.265 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.532 -8.171 2.791 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.029 -10.628 3.810 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -1.652 -10.330 2.199 1.00 0.00 H new ATOM 0 HD2 PRO A 81 0.987 -9.815 2.890 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.164 -8.941 1.613 1.00 0.00 H new ATOM 1250 N GLY A 82 0.415 -7.948 6.393 1.00 0.00 N ATOM 1251 CA GLY A 82 0.853 -8.369 7.744 1.00 0.00 C ATOM 1252 C GLY A 82 0.473 -9.779 8.241 1.00 0.00 C ATOM 1253 O GLY A 82 0.507 -9.974 9.458 1.00 0.00 O ATOM 0 H GLY A 82 1.148 -7.459 5.879 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.939 -8.288 7.779 1.00 0.00 H new ATOM 0 HA3 GLY A 82 0.456 -7.649 8.459 1.00 0.00 H new ATOM 1257 N LYS A 83 0.101 -10.713 7.320 1.00 0.00 N ATOM 1258 CA LYS A 83 -0.582 -12.017 7.664 1.00 0.00 C ATOM 1259 C LYS A 83 -2.068 -11.876 8.159 1.00 0.00 C ATOM 1260 O LYS A 83 -2.988 -12.575 7.736 1.00 0.00 O ATOM 1261 CB LYS A 83 0.211 -12.927 8.652 1.00 0.00 C ATOM 1262 CG LYS A 83 0.970 -14.119 8.025 1.00 0.00 C ATOM 1263 CD LYS A 83 0.159 -15.417 7.809 1.00 0.00 C ATOM 1264 CE LYS A 83 -0.840 -15.390 6.636 1.00 0.00 C ATOM 1265 NZ LYS A 83 -1.481 -16.701 6.433 1.00 0.00 N ATOM 0 H LYS A 83 0.261 -10.594 6.320 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.603 -12.514 6.694 1.00 0.00 H new ATOM 0 HB2 LYS A 83 0.930 -12.306 9.187 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -0.487 -13.317 9.393 1.00 0.00 H new ATOM 0 HG2 LYS A 83 1.368 -13.801 7.061 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.824 -14.352 8.661 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.858 -16.238 7.649 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.389 -15.638 8.725 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.605 -14.637 6.827 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.322 -15.094 5.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.146 -16.643 5.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.754 -17.415 6.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.997 -16.972 7.294 1.00 0.00 H new ATOM 1278 N ALA A 84 -2.211 -10.987 9.134 1.00 0.00 N ATOM 1279 CA ALA A 84 -3.441 -10.547 9.810 1.00 0.00 C ATOM 1280 C ALA A 84 -4.577 -10.028 8.905 1.00 0.00 C ATOM 1281 O ALA A 84 -5.714 -10.482 9.061 1.00 0.00 O ATOM 1282 CB ALA A 84 -2.902 -9.417 10.689 1.00 0.00 C ATOM 0 H ALA A 84 -1.395 -10.506 9.513 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.927 -11.381 10.317 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.719 -8.982 11.265 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.149 -9.813 11.370 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.453 -8.649 10.059 1.00 0.00 H new ATOM 1288 N LEU A 85 -4.282 -9.085 7.976 1.00 0.00 N ATOM 1289 CA LEU A 85 -5.227 -8.694 6.919 1.00 0.00 C ATOM 1290 C LEU A 85 -5.542 -9.910 5.990 1.00 0.00 C ATOM 1291 O LEU A 85 -6.707 -10.066 5.632 1.00 0.00 O ATOM 1292 CB LEU A 85 -4.702 -7.441 6.172 1.00 0.00 C ATOM 1293 CG LEU A 85 -5.626 -6.991 5.029 1.00 0.00 C ATOM 1294 CD1 LEU A 85 -6.917 -6.301 5.487 1.00 0.00 C ATOM 1295 CD2 LEU A 85 -4.881 -6.133 3.994 1.00 0.00 C ATOM 0 H LEU A 85 -3.394 -8.585 7.944 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.182 -8.405 7.357 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.588 -6.623 6.883 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.712 -7.654 5.769 1.00 0.00 H new ATOM 0 HG LEU A 85 -5.942 -7.918 4.551 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.507 -6.018 4.615 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.494 -6.985 6.109 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -6.669 -5.409 6.062 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.570 -5.836 3.204 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -4.481 -5.243 4.480 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.063 -6.711 3.564 1.00 0.00 H new ATOM 1307 N LYS A 86 -4.558 -10.754 5.608 1.00 0.00 N ATOM 1308 CA LYS A 86 -4.830 -12.020 4.865 1.00 0.00 C ATOM 1309 C LYS A 86 -5.909 -12.943 5.534 1.00 0.00 C ATOM 1310 O LYS A 86 -6.636 -13.624 4.812 1.00 0.00 O ATOM 1311 CB LYS A 86 -3.515 -12.765 4.518 1.00 0.00 C ATOM 1312 CG LYS A 86 -3.633 -13.707 3.303 1.00 0.00 C ATOM 1313 CD LYS A 86 -2.308 -14.407 2.947 1.00 0.00 C ATOM 1314 CE LYS A 86 -2.444 -15.341 1.731 1.00 0.00 C ATOM 1315 NZ LYS A 86 -1.164 -15.997 1.412 1.00 0.00 N ATOM 0 H LYS A 86 -3.570 -10.589 5.798 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.291 -11.723 3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -2.734 -12.031 4.322 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.197 -13.344 5.385 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.391 -14.462 3.509 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.978 -13.136 2.441 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -1.547 -13.654 2.740 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -1.962 -14.982 3.806 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.202 -16.098 1.934 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.787 -14.770 0.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -1.289 -16.620 0.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -0.448 -15.274 1.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -0.850 -16.561 2.228 1.00 0.00 H new ATOM 1328 N ASP A 87 -6.052 -12.923 6.878 1.00 0.00 N ATOM 1329 CA ASP A 87 -7.164 -13.584 7.600 1.00 0.00 C ATOM 1330 C ASP A 87 -8.519 -12.805 7.511 1.00 0.00 C ATOM 1331 O ASP A 87 -9.550 -13.437 7.263 1.00 0.00 O ATOM 1332 CB ASP A 87 -6.657 -13.769 9.056 1.00 0.00 C ATOM 1333 CG ASP A 87 -6.831 -15.196 9.584 1.00 0.00 C ATOM 1334 OD1 ASP A 87 -7.794 -15.554 10.261 1.00 0.00 O ATOM 1335 OD2 ASP A 87 -5.797 -16.017 9.210 1.00 0.00 O ATOM 0 H ASP A 87 -5.396 -12.445 7.496 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.410 -14.542 7.143 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.602 -13.498 9.103 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.192 -13.080 9.709 1.00 0.00 H new ATOM 1341 N ALA A 88 -8.519 -11.462 7.706 1.00 0.00 N ATOM 1342 CA ALA A 88 -9.706 -10.578 7.480 1.00 0.00 C ATOM 1343 C ALA A 88 -10.426 -10.713 6.102 1.00 0.00 C ATOM 1344 O ALA A 88 -11.655 -10.663 6.007 1.00 0.00 O ATOM 1345 CB ALA A 88 -9.222 -9.102 7.527 1.00 0.00 C ATOM 0 H ALA A 88 -7.695 -10.953 8.026 1.00 0.00 H new ATOM 0 HA ALA A 88 -10.414 -10.878 8.253 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.069 -8.436 7.365 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.779 -8.895 8.501 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.477 -8.938 6.748 1.00 0.00 H new ATOM 1351 N VAL A 89 -9.602 -10.856 5.058 1.00 0.00 N ATOM 1352 CA VAL A 89 -9.971 -10.827 3.642 1.00 0.00 C ATOM 1353 C VAL A 89 -10.240 -12.224 2.971 1.00 0.00 C ATOM 1354 O VAL A 89 -10.759 -12.267 1.852 1.00 0.00 O ATOM 1355 CB VAL A 89 -8.732 -9.992 3.142 1.00 0.00 C ATOM 1356 CG1 VAL A 89 -7.528 -10.845 2.734 1.00 0.00 C ATOM 1357 CG2 VAL A 89 -9.109 -9.038 2.045 1.00 0.00 C ATOM 0 H VAL A 89 -8.601 -11.004 5.189 1.00 0.00 H new ATOM 0 HA VAL A 89 -10.943 -10.403 3.391 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.412 -9.415 4.010 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.718 -10.196 2.402 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.194 -11.435 3.588 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.814 -11.513 1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -8.227 -8.481 1.728 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -9.509 -9.596 1.199 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -9.865 -8.343 2.411 1.00 0.00 H new ATOM 1367 N LYS A 90 -9.883 -13.337 3.652 1.00 0.00 N ATOM 1368 CA LYS A 90 -10.039 -14.721 3.164 1.00 0.00 C ATOM 1369 C LYS A 90 -11.499 -15.174 3.322 1.00 0.00 C ATOM 1370 O LYS A 90 -12.254 -15.207 2.350 1.00 0.00 O ATOM 1371 CB LYS A 90 -9.061 -15.639 3.955 1.00 0.00 C ATOM 1372 CG LYS A 90 -7.793 -16.030 3.158 1.00 0.00 C ATOM 1373 CD LYS A 90 -6.727 -16.808 3.959 1.00 0.00 C ATOM 1374 CE LYS A 90 -7.125 -18.247 4.342 1.00 0.00 C ATOM 1375 NZ LYS A 90 -6.039 -18.924 5.073 1.00 0.00 N ATOM 0 H LYS A 90 -9.467 -13.293 4.582 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.795 -14.781 2.103 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.761 -15.131 4.872 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.588 -16.546 4.251 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.093 -16.634 2.302 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.337 -15.122 2.763 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -5.808 -16.844 3.373 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.502 -16.254 4.870 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.024 -18.227 4.958 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.368 -18.812 3.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.335 -19.890 5.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.189 -18.963 4.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.825 -18.397 5.943 1.00 0.00 H new ATOM 1389 N MET B 1 9.310 -0.688 11.614 1.00 0.00 N ATOM 1390 CA MET B 1 8.551 -0.109 12.730 1.00 0.00 C ATOM 1391 C MET B 1 8.033 -1.269 13.640 1.00 0.00 C ATOM 1392 O MET B 1 8.836 -1.906 14.325 1.00 0.00 O ATOM 1393 CB MET B 1 7.520 0.939 12.193 1.00 0.00 C ATOM 1394 CG MET B 1 8.076 2.311 11.761 1.00 0.00 C ATOM 1395 SD MET B 1 8.443 2.339 9.991 1.00 0.00 S ATOM 1396 CE MET B 1 7.378 3.685 9.415 1.00 0.00 C ATOM 0 H1 MET B 1 9.297 -0.031 10.808 1.00 0.00 H new ATOM 0 H2 MET B 1 10.293 -0.853 11.911 1.00 0.00 H new ATOM 0 H3 MET B 1 8.878 -1.591 11.332 1.00 0.00 H new ATOM 0 HA MET B 1 9.162 0.494 13.402 1.00 0.00 H new ATOM 0 HB2 MET B 1 7.003 0.499 11.340 1.00 0.00 H new ATOM 0 HB3 MET B 1 6.772 1.106 12.968 1.00 0.00 H new ATOM 0 HG2 MET B 1 7.352 3.091 11.997 1.00 0.00 H new ATOM 0 HG3 MET B 1 8.981 2.534 12.326 1.00 0.00 H new ATOM 0 HE1 MET B 1 7.617 3.920 8.378 1.00 0.00 H new ATOM 0 HE2 MET B 1 6.334 3.379 9.486 1.00 0.00 H new ATOM 0 HE3 MET B 1 7.540 4.568 10.034 1.00 0.00 H new ATOM 1407 N ASN B 2 6.711 -1.503 13.642 1.00 0.00 N ATOM 1408 CA ASN B 2 5.964 -2.594 14.346 1.00 0.00 C ATOM 1409 C ASN B 2 4.427 -2.332 14.381 1.00 0.00 C ATOM 1410 O ASN B 2 3.663 -3.293 14.323 1.00 0.00 O ATOM 1411 CB ASN B 2 6.435 -3.155 15.719 1.00 0.00 C ATOM 1412 CG ASN B 2 6.260 -2.285 16.977 1.00 0.00 C ATOM 1413 OD1 ASN B 2 7.133 -1.515 17.371 1.00 0.00 O ATOM 1414 ND2 ASN B 2 5.132 -2.440 17.649 1.00 0.00 N ATOM 0 H ASN B 2 6.077 -0.899 13.118 1.00 0.00 H new ATOM 0 HA ASN B 2 6.245 -3.412 13.682 1.00 0.00 H new ATOM 0 HB2 ASN B 2 5.907 -4.093 15.891 1.00 0.00 H new ATOM 0 HB3 ASN B 2 7.494 -3.397 15.630 1.00 0.00 H new ATOM 0 HD21 ASN B 2 4.975 -1.916 18.510 1.00 0.00 H new ATOM 0 HD22 ASN B 2 4.419 -3.084 17.307 1.00 0.00 H new ATOM 1421 N LYS B 3 4.055 -1.043 14.505 1.00 0.00 N ATOM 1422 CA LYS B 3 2.691 -0.449 14.660 1.00 0.00 C ATOM 1423 C LYS B 3 2.737 0.705 15.710 1.00 0.00 C ATOM 1424 O LYS B 3 1.984 1.670 15.583 1.00 0.00 O ATOM 1425 CB LYS B 3 1.494 -1.405 14.946 1.00 0.00 C ATOM 1426 CG LYS B 3 0.086 -0.829 14.669 1.00 0.00 C ATOM 1427 CD LYS B 3 -1.032 -1.892 14.749 1.00 0.00 C ATOM 1428 CE LYS B 3 -2.430 -1.401 14.318 1.00 0.00 C ATOM 1429 NZ LYS B 3 -2.554 -1.207 12.859 1.00 0.00 N ATOM 0 H LYS B 3 4.764 -0.310 14.500 1.00 0.00 H new ATOM 0 HA LYS B 3 2.460 -0.088 13.658 1.00 0.00 H new ATOM 0 HB2 LYS B 3 1.622 -2.305 14.344 1.00 0.00 H new ATOM 0 HB3 LYS B 3 1.541 -1.711 15.991 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -0.123 -0.036 15.387 1.00 0.00 H new ATOM 0 HG3 LYS B 3 0.075 -0.373 13.679 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -0.752 -2.740 14.123 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -1.092 -2.258 15.774 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -3.179 -2.122 14.647 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -2.649 -0.460 14.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -3.514 -0.877 12.633 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -1.861 -0.499 12.543 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -2.374 -2.108 12.372 1.00 0.00 H new ATOM 1442 N THR B 4 3.601 0.593 16.732 1.00 0.00 N ATOM 1443 CA THR B 4 3.846 1.544 17.794 1.00 0.00 C ATOM 1444 C THR B 4 5.024 2.509 17.506 1.00 0.00 C ATOM 1445 O THR B 4 4.952 3.659 17.951 1.00 0.00 O ATOM 1446 CB THR B 4 4.103 0.623 19.001 1.00 0.00 C ATOM 1447 OG1 THR B 4 2.991 -0.226 19.302 1.00 0.00 O ATOM 1448 CG2 THR B 4 4.353 1.475 20.205 1.00 0.00 C ATOM 0 H THR B 4 4.186 -0.237 16.832 1.00 0.00 H new ATOM 0 HA THR B 4 3.017 2.236 17.943 1.00 0.00 H new ATOM 0 HB THR B 4 4.955 -0.007 18.747 1.00 0.00 H new ATOM 0 HG1 THR B 4 3.209 -0.789 20.074 1.00 0.00 H new ATOM 0 HG21 THR B 4 4.537 0.838 21.070 1.00 0.00 H new ATOM 0 HG22 THR B 4 5.223 2.108 20.029 1.00 0.00 H new ATOM 0 HG23 THR B 4 3.481 2.101 20.395 1.00 0.00 H new ATOM 1456 N GLU B 5 6.105 2.066 16.822 1.00 0.00 N ATOM 1457 CA GLU B 5 7.087 3.041 16.252 1.00 0.00 C ATOM 1458 C GLU B 5 6.377 4.017 15.237 1.00 0.00 C ATOM 1459 O GLU B 5 6.857 5.133 15.023 1.00 0.00 O ATOM 1460 CB GLU B 5 8.326 2.381 15.593 1.00 0.00 C ATOM 1461 CG GLU B 5 9.036 1.216 16.312 1.00 0.00 C ATOM 1462 CD GLU B 5 9.617 1.560 17.687 1.00 0.00 C ATOM 1463 OE1 GLU B 5 10.721 2.080 17.845 1.00 0.00 O ATOM 1464 OE2 GLU B 5 8.766 1.224 18.709 1.00 0.00 O ATOM 0 H GLU B 5 6.322 1.084 16.652 1.00 0.00 H new ATOM 0 HA GLU B 5 7.467 3.607 17.102 1.00 0.00 H new ATOM 0 HB2 GLU B 5 8.021 2.021 14.610 1.00 0.00 H new ATOM 0 HB3 GLU B 5 9.066 3.164 15.430 1.00 0.00 H new ATOM 0 HG2 GLU B 5 8.328 0.396 16.429 1.00 0.00 H new ATOM 0 HG3 GLU B 5 9.842 0.853 15.674 1.00 0.00 H new ATOM 1472 N LEU B 6 5.221 3.591 14.657 1.00 0.00 N ATOM 1473 CA LEU B 6 4.310 4.431 13.905 1.00 0.00 C ATOM 1474 C LEU B 6 3.536 5.452 14.770 1.00 0.00 C ATOM 1475 O LEU B 6 3.361 6.568 14.314 1.00 0.00 O ATOM 1476 CB LEU B 6 3.304 3.441 13.254 1.00 0.00 C ATOM 1477 CG LEU B 6 3.330 3.504 11.697 1.00 0.00 C ATOM 1478 CD1 LEU B 6 3.751 4.798 10.960 1.00 0.00 C ATOM 1479 CD2 LEU B 6 4.032 2.288 11.062 1.00 0.00 C ATOM 0 H LEU B 6 4.909 2.622 14.715 1.00 0.00 H new ATOM 0 HA LEU B 6 4.872 5.033 13.191 1.00 0.00 H new ATOM 0 HB2 LEU B 6 3.536 2.426 13.578 1.00 0.00 H new ATOM 0 HB3 LEU B 6 2.298 3.666 13.607 1.00 0.00 H new ATOM 0 HG LEU B 6 2.253 3.494 11.529 1.00 0.00 H new ATOM 0 HD11 LEU B 6 3.702 4.636 9.883 1.00 0.00 H new ATOM 0 HD12 LEU B 6 3.077 5.609 11.235 1.00 0.00 H new ATOM 0 HD13 LEU B 6 4.770 5.062 11.242 1.00 0.00 H new ATOM 0 HD21 LEU B 6 4.020 2.387 9.977 1.00 0.00 H new ATOM 0 HD22 LEU B 6 5.064 2.241 11.410 1.00 0.00 H new ATOM 0 HD23 LEU B 6 3.510 1.375 11.349 1.00 0.00 H new ATOM 1491 N ILE B 7 3.066 5.098 15.979 1.00 0.00 N ATOM 1492 CA ILE B 7 2.359 6.021 16.929 1.00 0.00 C ATOM 1493 C ILE B 7 3.269 7.219 17.317 1.00 0.00 C ATOM 1494 O ILE B 7 2.828 8.368 17.236 1.00 0.00 O ATOM 1495 CB ILE B 7 1.803 5.224 18.153 1.00 0.00 C ATOM 1496 CG1 ILE B 7 0.860 4.095 17.658 1.00 0.00 C ATOM 1497 CG2 ILE B 7 1.065 6.109 19.189 1.00 0.00 C ATOM 1498 CD1 ILE B 7 0.619 2.959 18.635 1.00 0.00 C ATOM 0 H ILE B 7 3.161 4.150 16.344 1.00 0.00 H new ATOM 0 HA ILE B 7 1.492 6.458 16.434 1.00 0.00 H new ATOM 0 HB ILE B 7 2.667 4.804 18.668 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -0.102 4.538 17.401 1.00 0.00 H new ATOM 0 HG13 ILE B 7 1.274 3.678 16.740 1.00 0.00 H new ATOM 0 HG21 ILE B 7 0.707 5.487 20.010 1.00 0.00 H new ATOM 0 HG22 ILE B 7 1.750 6.863 19.577 1.00 0.00 H new ATOM 0 HG23 ILE B 7 0.218 6.600 18.710 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -0.053 2.229 18.185 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.567 2.479 18.876 1.00 0.00 H new ATOM 0 HD13 ILE B 7 0.170 3.352 19.547 1.00 0.00 H new ATOM 1510 N ASN B 8 4.531 6.935 17.692 1.00 0.00 N ATOM 1511 CA ASN B 8 5.559 8.003 17.866 1.00 0.00 C ATOM 1512 C ASN B 8 5.947 8.769 16.551 1.00 0.00 C ATOM 1513 O ASN B 8 6.510 9.859 16.661 1.00 0.00 O ATOM 1514 CB ASN B 8 6.830 7.440 18.561 1.00 0.00 C ATOM 1515 CG ASN B 8 6.631 6.886 19.987 1.00 0.00 C ATOM 1516 OD1 ASN B 8 6.385 7.633 20.934 1.00 0.00 O ATOM 1517 ND2 ASN B 8 6.736 5.577 20.165 1.00 0.00 N ATOM 0 H ASN B 8 4.869 5.991 17.880 1.00 0.00 H new ATOM 0 HA ASN B 8 5.084 8.747 18.505 1.00 0.00 H new ATOM 0 HB2 ASN B 8 7.239 6.645 17.937 1.00 0.00 H new ATOM 0 HB3 ASN B 8 7.579 8.231 18.601 1.00 0.00 H new ATOM 0 HD21 ASN B 8 6.613 5.177 21.095 1.00 0.00 H new ATOM 0 HD22 ASN B 8 6.940 4.969 19.372 1.00 0.00 H new ATOM 1524 N ALA B 9 5.658 8.240 15.338 1.00 0.00 N ATOM 1525 CA ALA B 9 5.786 8.999 14.061 1.00 0.00 C ATOM 1526 C ALA B 9 4.753 10.124 13.905 1.00 0.00 C ATOM 1527 O ALA B 9 5.096 11.239 13.518 1.00 0.00 O ATOM 1528 CB ALA B 9 5.518 8.075 12.838 1.00 0.00 C ATOM 0 H ALA B 9 5.331 7.282 15.212 1.00 0.00 H new ATOM 0 HA ALA B 9 6.798 9.401 14.095 1.00 0.00 H new ATOM 0 HB1 ALA B 9 5.617 8.651 11.918 1.00 0.00 H new ATOM 0 HB2 ALA B 9 6.240 7.258 12.834 1.00 0.00 H new ATOM 0 HB3 ALA B 9 4.509 7.668 12.904 1.00 0.00 H new ATOM 1534 N VAL B 10 3.487 9.784 14.181 1.00 0.00 N ATOM 1535 CA VAL B 10 2.311 10.640 14.017 1.00 0.00 C ATOM 1536 C VAL B 10 2.321 11.752 15.023 1.00 0.00 C ATOM 1537 O VAL B 10 2.287 12.923 14.657 1.00 0.00 O ATOM 1538 CB VAL B 10 0.961 9.861 14.045 1.00 0.00 C ATOM 1539 CG1 VAL B 10 -0.142 10.551 13.263 1.00 0.00 C ATOM 1540 CG2 VAL B 10 1.117 8.446 13.526 1.00 0.00 C ATOM 0 H VAL B 10 3.247 8.861 14.541 1.00 0.00 H new ATOM 0 HA VAL B 10 2.381 11.068 13.017 1.00 0.00 H new ATOM 0 HB VAL B 10 0.670 9.837 15.095 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.055 9.959 13.322 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -0.323 11.540 13.685 1.00 0.00 H new ATOM 0 HG13 VAL B 10 0.159 10.651 12.220 1.00 0.00 H new ATOM 0 HG21 VAL B 10 0.154 7.937 13.562 1.00 0.00 H new ATOM 0 HG22 VAL B 10 1.475 8.473 12.497 1.00 0.00 H new ATOM 0 HG23 VAL B 10 1.835 7.908 14.145 1.00 0.00 H new ATOM 1550 N ALA B 11 2.418 11.343 16.288 1.00 0.00 N ATOM 1551 CA ALA B 11 2.535 12.286 17.379 1.00 0.00 C ATOM 1552 C ALA B 11 3.803 13.179 17.373 1.00 0.00 C ATOM 1553 O ALA B 11 3.735 14.282 17.924 1.00 0.00 O ATOM 1554 CB ALA B 11 2.346 11.496 18.674 1.00 0.00 C ATOM 0 H ALA B 11 2.417 10.364 16.573 1.00 0.00 H new ATOM 0 HA ALA B 11 1.756 13.040 17.266 1.00 0.00 H new ATOM 0 HB1 ALA B 11 2.427 12.170 19.527 1.00 0.00 H new ATOM 0 HB2 ALA B 11 1.362 11.027 18.674 1.00 0.00 H new ATOM 0 HB3 ALA B 11 3.114 10.726 18.746 1.00 0.00 H new ATOM 1560 N GLU B 12 4.922 12.743 16.737 1.00 0.00 N ATOM 1561 CA GLU B 12 6.077 13.637 16.499 1.00 0.00 C ATOM 1562 C GLU B 12 5.802 14.602 15.312 1.00 0.00 C ATOM 1563 O GLU B 12 5.959 15.812 15.509 1.00 0.00 O ATOM 1564 CB GLU B 12 7.380 12.809 16.351 1.00 0.00 C ATOM 1565 CG GLU B 12 8.676 13.627 16.173 1.00 0.00 C ATOM 1566 CD GLU B 12 9.919 12.740 16.077 1.00 0.00 C ATOM 1567 OE1 GLU B 12 10.624 12.455 17.044 1.00 0.00 O ATOM 1568 OE2 GLU B 12 10.146 12.302 14.796 1.00 0.00 O ATOM 0 H GLU B 12 5.045 11.793 16.386 1.00 0.00 H new ATOM 0 HA GLU B 12 6.223 14.280 17.367 1.00 0.00 H new ATOM 0 HB2 GLU B 12 7.489 12.177 17.232 1.00 0.00 H new ATOM 0 HB3 GLU B 12 7.271 12.144 15.494 1.00 0.00 H new ATOM 0 HG2 GLU B 12 8.597 14.235 15.272 1.00 0.00 H new ATOM 0 HG3 GLU B 12 8.787 14.313 17.012 1.00 0.00 H new ATOM 1576 N THR B 13 5.387 14.108 14.122 1.00 0.00 N ATOM 1577 CA THR B 13 5.143 15.002 12.935 1.00 0.00 C ATOM 1578 C THR B 13 3.717 15.600 12.710 1.00 0.00 C ATOM 1579 O THR B 13 3.388 16.106 11.633 1.00 0.00 O ATOM 1580 CB THR B 13 5.832 14.353 11.713 1.00 0.00 C ATOM 1581 OG1 THR B 13 6.359 15.355 10.849 1.00 0.00 O ATOM 1582 CG2 THR B 13 5.027 13.369 10.877 1.00 0.00 C ATOM 0 H THR B 13 5.213 13.118 13.946 1.00 0.00 H new ATOM 0 HA THR B 13 5.607 15.963 13.158 1.00 0.00 H new ATOM 0 HB THR B 13 6.605 13.743 12.180 1.00 0.00 H new ATOM 0 HG1 THR B 13 6.793 14.929 10.081 1.00 0.00 H new ATOM 0 HG21 THR B 13 5.643 12.999 10.057 1.00 0.00 H new ATOM 0 HG22 THR B 13 4.713 12.533 11.502 1.00 0.00 H new ATOM 0 HG23 THR B 13 4.147 13.870 10.472 1.00 0.00 H new ATOM 1590 N SER B 14 2.929 15.584 13.783 1.00 0.00 N ATOM 1591 CA SER B 14 1.559 16.170 13.847 1.00 0.00 C ATOM 1592 C SER B 14 1.264 16.882 15.204 1.00 0.00 C ATOM 1593 O SER B 14 0.556 17.894 15.181 1.00 0.00 O ATOM 1594 CB SER B 14 0.457 15.126 13.529 1.00 0.00 C ATOM 1595 OG SER B 14 -0.820 15.740 13.393 1.00 0.00 O ATOM 0 H SER B 14 3.217 15.156 14.663 1.00 0.00 H new ATOM 0 HA SER B 14 1.535 16.933 13.069 1.00 0.00 H new ATOM 0 HB2 SER B 14 0.708 14.599 12.609 1.00 0.00 H new ATOM 0 HB3 SER B 14 0.421 14.380 14.323 1.00 0.00 H new ATOM 0 HG SER B 14 -1.492 15.056 13.191 1.00 0.00 H new ATOM 1601 N GLY B 15 1.742 16.372 16.365 1.00 0.00 N ATOM 1602 CA GLY B 15 1.421 16.962 17.690 1.00 0.00 C ATOM 1603 C GLY B 15 -0.030 16.781 18.172 1.00 0.00 C ATOM 1604 O GLY B 15 -0.771 17.744 18.382 1.00 0.00 O ATOM 0 H GLY B 15 2.350 15.555 16.412 1.00 0.00 H new ATOM 0 HA2 GLY B 15 2.088 16.524 18.433 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.641 18.029 17.654 1.00 0.00 H new ATOM 1608 N LEU B 16 -0.371 15.509 18.365 1.00 0.00 N ATOM 1609 CA LEU B 16 -1.689 15.042 18.844 1.00 0.00 C ATOM 1610 C LEU B 16 -1.444 14.448 20.267 1.00 0.00 C ATOM 1611 O LEU B 16 -0.949 15.117 21.182 1.00 0.00 O ATOM 1612 CB LEU B 16 -2.501 14.369 17.674 1.00 0.00 C ATOM 1613 CG LEU B 16 -1.714 13.333 16.857 1.00 0.00 C ATOM 1614 CD1 LEU B 16 -0.877 12.362 17.612 1.00 0.00 C ATOM 1615 CD2 LEU B 16 -2.138 12.742 15.506 1.00 0.00 C ATOM 0 H LEU B 16 0.278 14.742 18.189 1.00 0.00 H new ATOM 0 HA LEU B 16 -2.472 15.765 19.072 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -3.383 13.886 18.094 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -2.855 15.149 17.000 1.00 0.00 H new ATOM 0 HG LEU B 16 -1.174 14.201 16.478 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -0.378 11.691 16.913 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -0.129 12.901 18.193 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -1.510 11.782 18.284 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -1.383 12.033 15.166 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -3.094 12.229 15.617 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -2.239 13.543 14.774 1.00 0.00 H new ATOM 1627 N SER B 17 -1.829 13.197 20.414 1.00 0.00 N ATOM 1628 CA SER B 17 -1.587 12.346 21.605 1.00 0.00 C ATOM 1629 C SER B 17 -1.039 10.951 21.183 1.00 0.00 C ATOM 1630 O SER B 17 -1.195 10.493 20.055 1.00 0.00 O ATOM 1631 CB SER B 17 -2.869 12.210 22.452 1.00 0.00 C ATOM 1632 OG SER B 17 -3.348 13.475 22.898 1.00 0.00 O ATOM 0 H SER B 17 -2.344 12.705 19.684 1.00 0.00 H new ATOM 0 HA SER B 17 -0.830 12.830 22.223 1.00 0.00 H new ATOM 0 HB2 SER B 17 -3.642 11.716 21.863 1.00 0.00 H new ATOM 0 HB3 SER B 17 -2.669 11.573 23.314 1.00 0.00 H new ATOM 0 HG SER B 17 -4.162 13.348 23.429 1.00 0.00 H new ATOM 1638 N LYS B 18 -0.399 10.240 22.122 1.00 0.00 N ATOM 1639 CA LYS B 18 -0.017 8.798 21.961 1.00 0.00 C ATOM 1640 C LYS B 18 -1.294 7.930 21.712 1.00 0.00 C ATOM 1641 O LYS B 18 -1.353 7.217 20.715 1.00 0.00 O ATOM 1642 CB LYS B 18 0.800 8.378 23.217 1.00 0.00 C ATOM 1643 CG LYS B 18 1.514 7.009 23.163 1.00 0.00 C ATOM 1644 CD LYS B 18 2.904 7.040 22.488 1.00 0.00 C ATOM 1645 CE LYS B 18 3.681 5.712 22.567 1.00 0.00 C ATOM 1646 NZ LYS B 18 3.124 4.652 21.708 1.00 0.00 N ATOM 0 H LYS B 18 -0.124 10.634 23.022 1.00 0.00 H new ATOM 0 HA LYS B 18 0.615 8.640 21.087 1.00 0.00 H new ATOM 0 HB2 LYS B 18 1.551 9.145 23.404 1.00 0.00 H new ATOM 0 HB3 LYS B 18 0.127 8.375 24.074 1.00 0.00 H new ATOM 0 HG2 LYS B 18 1.625 6.631 24.179 1.00 0.00 H new ATOM 0 HG3 LYS B 18 0.879 6.303 22.628 1.00 0.00 H new ATOM 0 HD2 LYS B 18 2.779 7.312 21.440 1.00 0.00 H new ATOM 0 HD3 LYS B 18 3.502 7.825 22.952 1.00 0.00 H new ATOM 0 HE2 LYS B 18 4.718 5.890 22.284 1.00 0.00 H new ATOM 0 HE3 LYS B 18 3.687 5.365 23.600 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 3.520 3.733 21.990 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 2.089 4.629 21.811 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 3.369 4.845 20.716 1.00 0.00 H new ATOM 1659 N LYS B 19 -2.329 8.080 22.559 1.00 0.00 N ATOM 1660 CA LYS B 19 -3.684 7.503 22.340 1.00 0.00 C ATOM 1661 C LYS B 19 -4.361 8.001 21.021 1.00 0.00 C ATOM 1662 O LYS B 19 -4.965 7.164 20.347 1.00 0.00 O ATOM 1663 CB LYS B 19 -4.619 7.781 23.550 1.00 0.00 C ATOM 1664 CG LYS B 19 -4.218 7.062 24.859 1.00 0.00 C ATOM 1665 CD LYS B 19 -5.181 7.369 26.022 1.00 0.00 C ATOM 1666 CE LYS B 19 -4.796 6.640 27.322 1.00 0.00 C ATOM 1667 NZ LYS B 19 -5.729 6.962 28.416 1.00 0.00 N ATOM 0 H LYS B 19 -2.255 8.610 23.427 1.00 0.00 H new ATOM 0 HA LYS B 19 -3.533 6.428 22.240 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -4.641 8.855 23.734 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -5.633 7.482 23.284 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -4.195 5.986 24.686 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -3.208 7.362 25.139 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -5.194 8.444 26.203 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -6.193 7.082 25.736 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -4.792 5.564 27.150 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -3.783 6.920 27.611 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -5.442 6.455 29.278 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -5.713 7.986 28.595 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -6.691 6.672 28.148 1.00 0.00 H new ATOM 1680 N ASP B 20 -4.265 9.303 20.628 1.00 0.00 N ATOM 1681 CA ASP B 20 -4.810 9.767 19.307 1.00 0.00 C ATOM 1682 C ASP B 20 -4.056 9.209 18.063 1.00 0.00 C ATOM 1683 O ASP B 20 -4.700 8.965 17.045 1.00 0.00 O ATOM 1684 CB ASP B 20 -4.914 11.315 19.219 1.00 0.00 C ATOM 1685 CG ASP B 20 -6.140 11.896 19.936 1.00 0.00 C ATOM 1686 OD1 ASP B 20 -6.097 12.390 21.062 1.00 0.00 O ATOM 1687 OD2 ASP B 20 -7.279 11.798 19.176 1.00 0.00 O ATOM 0 H ASP B 20 -3.829 10.037 21.186 1.00 0.00 H new ATOM 0 HA ASP B 20 -5.814 9.343 19.276 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -4.013 11.755 19.646 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -4.946 11.608 18.170 1.00 0.00 H new ATOM 1693 N ALA B 21 -2.729 9.016 18.136 1.00 0.00 N ATOM 1694 CA ALA B 21 -1.914 8.375 17.076 1.00 0.00 C ATOM 1695 C ALA B 21 -2.142 6.836 16.938 1.00 0.00 C ATOM 1696 O ALA B 21 -2.155 6.339 15.810 1.00 0.00 O ATOM 1697 CB ALA B 21 -0.458 8.785 17.332 1.00 0.00 C ATOM 0 H ALA B 21 -2.178 9.304 18.944 1.00 0.00 H new ATOM 0 HA ALA B 21 -2.228 8.729 16.094 1.00 0.00 H new ATOM 0 HB1 ALA B 21 0.185 8.336 16.575 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -0.372 9.871 17.284 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -0.151 8.440 18.319 1.00 0.00 H new ATOM 1703 N THR B 22 -2.358 6.098 18.053 1.00 0.00 N ATOM 1704 CA THR B 22 -2.777 4.666 18.063 1.00 0.00 C ATOM 1705 C THR B 22 -4.123 4.433 17.320 1.00 0.00 C ATOM 1706 O THR B 22 -4.226 3.567 16.446 1.00 0.00 O ATOM 1707 CB THR B 22 -2.849 4.164 19.543 1.00 0.00 C ATOM 1708 OG1 THR B 22 -1.757 4.600 20.343 1.00 0.00 O ATOM 1709 CG2 THR B 22 -2.855 2.641 19.613 1.00 0.00 C ATOM 0 H THR B 22 -2.245 6.484 18.991 1.00 0.00 H new ATOM 0 HA THR B 22 -2.031 4.088 17.517 1.00 0.00 H new ATOM 0 HB THR B 22 -3.775 4.589 19.929 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.932 5.507 20.669 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.906 2.325 20.655 1.00 0.00 H new ATOM 0 HG22 THR B 22 -3.721 2.255 19.074 1.00 0.00 H new ATOM 0 HG23 THR B 22 -1.943 2.252 19.160 1.00 0.00 H new ATOM 1717 N LYS B 23 -5.123 5.242 17.692 1.00 0.00 N ATOM 1718 CA LYS B 23 -6.434 5.315 17.019 1.00 0.00 C ATOM 1719 C LYS B 23 -6.369 5.693 15.526 1.00 0.00 C ATOM 1720 O LYS B 23 -6.990 5.017 14.724 1.00 0.00 O ATOM 1721 CB LYS B 23 -7.238 6.453 17.708 1.00 0.00 C ATOM 1722 CG LYS B 23 -7.812 6.125 19.104 1.00 0.00 C ATOM 1723 CD LYS B 23 -8.459 7.354 19.771 1.00 0.00 C ATOM 1724 CE LYS B 23 -8.974 7.061 21.191 1.00 0.00 C ATOM 1725 NZ LYS B 23 -9.560 8.264 21.806 1.00 0.00 N ATOM 0 H LYS B 23 -5.046 5.879 18.485 1.00 0.00 H new ATOM 0 HA LYS B 23 -6.877 4.322 17.093 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -6.591 7.325 17.799 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -8.063 6.735 17.054 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -8.553 5.331 19.013 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -7.015 5.745 19.743 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -7.731 8.164 19.814 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -9.287 7.702 19.154 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -9.721 6.269 21.153 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -8.154 6.696 21.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -9.898 8.035 22.762 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -8.839 9.011 21.863 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -10.357 8.596 21.227 1.00 0.00 H new ATOM 1738 N ALA B 24 -5.660 6.777 15.204 1.00 0.00 N ATOM 1739 CA ALA B 24 -5.507 7.326 13.846 1.00 0.00 C ATOM 1740 C ALA B 24 -4.839 6.414 12.790 1.00 0.00 C ATOM 1741 O ALA B 24 -5.218 6.455 11.625 1.00 0.00 O ATOM 1742 CB ALA B 24 -4.824 8.666 14.009 1.00 0.00 C ATOM 0 H ALA B 24 -5.156 7.320 15.905 1.00 0.00 H new ATOM 0 HA ALA B 24 -6.499 7.423 13.404 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -4.683 9.124 13.030 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -5.442 9.316 14.628 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -3.855 8.525 14.487 1.00 0.00 H new ATOM 1748 N VAL B 25 -3.871 5.588 13.198 1.00 0.00 N ATOM 1749 CA VAL B 25 -3.359 4.429 12.406 1.00 0.00 C ATOM 1750 C VAL B 25 -4.525 3.392 12.240 1.00 0.00 C ATOM 1751 O VAL B 25 -4.878 3.092 11.099 1.00 0.00 O ATOM 1752 CB VAL B 25 -2.177 3.918 13.325 1.00 0.00 C ATOM 1753 CG1 VAL B 25 -1.866 2.411 13.199 1.00 0.00 C ATOM 1754 CG2 VAL B 25 -0.882 4.726 13.123 1.00 0.00 C ATOM 0 H VAL B 25 -3.404 5.694 14.099 1.00 0.00 H new ATOM 0 HA VAL B 25 -3.018 4.639 11.392 1.00 0.00 H new ATOM 0 HB VAL B 25 -2.553 4.081 14.335 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -1.043 2.152 13.865 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.749 1.833 13.472 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -1.586 2.182 12.171 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -0.103 4.334 13.777 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -0.560 4.643 12.085 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -1.065 5.773 13.364 1.00 0.00 H new ATOM 1764 N ASP B 26 -5.132 2.883 13.343 1.00 0.00 N ATOM 1765 CA ASP B 26 -6.357 2.010 13.268 1.00 0.00 C ATOM 1766 C ASP B 26 -7.721 2.767 12.980 1.00 0.00 C ATOM 1767 O ASP B 26 -8.814 2.419 13.431 1.00 0.00 O ATOM 1768 CB ASP B 26 -6.391 1.220 14.594 1.00 0.00 C ATOM 1769 CG ASP B 26 -7.229 -0.066 14.559 1.00 0.00 C ATOM 1770 OD1 ASP B 26 -8.367 -0.148 15.019 1.00 0.00 O ATOM 1771 OD2 ASP B 26 -6.563 -1.101 13.952 1.00 0.00 O ATOM 0 H ASP B 26 -4.804 3.054 14.294 1.00 0.00 H new ATOM 0 HA ASP B 26 -6.275 1.358 12.398 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -5.369 0.963 14.873 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -6.782 1.870 15.377 1.00 0.00 H new ATOM 1777 N ALA B 27 -7.559 3.849 12.232 1.00 0.00 N ATOM 1778 CA ALA B 27 -8.584 4.750 11.673 1.00 0.00 C ATOM 1779 C ALA B 27 -8.450 4.751 10.135 1.00 0.00 C ATOM 1780 O ALA B 27 -9.446 4.555 9.432 1.00 0.00 O ATOM 1781 CB ALA B 27 -8.455 6.147 12.238 1.00 0.00 C ATOM 0 H ALA B 27 -6.622 4.156 11.971 1.00 0.00 H new ATOM 0 HA ALA B 27 -9.575 4.392 11.951 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -9.225 6.787 11.806 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -8.576 6.114 13.321 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -7.471 6.548 11.995 1.00 0.00 H new ATOM 1787 N VAL B 28 -7.205 4.954 9.631 1.00 0.00 N ATOM 1788 CA VAL B 28 -6.833 4.689 8.223 1.00 0.00 C ATOM 1789 C VAL B 28 -7.131 3.183 7.944 1.00 0.00 C ATOM 1790 O VAL B 28 -8.152 2.868 7.336 1.00 0.00 O ATOM 1791 CB VAL B 28 -5.313 4.976 7.899 1.00 0.00 C ATOM 1792 CG1 VAL B 28 -5.074 4.935 6.399 1.00 0.00 C ATOM 1793 CG2 VAL B 28 -4.715 6.258 8.408 1.00 0.00 C ATOM 0 H VAL B 28 -6.431 5.307 10.194 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.412 5.363 7.591 1.00 0.00 H new ATOM 0 HB VAL B 28 -4.810 4.180 8.448 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -4.023 5.135 6.193 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -5.338 3.950 6.015 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.689 5.691 5.912 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -3.668 6.315 8.109 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -5.259 7.105 7.989 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -4.783 6.285 9.496 1.00 0.00 H new ATOM 1803 N PHE B 29 -6.273 2.331 8.537 1.00 0.00 N ATOM 1804 CA PHE B 29 -6.217 0.859 8.400 1.00 0.00 C ATOM 1805 C PHE B 29 -7.465 0.070 8.850 1.00 0.00 C ATOM 1806 O PHE B 29 -7.546 -1.101 8.484 1.00 0.00 O ATOM 1807 CB PHE B 29 -4.877 0.362 9.037 1.00 0.00 C ATOM 1808 CG PHE B 29 -3.590 0.997 8.457 1.00 0.00 C ATOM 1809 CD1 PHE B 29 -3.386 1.014 7.073 1.00 0.00 C ATOM 1810 CD2 PHE B 29 -2.701 1.691 9.281 1.00 0.00 C ATOM 1811 CE1 PHE B 29 -2.364 1.764 6.514 1.00 0.00 C ATOM 1812 CE2 PHE B 29 -1.676 2.450 8.725 1.00 0.00 C ATOM 1813 CZ PHE B 29 -1.529 2.500 7.339 1.00 0.00 C ATOM 0 H PHE B 29 -5.550 2.675 9.169 1.00 0.00 H new ATOM 0 HA PHE B 29 -6.230 0.635 7.333 1.00 0.00 H new ATOM 0 HB2 PHE B 29 -4.908 0.560 10.108 1.00 0.00 H new ATOM 0 HB3 PHE B 29 -4.815 -0.719 8.914 1.00 0.00 H new ATOM 0 HD1 PHE B 29 -4.034 0.435 6.432 1.00 0.00 H new ATOM 0 HD2 PHE B 29 -2.810 1.638 10.354 1.00 0.00 H new ATOM 0 HE1 PHE B 29 -2.219 1.775 5.444 1.00 0.00 H new ATOM 0 HE2 PHE B 29 -0.998 2.997 9.363 1.00 0.00 H new ATOM 0 HZ PHE B 29 -0.757 3.118 6.905 1.00 0.00 H new ATOM 1823 N ASP B 30 -8.414 0.681 9.595 1.00 0.00 N ATOM 1824 CA ASP B 30 -9.747 0.068 9.865 1.00 0.00 C ATOM 1825 C ASP B 30 -10.750 0.267 8.690 1.00 0.00 C ATOM 1826 O ASP B 30 -11.476 -0.661 8.327 1.00 0.00 O ATOM 1827 CB ASP B 30 -10.311 0.649 11.178 1.00 0.00 C ATOM 1828 CG ASP B 30 -11.395 -0.211 11.840 1.00 0.00 C ATOM 1829 OD1 ASP B 30 -11.152 -1.241 12.467 1.00 0.00 O ATOM 1830 OD2 ASP B 30 -12.653 0.303 11.652 1.00 0.00 O ATOM 0 H ASP B 30 -8.287 1.598 10.023 1.00 0.00 H new ATOM 0 HA ASP B 30 -9.611 -1.009 9.964 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.491 0.783 11.883 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.723 1.638 10.976 1.00 0.00 H new ATOM 1836 N SER B 31 -10.786 1.483 8.123 1.00 0.00 N ATOM 1837 CA SER B 31 -11.573 1.790 6.894 1.00 0.00 C ATOM 1838 C SER B 31 -11.066 1.049 5.607 1.00 0.00 C ATOM 1839 O SER B 31 -11.885 0.718 4.747 1.00 0.00 O ATOM 1840 CB SER B 31 -11.648 3.319 6.689 1.00 0.00 C ATOM 1841 OG SER B 31 -12.257 3.961 7.805 1.00 0.00 O ATOM 0 H SER B 31 -10.277 2.285 8.493 1.00 0.00 H new ATOM 0 HA SER B 31 -12.578 1.399 7.055 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.645 3.718 6.540 1.00 0.00 H new ATOM 0 HB3 SER B 31 -12.216 3.540 5.785 1.00 0.00 H new ATOM 0 HG SER B 31 -11.565 4.231 8.445 1.00 0.00 H new ATOM 1847 N ILE B 32 -9.752 0.745 5.493 1.00 0.00 N ATOM 1848 CA ILE B 32 -9.123 -0.035 4.395 1.00 0.00 C ATOM 1849 C ILE B 32 -9.529 -1.501 4.521 1.00 0.00 C ATOM 1850 O ILE B 32 -10.122 -2.005 3.586 1.00 0.00 O ATOM 1851 CB ILE B 32 -7.574 0.116 4.357 1.00 0.00 C ATOM 1852 CG1 ILE B 32 -7.198 1.562 4.702 1.00 0.00 C ATOM 1853 CG2 ILE B 32 -7.042 -0.390 3.004 1.00 0.00 C ATOM 1854 CD1 ILE B 32 -5.878 2.182 4.395 1.00 0.00 C ATOM 0 H ILE B 32 -9.072 1.047 6.190 1.00 0.00 H new ATOM 0 HA ILE B 32 -9.486 0.367 3.449 1.00 0.00 H new ATOM 0 HB ILE B 32 -7.090 -0.504 5.111 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -7.947 2.192 4.223 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -7.337 1.663 5.778 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -5.957 -0.284 2.977 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -7.308 -1.440 2.878 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.484 0.195 2.197 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -5.871 3.215 4.744 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -5.088 1.624 4.898 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -5.708 2.162 3.319 1.00 0.00 H new ATOM 1866 N THR B 33 -9.244 -2.177 5.640 1.00 0.00 N ATOM 1867 CA THR B 33 -9.717 -3.588 5.840 1.00 0.00 C ATOM 1868 C THR B 33 -11.257 -3.813 5.664 1.00 0.00 C ATOM 1869 O THR B 33 -11.638 -4.897 5.229 1.00 0.00 O ATOM 1870 CB THR B 33 -9.219 -4.154 7.198 1.00 0.00 C ATOM 1871 OG1 THR B 33 -9.605 -5.514 7.374 1.00 0.00 O ATOM 1872 CG2 THR B 33 -9.675 -3.334 8.412 1.00 0.00 C ATOM 0 H THR B 33 -8.702 -1.797 6.416 1.00 0.00 H new ATOM 0 HA THR B 33 -9.265 -4.149 5.022 1.00 0.00 H new ATOM 0 HB THR B 33 -8.132 -4.086 7.149 1.00 0.00 H new ATOM 0 HG1 THR B 33 -9.274 -5.839 8.237 1.00 0.00 H new ATOM 0 HG21 THR B 33 -9.289 -3.789 9.324 1.00 0.00 H new ATOM 0 HG22 THR B 33 -9.296 -2.316 8.326 1.00 0.00 H new ATOM 0 HG23 THR B 33 -10.764 -3.314 8.449 1.00 0.00 H new ATOM 1880 N GLU B 34 -12.113 -2.819 5.990 1.00 0.00 N ATOM 1881 CA GLU B 34 -13.554 -2.842 5.609 1.00 0.00 C ATOM 1882 C GLU B 34 -13.746 -2.704 4.067 1.00 0.00 C ATOM 1883 O GLU B 34 -14.598 -3.403 3.519 1.00 0.00 O ATOM 1884 CB GLU B 34 -14.368 -1.794 6.422 1.00 0.00 C ATOM 1885 CG GLU B 34 -14.989 -2.299 7.743 1.00 0.00 C ATOM 1886 CD GLU B 34 -13.997 -2.700 8.841 1.00 0.00 C ATOM 1887 OE1 GLU B 34 -13.440 -3.796 8.883 1.00 0.00 O ATOM 1888 OE2 GLU B 34 -13.813 -1.704 9.765 1.00 0.00 O ATOM 0 H GLU B 34 -11.837 -1.989 6.515 1.00 0.00 H new ATOM 0 HA GLU B 34 -13.957 -3.820 5.874 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -13.714 -0.952 6.649 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -15.169 -1.414 5.788 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -15.641 -1.519 8.137 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -15.620 -3.159 7.519 1.00 0.00 H new ATOM 1896 N ALA B 35 -12.955 -1.858 3.367 1.00 0.00 N ATOM 1897 CA ALA B 35 -12.893 -1.835 1.886 1.00 0.00 C ATOM 1898 C ALA B 35 -12.455 -3.195 1.276 1.00 0.00 C ATOM 1899 O ALA B 35 -13.208 -3.799 0.520 1.00 0.00 O ATOM 1900 CB ALA B 35 -11.919 -0.711 1.393 1.00 0.00 C ATOM 0 H ALA B 35 -12.343 -1.174 3.811 1.00 0.00 H new ATOM 0 HA ALA B 35 -13.907 -1.631 1.543 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -11.887 -0.710 0.303 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -12.272 0.258 1.747 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -10.919 -0.898 1.785 1.00 0.00 H new ATOM 1906 N LEU B 36 -11.286 -3.712 1.675 1.00 0.00 N ATOM 1907 CA LEU B 36 -10.678 -4.960 1.167 1.00 0.00 C ATOM 1908 C LEU B 36 -11.537 -6.185 1.467 1.00 0.00 C ATOM 1909 O LEU B 36 -11.881 -6.907 0.527 1.00 0.00 O ATOM 1910 CB LEU B 36 -9.220 -5.050 1.650 1.00 0.00 C ATOM 1911 CG LEU B 36 -8.389 -3.735 1.416 1.00 0.00 C ATOM 1912 CD1 LEU B 36 -6.897 -3.894 1.584 1.00 0.00 C ATOM 1913 CD2 LEU B 36 -8.586 -3.059 0.044 1.00 0.00 C ATOM 0 H LEU B 36 -10.712 -3.260 2.387 1.00 0.00 H new ATOM 0 HA LEU B 36 -10.644 -4.938 0.078 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -9.214 -5.288 2.714 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -8.728 -5.876 1.136 1.00 0.00 H new ATOM 0 HG LEU B 36 -8.804 -3.106 2.203 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -6.407 -2.937 1.404 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.679 -4.228 2.598 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.527 -4.631 0.871 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -7.968 -2.163 -0.012 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -8.296 -3.750 -0.747 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -9.634 -2.786 -0.080 1.00 0.00 H new ATOM 1925 N ARG B 37 -11.968 -6.384 2.731 1.00 0.00 N ATOM 1926 CA ARG B 37 -12.889 -7.493 3.032 1.00 0.00 C ATOM 1927 C ARG B 37 -14.250 -7.423 2.255 1.00 0.00 C ATOM 1928 O ARG B 37 -14.789 -8.485 1.929 1.00 0.00 O ATOM 1929 CB ARG B 37 -13.106 -7.724 4.553 1.00 0.00 C ATOM 1930 CG ARG B 37 -14.203 -6.851 5.207 1.00 0.00 C ATOM 1931 CD ARG B 37 -14.363 -7.055 6.710 1.00 0.00 C ATOM 1932 NE ARG B 37 -15.354 -6.129 7.317 1.00 0.00 N ATOM 1933 CZ ARG B 37 -16.688 -6.324 7.343 1.00 0.00 C ATOM 1934 NH1 ARG B 37 -17.297 -7.385 6.816 1.00 0.00 N ATOM 1935 NH2 ARG B 37 -17.440 -5.408 7.925 1.00 0.00 N ATOM 0 H ARG B 37 -11.703 -5.812 3.532 1.00 0.00 H new ATOM 0 HA ARG B 37 -12.371 -8.374 2.653 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -13.357 -8.773 4.712 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -12.164 -7.540 5.069 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -13.975 -5.802 5.018 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -15.155 -7.063 4.721 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -14.669 -8.083 6.901 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -13.397 -6.915 7.195 1.00 0.00 H new ATOM 0 HE ARG B 37 -14.996 -5.277 7.749 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -16.748 -8.112 6.358 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -18.312 -7.470 6.871 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -17.009 -4.582 8.339 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -18.452 -5.527 7.961 1.00 0.00 H new ATOM 1948 N LYS B 38 -14.799 -6.198 2.002 1.00 0.00 N ATOM 1949 CA LYS B 38 -16.122 -6.060 1.331 1.00 0.00 C ATOM 1950 C LYS B 38 -16.076 -5.821 -0.224 1.00 0.00 C ATOM 1951 O LYS B 38 -17.114 -5.494 -0.810 1.00 0.00 O ATOM 1952 CB LYS B 38 -16.979 -4.966 2.039 1.00 0.00 C ATOM 1953 CG LYS B 38 -17.397 -5.272 3.499 1.00 0.00 C ATOM 1954 CD LYS B 38 -18.359 -4.249 4.136 1.00 0.00 C ATOM 1955 CE LYS B 38 -17.692 -2.917 4.528 1.00 0.00 C ATOM 1956 NZ LYS B 38 -18.643 -2.002 5.183 1.00 0.00 N ATOM 0 H LYS B 38 -14.356 -5.313 2.247 1.00 0.00 H new ATOM 0 HA LYS B 38 -16.594 -7.037 1.438 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -16.418 -4.031 2.031 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -17.881 -4.802 1.450 1.00 0.00 H new ATOM 0 HG2 LYS B 38 -17.867 -6.255 3.527 1.00 0.00 H new ATOM 0 HG3 LYS B 38 -16.498 -5.332 4.112 1.00 0.00 H new ATOM 0 HD2 LYS B 38 -19.170 -4.045 3.437 1.00 0.00 H new ATOM 0 HD3 LYS B 38 -18.808 -4.693 5.024 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -16.855 -3.113 5.198 1.00 0.00 H new ATOM 0 HE3 LYS B 38 -17.282 -2.440 3.638 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -18.157 -1.117 5.432 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 -19.429 -1.795 4.534 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 -19.015 -2.447 6.046 1.00 0.00 H new ATOM 1969 N GLY B 39 -14.925 -5.998 -0.910 1.00 0.00 N ATOM 1970 CA GLY B 39 -14.799 -5.711 -2.366 1.00 0.00 C ATOM 1971 C GLY B 39 -14.850 -4.218 -2.805 1.00 0.00 C ATOM 1972 O GLY B 39 -15.463 -3.909 -3.829 1.00 0.00 O ATOM 0 H GLY B 39 -14.065 -6.339 -0.482 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -13.856 -6.133 -2.713 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -15.596 -6.243 -2.885 1.00 0.00 H new ATOM 1976 N ASP B 40 -14.190 -3.324 -2.045 1.00 0.00 N ATOM 1977 CA ASP B 40 -14.159 -1.854 -2.299 1.00 0.00 C ATOM 1978 C ASP B 40 -12.715 -1.364 -2.572 1.00 0.00 C ATOM 1979 O ASP B 40 -11.753 -1.801 -1.928 1.00 0.00 O ATOM 1980 CB ASP B 40 -14.844 -0.989 -1.207 1.00 0.00 C ATOM 1981 CG ASP B 40 -16.251 -1.416 -0.762 1.00 0.00 C ATOM 1982 OD1 ASP B 40 -16.480 -1.974 0.311 1.00 0.00 O ATOM 1983 OD2 ASP B 40 -17.206 -1.111 -1.697 1.00 0.00 O ATOM 0 H ASP B 40 -13.652 -3.597 -1.223 1.00 0.00 H new ATOM 0 HA ASP B 40 -14.763 -1.711 -3.195 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -14.199 -0.979 -0.328 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -14.901 0.036 -1.573 1.00 0.00 H new ATOM 1989 N LYS B 41 -12.592 -0.423 -3.531 1.00 0.00 N ATOM 1990 CA LYS B 41 -11.293 0.199 -3.879 1.00 0.00 C ATOM 1991 C LYS B 41 -11.078 1.438 -2.973 1.00 0.00 C ATOM 1992 O LYS B 41 -11.916 2.341 -2.866 1.00 0.00 O ATOM 1993 CB LYS B 41 -11.166 0.686 -5.343 1.00 0.00 C ATOM 1994 CG LYS B 41 -11.539 -0.315 -6.458 1.00 0.00 C ATOM 1995 CD LYS B 41 -11.211 0.238 -7.862 1.00 0.00 C ATOM 1996 CE LYS B 41 -11.593 -0.685 -9.033 1.00 0.00 C ATOM 1997 NZ LYS B 41 -10.750 -1.893 -9.124 1.00 0.00 N ATOM 0 H LYS B 41 -13.378 -0.075 -4.081 1.00 0.00 H new ATOM 0 HA LYS B 41 -10.551 -0.586 -3.736 1.00 0.00 H new ATOM 0 HB2 LYS B 41 -11.793 1.570 -5.460 1.00 0.00 H new ATOM 0 HB3 LYS B 41 -10.136 1.002 -5.505 1.00 0.00 H new ATOM 0 HG2 LYS B 41 -11.001 -1.250 -6.301 1.00 0.00 H new ATOM 0 HG3 LYS B 41 -12.603 -0.545 -6.398 1.00 0.00 H new ATOM 0 HD2 LYS B 41 -11.724 1.191 -7.989 1.00 0.00 H new ATOM 0 HD3 LYS B 41 -10.142 0.442 -7.914 1.00 0.00 H new ATOM 0 HE2 LYS B 41 -12.635 -0.985 -8.925 1.00 0.00 H new ATOM 0 HE3 LYS B 41 -11.517 -0.127 -9.966 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 -11.058 -2.471 -9.932 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 -9.757 -1.614 -9.257 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 -10.840 -2.446 -8.248 1.00 0.00 H new ATOM 2010 N VAL B 42 -9.889 1.473 -2.386 1.00 0.00 N ATOM 2011 CA VAL B 42 -9.402 2.522 -1.506 1.00 0.00 C ATOM 2012 C VAL B 42 -8.478 3.376 -2.387 1.00 0.00 C ATOM 2013 O VAL B 42 -7.630 2.905 -3.153 1.00 0.00 O ATOM 2014 CB VAL B 42 -8.607 1.794 -0.400 1.00 0.00 C ATOM 2015 CG1 VAL B 42 -8.029 2.718 0.631 1.00 0.00 C ATOM 2016 CG2 VAL B 42 -9.466 0.868 0.434 1.00 0.00 C ATOM 0 H VAL B 42 -9.203 0.730 -2.519 1.00 0.00 H new ATOM 0 HA VAL B 42 -10.170 3.148 -1.051 1.00 0.00 H new ATOM 0 HB VAL B 42 -7.841 1.272 -0.974 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -7.485 2.137 1.376 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -7.348 3.420 0.150 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -8.834 3.269 1.118 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -8.850 0.386 1.193 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -10.256 1.442 0.918 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -9.911 0.108 -0.208 1.00 0.00 H new ATOM 2026 N GLN B 43 -8.682 4.659 -2.191 1.00 0.00 N ATOM 2027 CA GLN B 43 -8.001 5.703 -2.996 1.00 0.00 C ATOM 2028 C GLN B 43 -7.184 6.659 -2.086 1.00 0.00 C ATOM 2029 O GLN B 43 -7.727 7.274 -1.171 1.00 0.00 O ATOM 2030 CB GLN B 43 -8.922 6.297 -4.106 1.00 0.00 C ATOM 2031 CG GLN B 43 -9.845 5.371 -4.951 1.00 0.00 C ATOM 2032 CD GLN B 43 -9.193 4.423 -5.977 1.00 0.00 C ATOM 2033 OE1 GLN B 43 -8.226 3.719 -5.698 1.00 0.00 O ATOM 2034 NE2 GLN B 43 -9.737 4.333 -7.181 1.00 0.00 N ATOM 0 H GLN B 43 -9.315 5.028 -1.481 1.00 0.00 H new ATOM 0 HA GLN B 43 -7.220 5.266 -3.619 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -9.562 7.039 -3.629 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -8.279 6.833 -4.804 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -10.427 4.762 -4.259 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -10.550 6.006 -5.487 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -10.540 4.913 -7.422 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -9.353 3.683 -7.867 1.00 0.00 H new ATOM 2043 N LEU B 44 -5.849 6.716 -2.275 1.00 0.00 N ATOM 2044 CA LEU B 44 -4.951 7.677 -1.575 1.00 0.00 C ATOM 2045 C LEU B 44 -4.040 8.172 -2.743 1.00 0.00 C ATOM 2046 O LEU B 44 -3.164 7.435 -3.203 1.00 0.00 O ATOM 2047 CB LEU B 44 -4.133 7.158 -0.342 1.00 0.00 C ATOM 2048 CG LEU B 44 -4.678 6.011 0.572 1.00 0.00 C ATOM 2049 CD1 LEU B 44 -3.625 5.673 1.650 1.00 0.00 C ATOM 2050 CD2 LEU B 44 -6.067 6.248 1.203 1.00 0.00 C ATOM 0 H LEU B 44 -5.355 6.097 -2.918 1.00 0.00 H new ATOM 0 HA LEU B 44 -5.537 8.446 -1.072 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -3.164 6.830 -0.719 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -3.950 8.018 0.302 1.00 0.00 H new ATOM 0 HG LEU B 44 -4.844 5.163 -0.092 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -4.002 4.874 2.289 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.703 5.348 1.168 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -3.426 6.558 2.255 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -6.340 5.388 1.814 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.036 7.141 1.827 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -6.807 6.382 0.414 1.00 0.00 H new ATOM 2062 N ILE B 45 -4.253 9.397 -3.260 1.00 0.00 N ATOM 2063 CA ILE B 45 -3.571 9.897 -4.502 1.00 0.00 C ATOM 2064 C ILE B 45 -2.041 10.078 -4.531 1.00 0.00 C ATOM 2065 O ILE B 45 -1.312 9.520 -5.360 1.00 0.00 O ATOM 2066 CB ILE B 45 -4.447 10.981 -5.217 1.00 0.00 C ATOM 2067 CG1 ILE B 45 -4.147 11.192 -6.730 1.00 0.00 C ATOM 2068 CG2 ILE B 45 -4.555 12.310 -4.438 1.00 0.00 C ATOM 2069 CD1 ILE B 45 -2.938 12.053 -7.144 1.00 0.00 C ATOM 0 H ILE B 45 -4.893 10.073 -2.845 1.00 0.00 H new ATOM 0 HA ILE B 45 -3.534 9.020 -5.148 1.00 0.00 H new ATOM 0 HB ILE B 45 -5.442 10.537 -5.201 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -4.018 10.207 -7.179 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.035 11.634 -7.182 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -5.177 13.010 -4.996 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -5.004 12.124 -3.462 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -3.560 12.735 -4.305 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -2.876 12.095 -8.231 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -3.057 13.062 -6.748 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -2.024 11.612 -6.746 1.00 0.00 H new ATOM 2081 N GLY B 46 -1.621 10.872 -3.584 1.00 0.00 N ATOM 2082 CA GLY B 46 -0.185 11.129 -3.321 1.00 0.00 C ATOM 2083 C GLY B 46 0.651 9.991 -2.667 1.00 0.00 C ATOM 2084 O GLY B 46 1.797 10.259 -2.293 1.00 0.00 O ATOM 0 H GLY B 46 -2.249 11.373 -2.956 1.00 0.00 H new ATOM 0 HA2 GLY B 46 0.287 11.388 -4.269 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -0.115 12.007 -2.679 1.00 0.00 H new ATOM 2088 N PHE B 47 0.122 8.749 -2.549 1.00 0.00 N ATOM 2089 CA PHE B 47 0.806 7.641 -1.853 1.00 0.00 C ATOM 2090 C PHE B 47 0.414 6.204 -2.297 1.00 0.00 C ATOM 2091 O PHE B 47 1.326 5.392 -2.476 1.00 0.00 O ATOM 2092 CB PHE B 47 0.519 7.798 -0.332 1.00 0.00 C ATOM 2093 CG PHE B 47 1.434 6.895 0.521 1.00 0.00 C ATOM 2094 CD1 PHE B 47 2.768 7.250 0.751 1.00 0.00 C ATOM 2095 CD2 PHE B 47 0.999 5.604 0.856 1.00 0.00 C ATOM 2096 CE1 PHE B 47 3.648 6.321 1.295 1.00 0.00 C ATOM 2097 CE2 PHE B 47 1.900 4.669 1.355 1.00 0.00 C ATOM 2098 CZ PHE B 47 3.226 5.027 1.558 1.00 0.00 C ATOM 0 H PHE B 47 -0.787 8.492 -2.933 1.00 0.00 H new ATOM 0 HA PHE B 47 1.861 7.727 -2.112 1.00 0.00 H new ATOM 0 HB2 PHE B 47 0.662 8.839 -0.041 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -0.524 7.551 -0.132 1.00 0.00 H new ATOM 0 HD1 PHE B 47 3.113 8.244 0.506 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -0.039 5.335 0.726 1.00 0.00 H new ATOM 0 HE1 PHE B 47 4.666 6.609 1.514 1.00 0.00 H new ATOM 0 HE2 PHE B 47 1.569 3.667 1.584 1.00 0.00 H new ATOM 0 HZ PHE B 47 3.931 4.295 1.922 1.00 0.00 H new ATOM 2108 N GLY B 48 -0.887 5.851 -2.325 1.00 0.00 N ATOM 2109 CA GLY B 48 -1.303 4.463 -2.553 1.00 0.00 C ATOM 2110 C GLY B 48 -2.785 4.220 -2.836 1.00 0.00 C ATOM 2111 O GLY B 48 -3.649 4.735 -2.133 1.00 0.00 O ATOM 0 H GLY B 48 -1.658 6.506 -2.193 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -0.729 4.071 -3.393 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -1.025 3.878 -1.676 1.00 0.00 H new ATOM 2115 N ASN B 49 -3.077 3.384 -3.839 1.00 0.00 N ATOM 2116 CA ASN B 49 -4.474 3.032 -4.205 1.00 0.00 C ATOM 2117 C ASN B 49 -4.625 1.502 -3.973 1.00 0.00 C ATOM 2118 O ASN B 49 -4.241 0.691 -4.821 1.00 0.00 O ATOM 2119 CB ASN B 49 -4.811 3.499 -5.653 1.00 0.00 C ATOM 2120 CG ASN B 49 -4.903 5.031 -5.880 1.00 0.00 C ATOM 2121 OD1 ASN B 49 -4.094 5.818 -5.389 1.00 0.00 O ATOM 2122 ND2 ASN B 49 -5.861 5.493 -6.666 1.00 0.00 N ATOM 0 H ASN B 49 -2.370 2.932 -4.419 1.00 0.00 H new ATOM 0 HA ASN B 49 -5.203 3.553 -3.584 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -4.053 3.099 -6.326 1.00 0.00 H new ATOM 0 HB3 ASN B 49 -5.762 3.053 -5.943 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -5.924 6.492 -6.860 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -6.537 4.850 -7.078 1.00 0.00 H new ATOM 2129 N PHE B 50 -5.169 1.108 -2.801 1.00 0.00 N ATOM 2130 CA PHE B 50 -5.403 -0.326 -2.464 1.00 0.00 C ATOM 2131 C PHE B 50 -6.707 -0.817 -3.126 1.00 0.00 C ATOM 2132 O PHE B 50 -7.647 -0.051 -3.349 1.00 0.00 O ATOM 2133 CB PHE B 50 -5.566 -0.670 -0.949 1.00 0.00 C ATOM 2134 CG PHE B 50 -4.527 -0.237 0.058 1.00 0.00 C ATOM 2135 CD1 PHE B 50 -4.452 1.113 0.418 1.00 0.00 C ATOM 2136 CD2 PHE B 50 -3.844 -1.198 0.811 1.00 0.00 C ATOM 2137 CE1 PHE B 50 -3.625 1.509 1.458 1.00 0.00 C ATOM 2138 CE2 PHE B 50 -3.023 -0.796 1.858 1.00 0.00 C ATOM 2139 CZ PHE B 50 -2.894 0.555 2.148 1.00 0.00 C ATOM 0 H PHE B 50 -5.456 1.757 -2.069 1.00 0.00 H new ATOM 0 HA PHE B 50 -4.495 -0.810 -2.824 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -6.519 -0.251 -0.626 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -5.652 -1.754 -0.874 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -5.039 1.847 -0.115 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -3.954 -2.247 0.580 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -3.551 2.552 1.728 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -2.489 -1.531 2.442 1.00 0.00 H new ATOM 0 HZ PHE B 50 -2.212 0.868 2.925 1.00 0.00 H new ATOM 2149 N GLU B 51 -6.757 -2.122 -3.413 1.00 0.00 N ATOM 2150 CA GLU B 51 -7.977 -2.767 -3.941 1.00 0.00 C ATOM 2151 C GLU B 51 -7.787 -4.291 -3.929 1.00 0.00 C ATOM 2152 O GLU B 51 -6.699 -4.812 -4.188 1.00 0.00 O ATOM 2153 CB GLU B 51 -8.450 -2.251 -5.340 1.00 0.00 C ATOM 2154 CG GLU B 51 -7.509 -2.414 -6.560 1.00 0.00 C ATOM 2155 CD GLU B 51 -6.331 -1.432 -6.594 1.00 0.00 C ATOM 2156 OE1 GLU B 51 -6.455 -0.233 -6.844 1.00 0.00 O ATOM 2157 OE2 GLU B 51 -5.137 -2.041 -6.300 1.00 0.00 O ATOM 0 H GLU B 51 -5.969 -2.758 -3.290 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.792 -2.483 -3.275 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -9.386 -2.756 -5.577 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -8.677 -1.190 -5.239 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.117 -3.431 -6.567 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -8.093 -2.292 -7.472 1.00 0.00 H new ATOM 2165 N VAL B 52 -8.875 -5.024 -3.666 1.00 0.00 N ATOM 2166 CA VAL B 52 -8.846 -6.479 -3.538 1.00 0.00 C ATOM 2167 C VAL B 52 -9.097 -7.133 -4.939 1.00 0.00 C ATOM 2168 O VAL B 52 -9.803 -6.576 -5.791 1.00 0.00 O ATOM 2169 CB VAL B 52 -9.865 -6.709 -2.358 1.00 0.00 C ATOM 2170 CG1 VAL B 52 -11.184 -7.313 -2.818 1.00 0.00 C ATOM 2171 CG2 VAL B 52 -9.209 -7.477 -1.208 1.00 0.00 C ATOM 0 H VAL B 52 -9.802 -4.620 -3.536 1.00 0.00 H new ATOM 0 HA VAL B 52 -7.909 -6.969 -3.274 1.00 0.00 H new ATOM 0 HB VAL B 52 -10.137 -5.728 -1.968 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -11.842 -7.447 -1.959 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -11.658 -6.646 -3.538 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -10.998 -8.279 -3.286 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -9.934 -7.622 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -8.866 -8.447 -1.567 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -8.359 -6.909 -0.829 1.00 0.00 H new ATOM 2181 N ARG B 53 -8.538 -8.337 -5.151 1.00 0.00 N ATOM 2182 CA ARG B 53 -8.765 -9.115 -6.400 1.00 0.00 C ATOM 2183 C ARG B 53 -9.876 -10.125 -5.999 1.00 0.00 C ATOM 2184 O ARG B 53 -9.600 -11.259 -5.590 1.00 0.00 O ATOM 2185 CB ARG B 53 -7.417 -9.733 -6.846 1.00 0.00 C ATOM 2186 CG ARG B 53 -7.465 -10.495 -8.194 1.00 0.00 C ATOM 2187 CD ARG B 53 -6.500 -11.694 -8.294 1.00 0.00 C ATOM 2188 NE ARG B 53 -6.944 -12.834 -7.449 1.00 0.00 N ATOM 2189 CZ ARG B 53 -6.364 -14.048 -7.425 1.00 0.00 C ATOM 2190 NH1 ARG B 53 -5.302 -14.378 -8.158 1.00 0.00 N ATOM 2191 NH2 ARG B 53 -6.881 -14.968 -6.631 1.00 0.00 N ATOM 0 H ARG B 53 -7.925 -8.799 -4.480 1.00 0.00 H new ATOM 0 HA ARG B 53 -9.096 -8.549 -7.270 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -6.676 -8.937 -6.921 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -7.073 -10.417 -6.070 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -8.482 -10.851 -8.358 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -7.238 -9.796 -8.999 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -6.429 -12.018 -9.332 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -5.501 -11.383 -7.988 1.00 0.00 H new ATOM 0 HE ARG B 53 -7.749 -12.684 -6.841 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -4.881 -13.691 -8.784 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -4.910 -15.317 -8.093 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -7.697 -14.748 -6.059 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -6.465 -15.898 -6.590 1.00 0.00 H new ATOM 2522 N LYS B 75 -10.589 -13.320 -2.042 1.00 0.00 N ATOM 2523 CA LYS B 75 -10.442 -11.829 -2.156 1.00 0.00 C ATOM 2524 C LYS B 75 -9.036 -11.490 -1.602 1.00 0.00 C ATOM 2525 O LYS B 75 -8.739 -11.727 -0.427 1.00 0.00 O ATOM 2526 CB LYS B 75 -11.517 -10.874 -1.585 1.00 0.00 C ATOM 2527 CG LYS B 75 -12.968 -11.395 -1.530 1.00 0.00 C ATOM 2528 CD LYS B 75 -13.966 -10.281 -1.153 1.00 0.00 C ATOM 2529 CE LYS B 75 -15.423 -10.771 -1.125 1.00 0.00 C ATOM 2530 NZ LYS B 75 -16.354 -9.671 -0.817 1.00 0.00 N ATOM 0 HA LYS B 75 -10.594 -11.623 -3.215 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -11.219 -10.597 -0.574 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -11.509 -9.961 -2.181 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -13.240 -11.813 -2.499 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -13.036 -12.204 -0.803 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -13.703 -9.880 -0.174 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -13.876 -9.462 -1.867 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -15.680 -11.208 -2.090 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -15.529 -11.559 -0.380 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -17.306 -10.057 -0.655 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -16.032 -9.173 0.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -16.382 -9.006 -1.616 1.00 0.00 H new ATOM 2543 N VAL B 76 -8.184 -10.953 -2.482 1.00 0.00 N ATOM 2544 CA VAL B 76 -6.740 -10.948 -2.308 1.00 0.00 C ATOM 2545 C VAL B 76 -6.277 -9.454 -2.251 1.00 0.00 C ATOM 2546 O VAL B 76 -6.425 -8.731 -3.238 1.00 0.00 O ATOM 2547 CB VAL B 76 -6.354 -11.845 -3.532 1.00 0.00 C ATOM 2548 CG1 VAL B 76 -5.169 -11.355 -4.317 1.00 0.00 C ATOM 2549 CG2 VAL B 76 -6.216 -13.323 -3.148 1.00 0.00 C ATOM 0 H VAL B 76 -8.490 -10.505 -3.346 1.00 0.00 H new ATOM 0 HA VAL B 76 -6.271 -11.342 -1.407 1.00 0.00 H new ATOM 0 HB VAL B 76 -7.199 -11.758 -4.215 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -4.974 -12.037 -5.145 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -5.378 -10.359 -4.708 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -4.295 -11.313 -3.668 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -5.947 -13.905 -4.030 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -5.439 -13.431 -2.391 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -7.164 -13.685 -2.749 1.00 0.00 H new ATOM 2559 N PRO B 77 -5.685 -8.963 -1.141 1.00 0.00 N ATOM 2560 CA PRO B 77 -5.333 -7.540 -0.969 1.00 0.00 C ATOM 2561 C PRO B 77 -4.040 -7.110 -1.681 1.00 0.00 C ATOM 2562 O PRO B 77 -3.023 -7.810 -1.729 1.00 0.00 O ATOM 2563 CB PRO B 77 -5.250 -7.434 0.563 1.00 0.00 C ATOM 2564 CG PRO B 77 -4.775 -8.815 1.024 1.00 0.00 C ATOM 2565 CD PRO B 77 -5.396 -9.795 0.023 1.00 0.00 C ATOM 0 HA PRO B 77 -6.055 -6.863 -1.427 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -4.553 -6.653 0.869 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -6.219 -7.184 0.996 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -3.687 -8.881 1.020 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -5.103 -9.027 2.041 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.709 -10.604 -0.224 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.300 -10.255 0.421 1.00 0.00 H new ATOM 2573 N ALA B 78 -4.168 -5.901 -2.226 1.00 0.00 N ATOM 2574 CA ALA B 78 -3.138 -5.260 -3.045 1.00 0.00 C ATOM 2575 C ALA B 78 -3.056 -3.754 -2.679 1.00 0.00 C ATOM 2576 O ALA B 78 -3.933 -3.159 -2.044 1.00 0.00 O ATOM 2577 CB ALA B 78 -3.550 -5.557 -4.498 1.00 0.00 C ATOM 0 H ALA B 78 -5.004 -5.329 -2.109 1.00 0.00 H new ATOM 0 HA ALA B 78 -2.127 -5.634 -2.881 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -2.827 -5.109 -5.180 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -3.578 -6.635 -4.655 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -4.537 -5.137 -4.689 1.00 0.00 H new ATOM 2583 N PHE B 79 -1.933 -3.171 -3.089 1.00 0.00 N ATOM 2584 CA PHE B 79 -1.563 -1.758 -2.812 1.00 0.00 C ATOM 2585 C PHE B 79 -0.756 -1.314 -4.068 1.00 0.00 C ATOM 2586 O PHE B 79 0.326 -1.816 -4.393 1.00 0.00 O ATOM 2587 CB PHE B 79 -0.776 -1.650 -1.490 1.00 0.00 C ATOM 2588 CG PHE B 79 0.092 -0.391 -1.261 1.00 0.00 C ATOM 2589 CD1 PHE B 79 -0.452 0.756 -0.682 1.00 0.00 C ATOM 2590 CD2 PHE B 79 1.433 -0.378 -1.675 1.00 0.00 C ATOM 2591 CE1 PHE B 79 0.326 1.898 -0.524 1.00 0.00 C ATOM 2592 CE2 PHE B 79 2.200 0.776 -1.547 1.00 0.00 C ATOM 2593 CZ PHE B 79 1.641 1.918 -0.984 1.00 0.00 C ATOM 0 H PHE B 79 -1.229 -3.666 -3.636 1.00 0.00 H new ATOM 0 HA PHE B 79 -2.421 -1.103 -2.663 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -1.491 -1.716 -0.670 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -0.125 -2.522 -1.417 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -1.481 0.757 -0.355 1.00 0.00 H new ATOM 0 HD2 PHE B 79 1.873 -1.270 -2.096 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -0.090 2.771 -0.044 1.00 0.00 H new ATOM 0 HE2 PHE B 79 3.226 0.785 -1.884 1.00 0.00 H new ATOM 0 HZ PHE B 79 2.227 2.822 -0.903 1.00 0.00 H new ATOM 2603 N LYS B 80 -1.333 -0.315 -4.716 1.00 0.00 N ATOM 2604 CA LYS B 80 -0.648 0.505 -5.767 1.00 0.00 C ATOM 2605 C LYS B 80 0.207 1.569 -5.029 1.00 0.00 C ATOM 2606 O LYS B 80 -0.170 1.965 -3.922 1.00 0.00 O ATOM 2607 CB LYS B 80 -1.662 1.184 -6.721 1.00 0.00 C ATOM 2608 CG LYS B 80 -2.405 0.204 -7.658 1.00 0.00 C ATOM 2609 CD LYS B 80 -3.476 0.894 -8.525 1.00 0.00 C ATOM 2610 CE LYS B 80 -4.145 -0.069 -9.522 1.00 0.00 C ATOM 2611 NZ LYS B 80 -5.204 0.606 -10.293 1.00 0.00 N ATOM 0 H LYS B 80 -2.297 -0.028 -4.544 1.00 0.00 H new ATOM 0 HA LYS B 80 -0.025 -0.136 -6.390 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.396 1.727 -6.126 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -1.136 1.921 -7.328 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -1.681 -0.288 -8.308 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -2.877 -0.575 -7.059 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -4.238 1.327 -7.877 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -3.018 1.718 -9.073 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -3.394 -0.468 -10.204 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -4.569 -0.916 -8.983 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -5.635 -0.070 -10.956 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -5.932 0.965 -9.643 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -4.794 1.399 -10.826 1.00 0.00 H new ATOM 2624 N PRO B 81 1.361 2.060 -5.552 1.00 0.00 N ATOM 2625 CA PRO B 81 2.058 3.217 -4.935 1.00 0.00 C ATOM 2626 C PRO B 81 1.469 4.599 -5.375 1.00 0.00 C ATOM 2627 O PRO B 81 2.208 5.579 -5.461 1.00 0.00 O ATOM 2628 CB PRO B 81 3.484 2.940 -5.442 1.00 0.00 C ATOM 2629 CG PRO B 81 3.321 2.326 -6.834 1.00 0.00 C ATOM 2630 CD PRO B 81 2.070 1.466 -6.704 1.00 0.00 C ATOM 0 HA PRO B 81 1.972 3.298 -3.851 1.00 0.00 H new ATOM 0 HB2 PRO B 81 4.068 3.859 -5.486 1.00 0.00 H new ATOM 0 HB3 PRO B 81 4.011 2.259 -4.774 1.00 0.00 H new ATOM 0 HG2 PRO B 81 3.202 3.093 -7.599 1.00 0.00 H new ATOM 0 HG3 PRO B 81 4.190 1.730 -7.113 1.00 0.00 H new ATOM 0 HD2 PRO B 81 1.464 1.500 -7.609 1.00 0.00 H new ATOM 0 HD3 PRO B 81 2.319 0.420 -6.526 1.00 0.00 H new ATOM 2638 N GLY B 82 0.145 4.688 -5.644 1.00 0.00 N ATOM 2639 CA GLY B 82 -0.523 5.889 -6.197 1.00 0.00 C ATOM 2640 C GLY B 82 0.143 6.616 -7.389 1.00 0.00 C ATOM 2641 O GLY B 82 -0.217 7.774 -7.611 1.00 0.00 O ATOM 0 H GLY B 82 -0.499 3.914 -5.480 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -1.528 5.599 -6.504 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -0.633 6.610 -5.387 1.00 0.00 H new ATOM 2645 N LYS B 83 1.099 5.957 -8.108 1.00 0.00 N ATOM 2646 CA LYS B 83 2.028 6.622 -9.099 1.00 0.00 C ATOM 2647 C LYS B 83 3.136 7.534 -8.463 1.00 0.00 C ATOM 2648 O LYS B 83 4.319 7.490 -8.802 1.00 0.00 O ATOM 2649 CB LYS B 83 1.310 7.409 -10.240 1.00 0.00 C ATOM 2650 CG LYS B 83 1.339 6.736 -11.627 1.00 0.00 C ATOM 2651 CD LYS B 83 2.704 6.854 -12.336 1.00 0.00 C ATOM 2652 CE LYS B 83 2.730 6.147 -13.703 1.00 0.00 C ATOM 2653 NZ LYS B 83 4.047 6.281 -14.351 1.00 0.00 N ATOM 0 H LYS B 83 1.255 4.952 -8.024 1.00 0.00 H new ATOM 0 HA LYS B 83 2.522 5.757 -9.541 1.00 0.00 H new ATOM 0 HB2 LYS B 83 0.270 7.565 -9.952 1.00 0.00 H new ATOM 0 HB3 LYS B 83 1.769 8.394 -10.323 1.00 0.00 H new ATOM 0 HG2 LYS B 83 1.085 5.682 -11.517 1.00 0.00 H new ATOM 0 HG3 LYS B 83 0.571 7.185 -12.257 1.00 0.00 H new ATOM 0 HD2 LYS B 83 2.947 7.908 -12.473 1.00 0.00 H new ATOM 0 HD3 LYS B 83 3.478 6.428 -11.697 1.00 0.00 H new ATOM 0 HE2 LYS B 83 2.492 5.091 -13.573 1.00 0.00 H new ATOM 0 HE3 LYS B 83 1.960 6.570 -14.348 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 4.033 5.794 -15.270 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 4.262 7.288 -14.496 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 4.777 5.855 -13.745 1.00 0.00 H new ATOM 2666 N ALA B 84 2.650 8.408 -7.590 1.00 0.00 N ATOM 2667 CA ALA B 84 3.379 9.383 -6.765 1.00 0.00 C ATOM 2668 C ALA B 84 4.503 8.820 -5.870 1.00 0.00 C ATOM 2669 O ALA B 84 5.618 9.348 -5.908 1.00 0.00 O ATOM 2670 CB ALA B 84 2.246 9.946 -5.905 1.00 0.00 C ATOM 0 H ALA B 84 1.646 8.463 -7.421 1.00 0.00 H new ATOM 0 HA ALA B 84 3.924 10.091 -7.389 1.00 0.00 H new ATOM 0 HB1 ALA B 84 2.645 10.700 -5.226 1.00 0.00 H new ATOM 0 HB2 ALA B 84 1.492 10.399 -6.548 1.00 0.00 H new ATOM 0 HB3 ALA B 84 1.793 9.140 -5.327 1.00 0.00 H new ATOM 2676 N LEU B 85 4.217 7.762 -5.071 1.00 0.00 N ATOM 2677 CA LEU B 85 5.259 7.019 -4.348 1.00 0.00 C ATOM 2678 C LEU B 85 6.252 6.341 -5.346 1.00 0.00 C ATOM 2679 O LEU B 85 7.448 6.369 -5.064 1.00 0.00 O ATOM 2680 CB LEU B 85 4.592 6.045 -3.346 1.00 0.00 C ATOM 2681 CG LEU B 85 5.607 5.206 -2.557 1.00 0.00 C ATOM 2682 CD1 LEU B 85 6.328 5.981 -1.450 1.00 0.00 C ATOM 2683 CD2 LEU B 85 4.958 3.930 -1.996 1.00 0.00 C ATOM 0 H LEU B 85 3.272 7.411 -4.916 1.00 0.00 H new ATOM 0 HA LEU B 85 5.874 7.699 -3.758 1.00 0.00 H new ATOM 0 HB2 LEU B 85 3.979 6.615 -2.647 1.00 0.00 H new ATOM 0 HB3 LEU B 85 3.921 5.378 -3.888 1.00 0.00 H new ATOM 0 HG LEU B 85 6.376 4.926 -3.277 1.00 0.00 H new ATOM 0 HD11 LEU B 85 7.028 5.319 -0.939 1.00 0.00 H new ATOM 0 HD12 LEU B 85 6.873 6.818 -1.887 1.00 0.00 H new ATOM 0 HD13 LEU B 85 5.597 6.358 -0.735 1.00 0.00 H new ATOM 0 HD21 LEU B 85 5.702 3.357 -1.442 1.00 0.00 H new ATOM 0 HD22 LEU B 85 4.139 4.201 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU B 85 4.573 3.326 -2.818 1.00 0.00 H new ATOM 2695 N LYS B 86 5.794 5.761 -6.477 1.00 0.00 N ATOM 2696 CA LYS B 86 6.698 5.261 -7.555 1.00 0.00 C ATOM 2697 C LYS B 86 7.751 6.310 -8.065 1.00 0.00 C ATOM 2698 O LYS B 86 8.822 5.903 -8.516 1.00 0.00 O ATOM 2699 CB LYS B 86 5.879 4.608 -8.698 1.00 0.00 C ATOM 2700 CG LYS B 86 6.666 3.581 -9.541 1.00 0.00 C ATOM 2701 CD LYS B 86 5.820 2.771 -10.545 1.00 0.00 C ATOM 2702 CE LYS B 86 5.226 3.598 -11.702 1.00 0.00 C ATOM 2703 NZ LYS B 86 4.489 2.747 -12.653 1.00 0.00 N ATOM 0 H LYS B 86 4.803 5.624 -6.674 1.00 0.00 H new ATOM 0 HA LYS B 86 7.316 4.486 -7.102 1.00 0.00 H new ATOM 0 HB2 LYS B 86 5.007 4.115 -8.268 1.00 0.00 H new ATOM 0 HB3 LYS B 86 5.508 5.393 -9.357 1.00 0.00 H new ATOM 0 HG2 LYS B 86 7.447 4.107 -10.090 1.00 0.00 H new ATOM 0 HG3 LYS B 86 7.164 2.886 -8.866 1.00 0.00 H new ATOM 0 HD2 LYS B 86 6.439 1.978 -10.964 1.00 0.00 H new ATOM 0 HD3 LYS B 86 5.005 2.288 -10.006 1.00 0.00 H new ATOM 0 HE2 LYS B 86 4.557 4.359 -11.300 1.00 0.00 H new ATOM 0 HE3 LYS B 86 6.027 4.121 -12.225 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 4.103 3.336 -13.418 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 5.133 2.036 -13.054 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 3.710 2.268 -12.158 1.00 0.00 H new ATOM 2716 N ASP B 87 7.469 7.627 -7.956 1.00 0.00 N ATOM 2717 CA ASP B 87 8.445 8.715 -8.190 1.00 0.00 C ATOM 2718 C ASP B 87 9.385 8.993 -6.975 1.00 0.00 C ATOM 2719 O ASP B 87 10.579 9.217 -7.191 1.00 0.00 O ATOM 2720 CB ASP B 87 7.611 9.954 -8.604 1.00 0.00 C ATOM 2721 CG ASP B 87 8.131 10.638 -9.872 1.00 0.00 C ATOM 2722 OD1 ASP B 87 8.865 11.626 -9.853 1.00 0.00 O ATOM 2723 OD2 ASP B 87 7.692 10.019 -11.014 1.00 0.00 O ATOM 0 H ASP B 87 6.543 7.969 -7.699 1.00 0.00 H new ATOM 0 HA ASP B 87 9.144 8.430 -8.976 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.576 9.651 -8.762 1.00 0.00 H new ATOM 0 HB3 ASP B 87 7.611 10.674 -7.785 1.00 0.00 H new ATOM 2729 N ALA B 88 8.869 8.993 -5.722 1.00 0.00 N ATOM 2730 CA ALA B 88 9.709 9.054 -4.487 1.00 0.00 C ATOM 2731 C ALA B 88 10.827 7.977 -4.360 1.00 0.00 C ATOM 2732 O ALA B 88 11.928 8.255 -3.883 1.00 0.00 O ATOM 2733 CB ALA B 88 8.807 8.801 -3.247 1.00 0.00 C ATOM 0 H ALA B 88 7.868 8.951 -5.533 1.00 0.00 H new ATOM 0 HA ALA B 88 10.175 10.037 -4.546 1.00 0.00 H new ATOM 0 HB1 ALA B 88 9.413 8.844 -2.342 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.030 9.564 -3.200 1.00 0.00 H new ATOM 0 HB3 ALA B 88 8.345 7.817 -3.328 1.00 0.00 H new ATOM 2739 N VAL B 89 10.491 6.750 -4.782 1.00 0.00 N ATOM 2740 CA VAL B 89 11.247 5.523 -4.532 1.00 0.00 C ATOM 2741 C VAL B 89 12.192 5.027 -5.678 1.00 0.00 C ATOM 2742 O VAL B 89 13.015 4.142 -5.430 1.00 0.00 O ATOM 2743 CB VAL B 89 10.007 4.618 -4.193 1.00 0.00 C ATOM 2744 CG1 VAL B 89 9.342 3.994 -5.425 1.00 0.00 C ATOM 2745 CG2 VAL B 89 10.336 3.549 -3.191 1.00 0.00 C ATOM 0 H VAL B 89 9.647 6.582 -5.330 1.00 0.00 H new ATOM 0 HA VAL B 89 12.025 5.582 -3.771 1.00 0.00 H new ATOM 0 HB VAL B 89 9.284 5.302 -3.749 1.00 0.00 H new ATOM 0 HG11 VAL B 89 8.495 3.384 -5.111 1.00 0.00 H new ATOM 0 HG12 VAL B 89 8.994 4.784 -6.090 1.00 0.00 H new ATOM 0 HG13 VAL B 89 10.064 3.369 -5.951 1.00 0.00 H new ATOM 0 HG21 VAL B 89 9.446 2.952 -2.991 1.00 0.00 H new ATOM 0 HG22 VAL B 89 11.122 2.907 -3.589 1.00 0.00 H new ATOM 0 HG23 VAL B 89 10.678 4.011 -2.265 1.00 0.00 H new ATOM 2755 N LYS B 90 12.061 5.584 -6.903 1.00 0.00 N ATOM 2756 CA LYS B 90 12.791 5.147 -8.111 1.00 0.00 C ATOM 2757 C LYS B 90 14.328 5.232 -8.026 1.00 0.00 C ATOM 2758 O LYS B 90 15.003 4.219 -7.837 1.00 0.00 O ATOM 2759 CB LYS B 90 12.195 5.937 -9.303 1.00 0.00 C ATOM 2760 CG LYS B 90 12.566 7.433 -9.452 1.00 0.00 C ATOM 2761 CD LYS B 90 11.828 8.120 -10.617 1.00 0.00 C ATOM 2762 CE LYS B 90 12.100 9.634 -10.681 1.00 0.00 C ATOM 2763 NZ LYS B 90 11.396 10.260 -11.814 1.00 0.00 N ATOM 0 H LYS B 90 11.431 6.366 -7.081 1.00 0.00 H new ATOM 0 HA LYS B 90 12.644 4.075 -8.240 1.00 0.00 H new ATOM 0 HB2 LYS B 90 12.491 5.428 -10.220 1.00 0.00 H new ATOM 0 HB3 LYS B 90 11.109 5.869 -9.237 1.00 0.00 H new ATOM 0 HG2 LYS B 90 12.333 7.954 -8.523 1.00 0.00 H new ATOM 0 HG3 LYS B 90 13.641 7.522 -9.607 1.00 0.00 H new ATOM 0 HD2 LYS B 90 12.133 7.660 -11.557 1.00 0.00 H new ATOM 0 HD3 LYS B 90 10.756 7.951 -10.513 1.00 0.00 H new ATOM 0 HE2 LYS B 90 11.781 10.102 -9.750 1.00 0.00 H new ATOM 0 HE3 LYS B 90 13.172 9.809 -10.775 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 11.600 11.280 -11.829 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 11.719 9.829 -12.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 10.372 10.113 -11.710 1.00 0.00 H new