USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 922 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 35 ASN : amide:sc= -0.948 K(o=-0.94,f=-4.2!) USER MOD Set 1.2: B 1 MET N :NH3+ 154:sc= 0.00481 (180deg=0) USER MOD Set 2.1: A 1 MET N :NH3+ 154:sc= 0.00416 (180deg=0) USER MOD Set 2.2: B 35 ASN : amide:sc= -1.01 K(o=-1,f=-4.3!) USER MOD Single : A 1 MET CE :methyl -173:sc= 0 (180deg=-0.0628) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.122 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 154:sc= 0 (180deg=-0.437) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -0.337 K(o=-0.34,f=-2.5!) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.184 K(o=-0.18,f=-2.1!) USER MOD Single : A 52 GLN : amide:sc= -1.32 K(o=-1.3,f=-5.4!) USER MOD Single : A 55 LYS NZ :NH3+ -165:sc= -0.0522 (180deg=-0.301) USER MOD Single : B 1 MET CE :methyl -173:sc= 0 (180deg=-0.0612) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.137 USER MOD Single : B 11 THR OG1 : rot 180:sc=-0.00171 USER MOD Single : B 13 MET CE :methyl 155:sc= 0 (180deg=-0.415) USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 ASN : amide:sc= -0.316 K(o=-0.32,f=-2.5!) USER MOD Single : B 29 GLN : amide:sc= 0 X(o=0,f=-0.0024) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0056) USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= -0.197 K(o=-0.2,f=-2.2!) USER MOD Single : B 52 GLN : amide:sc= -1.33 K(o=-1.3,f=-5.4!) USER MOD Single : B 55 LYS NZ :NH3+ -148:sc= -0.374 (180deg=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.728 -11.396 -5.565 1.00 0.00 N ATOM 2 CA MET A 1 -2.343 -10.755 -4.281 1.00 0.00 C ATOM 3 C MET A 1 -0.861 -10.960 -3.985 1.00 0.00 C ATOM 4 O MET A 1 -0.291 -12.002 -4.309 1.00 0.00 O ATOM 5 CB MET A 1 -3.198 -11.356 -3.161 1.00 0.00 C ATOM 6 CG MET A 1 -4.178 -10.369 -2.549 1.00 0.00 C ATOM 7 SD MET A 1 -4.353 -10.578 -0.767 1.00 0.00 S ATOM 8 CE MET A 1 -4.482 -8.872 -0.238 1.00 0.00 C ATOM 0 H1 MET A 1 -3.740 -11.635 -5.544 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.544 -10.739 -6.350 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.170 -12.263 -5.701 1.00 0.00 H new ATOM 0 HA MET A 1 -2.516 -9.681 -4.349 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.752 -12.208 -3.555 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.542 -11.737 -2.378 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.844 -9.353 -2.761 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.152 -10.490 -3.022 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.470 -8.827 0.851 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.640 -8.304 -0.634 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.414 -8.446 -0.609 1.00 0.00 H new ATOM 20 N LEU A 2 -0.244 -9.960 -3.365 1.00 0.00 N ATOM 21 CA LEU A 2 1.171 -10.029 -3.020 1.00 0.00 C ATOM 22 C LEU A 2 1.375 -9.845 -1.520 1.00 0.00 C ATOM 23 O LEU A 2 1.113 -8.771 -0.981 1.00 0.00 O ATOM 24 CB LEU A 2 1.957 -8.959 -3.782 1.00 0.00 C ATOM 25 CG LEU A 2 2.153 -9.237 -5.273 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.987 -8.682 -6.077 1.00 0.00 C ATOM 27 CD2 LEU A 2 3.467 -8.641 -5.755 1.00 0.00 C ATOM 0 H LEU A 2 -0.702 -9.091 -3.091 1.00 0.00 H new ATOM 0 HA LEU A 2 1.539 -11.015 -3.304 1.00 0.00 H new ATOM 0 HB2 LEU A 2 1.443 -8.004 -3.671 1.00 0.00 H new ATOM 0 HB3 LEU A 2 2.937 -8.850 -3.317 1.00 0.00 H new ATOM 0 HG LEU A 2 2.189 -10.316 -5.422 1.00 0.00 H new ATOM 0 HD11 LEU A 2 1.144 -8.889 -7.136 1.00 0.00 H new ATOM 0 HD12 LEU A 2 0.061 -9.154 -5.748 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.920 -7.605 -5.924 1.00 0.00 H new ATOM 0 HD21 LEU A 2 3.592 -8.847 -6.818 1.00 0.00 H new ATOM 0 HD22 LEU A 2 3.459 -7.563 -5.593 1.00 0.00 H new ATOM 0 HD23 LEU A 2 4.293 -9.085 -5.200 1.00 0.00 H new ATOM 39 N ILE A 3 1.852 -10.891 -0.851 1.00 0.00 N ATOM 40 CA ILE A 3 2.095 -10.820 0.585 1.00 0.00 C ATOM 41 C ILE A 3 3.560 -10.493 0.864 1.00 0.00 C ATOM 42 O ILE A 3 4.436 -11.347 0.735 1.00 0.00 O ATOM 43 CB ILE A 3 1.719 -12.143 1.286 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.238 -12.467 1.054 1.00 0.00 C ATOM 45 CG2 ILE A 3 2.023 -12.068 2.776 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.714 -11.577 1.831 1.00 0.00 C ATOM 0 H ILE A 3 2.076 -11.790 -1.277 1.00 0.00 H new ATOM 0 HA ILE A 3 1.464 -10.026 0.985 1.00 0.00 H new ATOM 0 HB ILE A 3 2.321 -12.944 0.856 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.018 -12.376 -0.010 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.056 -13.506 1.330 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.751 -13.011 3.251 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.087 -11.883 2.921 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.449 -11.257 3.224 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.742 -11.867 1.615 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.523 -11.685 2.899 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.561 -10.538 1.539 1.00 0.00 H new ATOM 58 N LEU A 4 3.809 -9.250 1.261 1.00 0.00 N ATOM 59 CA LEU A 4 5.158 -8.795 1.577 1.00 0.00 C ATOM 60 C LEU A 4 5.217 -8.212 2.985 1.00 0.00 C ATOM 61 O LEU A 4 4.548 -7.221 3.275 1.00 0.00 O ATOM 62 CB LEU A 4 5.620 -7.742 0.564 1.00 0.00 C ATOM 63 CG LEU A 4 6.029 -8.277 -0.813 1.00 0.00 C ATOM 64 CD1 LEU A 4 6.861 -9.545 -0.681 1.00 0.00 C ATOM 65 CD2 LEU A 4 4.800 -8.528 -1.674 1.00 0.00 C ATOM 0 H LEU A 4 3.089 -8.536 1.372 1.00 0.00 H new ATOM 0 HA LEU A 4 5.823 -9.657 1.525 1.00 0.00 H new ATOM 0 HB2 LEU A 4 4.816 -7.019 0.428 1.00 0.00 H new ATOM 0 HB3 LEU A 4 6.466 -7.202 0.989 1.00 0.00 H new ATOM 0 HG LEU A 4 6.644 -7.521 -1.301 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.138 -9.903 -1.672 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.763 -9.330 -0.108 1.00 0.00 H new ATOM 0 HD13 LEU A 4 6.279 -10.310 -0.168 1.00 0.00 H new ATOM 0 HD21 LEU A 4 5.109 -8.907 -2.648 1.00 0.00 H new ATOM 0 HD22 LEU A 4 4.158 -9.261 -1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.251 -7.595 -1.806 1.00 0.00 H new ATOM 77 N THR A 5 6.015 -8.817 3.861 1.00 0.00 N ATOM 78 CA THR A 5 6.140 -8.321 5.228 1.00 0.00 C ATOM 79 C THR A 5 6.557 -6.855 5.226 1.00 0.00 C ATOM 80 O THR A 5 7.389 -6.439 4.420 1.00 0.00 O ATOM 81 CB THR A 5 7.151 -9.151 6.022 1.00 0.00 C ATOM 82 OG1 THR A 5 7.625 -10.242 5.252 1.00 0.00 O ATOM 83 CG2 THR A 5 6.576 -9.707 7.306 1.00 0.00 C ATOM 0 H THR A 5 6.578 -9.641 3.652 1.00 0.00 H new ATOM 0 HA THR A 5 5.166 -8.412 5.709 1.00 0.00 H new ATOM 0 HB THR A 5 7.963 -8.467 6.268 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.271 -10.758 5.778 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.339 -10.286 7.826 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.247 -8.886 7.943 1.00 0.00 H new ATOM 0 HG23 THR A 5 5.727 -10.350 7.076 1.00 0.00 H new ATOM 91 N ARG A 6 5.970 -6.075 6.126 1.00 0.00 N ATOM 92 CA ARG A 6 6.282 -4.654 6.214 1.00 0.00 C ATOM 93 C ARG A 6 6.093 -4.128 7.632 1.00 0.00 C ATOM 94 O ARG A 6 5.228 -4.599 8.375 1.00 0.00 O ATOM 95 CB ARG A 6 5.404 -3.846 5.255 1.00 0.00 C ATOM 96 CG ARG A 6 5.505 -4.273 3.798 1.00 0.00 C ATOM 97 CD ARG A 6 4.305 -3.794 2.995 1.00 0.00 C ATOM 98 NE ARG A 6 4.687 -2.870 1.931 1.00 0.00 N ATOM 99 CZ ARG A 6 3.833 -2.373 1.039 1.00 0.00 C ATOM 100 NH1 ARG A 6 2.548 -2.702 1.086 1.00 0.00 N ATOM 101 NH2 ARG A 6 4.264 -1.542 0.100 1.00 0.00 N ATOM 0 H ARG A 6 5.279 -6.400 6.802 1.00 0.00 H new ATOM 0 HA ARG A 6 7.329 -4.537 5.934 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.365 -3.931 5.574 1.00 0.00 H new ATOM 0 HB3 ARG A 6 5.676 -2.793 5.332 1.00 0.00 H new ATOM 0 HG2 ARG A 6 6.420 -3.872 3.362 1.00 0.00 H new ATOM 0 HG3 ARG A 6 5.574 -5.359 3.739 1.00 0.00 H new ATOM 0 HD2 ARG A 6 3.794 -4.653 2.561 1.00 0.00 H new ATOM 0 HD3 ARG A 6 3.596 -3.304 3.662 1.00 0.00 H new ATOM 0 HE ARG A 6 5.665 -2.589 1.867 1.00 0.00 H new ATOM 0 HH11 ARG A 6 2.211 -3.339 1.808 1.00 0.00 H new ATOM 0 HH12 ARG A 6 1.898 -2.318 0.400 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.250 -1.284 0.061 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.610 -1.161 -0.583 1.00 0.00 H new ATOM 115 N ARG A 7 6.906 -3.138 7.988 1.00 0.00 N ATOM 116 CA ARG A 7 6.843 -2.511 9.304 1.00 0.00 C ATOM 117 C ARG A 7 7.959 -1.479 9.461 1.00 0.00 C ATOM 118 O ARG A 7 7.724 -0.279 9.322 1.00 0.00 O ATOM 119 CB ARG A 7 6.930 -3.561 10.416 1.00 0.00 C ATOM 120 CG ARG A 7 6.903 -2.965 11.815 1.00 0.00 C ATOM 121 CD ARG A 7 7.521 -3.907 12.836 1.00 0.00 C ATOM 122 NE ARG A 7 6.690 -4.039 14.029 1.00 0.00 N ATOM 123 CZ ARG A 7 7.126 -4.532 15.186 1.00 0.00 C ATOM 124 NH1 ARG A 7 8.384 -4.936 15.312 1.00 0.00 N ATOM 125 NH2 ARG A 7 6.301 -4.620 16.221 1.00 0.00 N ATOM 0 H ARG A 7 7.623 -2.749 7.376 1.00 0.00 H new ATOM 0 HA ARG A 7 5.883 -2.002 9.389 1.00 0.00 H new ATOM 0 HB2 ARG A 7 6.100 -4.260 10.311 1.00 0.00 H new ATOM 0 HB3 ARG A 7 7.848 -4.135 10.292 1.00 0.00 H new ATOM 0 HG2 ARG A 7 7.443 -2.018 11.818 1.00 0.00 H new ATOM 0 HG3 ARG A 7 5.874 -2.745 12.098 1.00 0.00 H new ATOM 0 HD2 ARG A 7 7.665 -4.888 12.384 1.00 0.00 H new ATOM 0 HD3 ARG A 7 8.507 -3.539 13.119 1.00 0.00 H new ATOM 0 HE ARG A 7 5.718 -3.736 13.973 1.00 0.00 H new ATOM 0 HH11 ARG A 7 9.023 -4.870 14.520 1.00 0.00 H new ATOM 0 HH12 ARG A 7 8.712 -5.313 16.201 1.00 0.00 H new ATOM 0 HH21 ARG A 7 5.334 -4.310 16.130 1.00 0.00 H new ATOM 0 HH22 ARG A 7 6.634 -4.998 17.108 1.00 0.00 H new ATOM 139 N VAL A 8 9.167 -1.958 9.764 1.00 0.00 N ATOM 140 CA VAL A 8 10.334 -1.091 9.957 1.00 0.00 C ATOM 141 C VAL A 8 10.288 0.152 9.068 1.00 0.00 C ATOM 142 O VAL A 8 10.125 1.268 9.560 1.00 0.00 O ATOM 143 CB VAL A 8 11.646 -1.852 9.681 1.00 0.00 C ATOM 144 CG1 VAL A 8 12.850 -0.996 10.045 1.00 0.00 C ATOM 145 CG2 VAL A 8 11.671 -3.168 10.443 1.00 0.00 C ATOM 0 H VAL A 8 9.365 -2.952 9.882 1.00 0.00 H new ATOM 0 HA VAL A 8 10.305 -0.773 10.999 1.00 0.00 H new ATOM 0 HB VAL A 8 11.696 -2.073 8.615 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.766 -1.551 9.843 1.00 0.00 H new ATOM 0 HG12 VAL A 8 12.840 -0.083 9.450 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.807 -0.740 11.104 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.605 -3.691 10.236 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.595 -2.971 11.512 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.831 -3.787 10.128 1.00 0.00 H new ATOM 155 N GLY A 9 10.436 -0.044 7.761 1.00 0.00 N ATOM 156 CA GLY A 9 10.410 1.080 6.842 1.00 0.00 C ATOM 157 C GLY A 9 10.041 0.680 5.427 1.00 0.00 C ATOM 158 O GLY A 9 10.825 0.034 4.731 1.00 0.00 O ATOM 0 H GLY A 9 10.573 -0.955 7.324 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.696 1.820 7.202 1.00 0.00 H new ATOM 0 HA3 GLY A 9 11.389 1.559 6.835 1.00 0.00 H new ATOM 162 N GLU A 10 8.846 1.073 4.997 1.00 0.00 N ATOM 163 CA GLU A 10 8.373 0.763 3.652 1.00 0.00 C ATOM 164 C GLU A 10 8.245 2.037 2.823 1.00 0.00 C ATOM 165 O GLU A 10 8.629 3.117 3.272 1.00 0.00 O ATOM 166 CB GLU A 10 7.024 0.045 3.715 1.00 0.00 C ATOM 167 CG GLU A 10 7.139 -1.471 3.713 1.00 0.00 C ATOM 168 CD GLU A 10 7.970 -1.993 2.556 1.00 0.00 C ATOM 169 OE1 GLU A 10 7.417 -2.134 1.445 1.00 0.00 O ATOM 170 OE2 GLU A 10 9.173 -2.259 2.761 1.00 0.00 O ATOM 0 H GLU A 10 8.186 1.608 5.562 1.00 0.00 H new ATOM 0 HA GLU A 10 9.101 0.107 3.176 1.00 0.00 H new ATOM 0 HB2 GLU A 10 6.497 0.360 4.616 1.00 0.00 H new ATOM 0 HB3 GLU A 10 6.417 0.356 2.865 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.585 -1.799 4.652 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.141 -1.907 3.664 1.00 0.00 H new ATOM 177 N THR A 11 7.697 1.909 1.615 1.00 0.00 N ATOM 178 CA THR A 11 7.514 3.058 0.731 1.00 0.00 C ATOM 179 C THR A 11 7.126 2.621 -0.679 1.00 0.00 C ATOM 180 O THR A 11 7.989 2.422 -1.535 1.00 0.00 O ATOM 181 CB THR A 11 8.790 3.905 0.672 1.00 0.00 C ATOM 182 OG1 THR A 11 8.758 4.788 -0.436 1.00 0.00 O ATOM 183 CG2 THR A 11 10.053 3.078 0.561 1.00 0.00 C ATOM 0 H THR A 11 7.373 1.023 1.227 1.00 0.00 H new ATOM 0 HA THR A 11 6.703 3.658 1.143 1.00 0.00 H new ATOM 0 HB THR A 11 8.814 4.454 1.614 1.00 0.00 H new ATOM 0 HG1 THR A 11 9.581 5.320 -0.454 1.00 0.00 H new ATOM 0 HG21 THR A 11 10.919 3.739 0.524 1.00 0.00 H new ATOM 0 HG22 THR A 11 10.135 2.421 1.427 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.016 2.477 -0.348 1.00 0.00 H new ATOM 191 N LEU A 12 5.825 2.493 -0.923 1.00 0.00 N ATOM 192 CA LEU A 12 5.333 2.102 -2.242 1.00 0.00 C ATOM 193 C LEU A 12 4.570 3.262 -2.876 1.00 0.00 C ATOM 194 O LEU A 12 4.038 4.119 -2.170 1.00 0.00 O ATOM 195 CB LEU A 12 4.440 0.855 -2.149 1.00 0.00 C ATOM 196 CG LEU A 12 2.962 1.122 -1.836 1.00 0.00 C ATOM 197 CD1 LEU A 12 2.089 -0.024 -2.321 1.00 0.00 C ATOM 198 CD2 LEU A 12 2.772 1.352 -0.348 1.00 0.00 C ATOM 0 H LEU A 12 5.095 2.653 -0.229 1.00 0.00 H new ATOM 0 HA LEU A 12 6.188 1.854 -2.871 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.501 0.315 -3.094 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.843 0.197 -1.379 1.00 0.00 H new ATOM 0 HG LEU A 12 2.656 2.023 -2.367 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.046 0.189 -2.087 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.204 -0.138 -3.399 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.391 -0.946 -1.825 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.719 1.540 -0.141 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.098 0.469 0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.363 2.213 -0.034 1.00 0.00 H new ATOM 210 N MET A 13 4.517 3.292 -4.202 1.00 0.00 N ATOM 211 CA MET A 13 3.813 4.361 -4.899 1.00 0.00 C ATOM 212 C MET A 13 2.866 3.806 -5.951 1.00 0.00 C ATOM 213 O MET A 13 3.279 3.438 -7.050 1.00 0.00 O ATOM 214 CB MET A 13 4.810 5.327 -5.540 1.00 0.00 C ATOM 215 CG MET A 13 4.152 6.479 -6.282 1.00 0.00 C ATOM 216 SD MET A 13 5.347 7.663 -6.929 1.00 0.00 S ATOM 217 CE MET A 13 4.601 8.071 -8.506 1.00 0.00 C ATOM 0 H MET A 13 4.948 2.596 -4.811 1.00 0.00 H new ATOM 0 HA MET A 13 3.218 4.903 -4.164 1.00 0.00 H new ATOM 0 HB2 MET A 13 5.462 5.730 -4.765 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.444 4.774 -6.233 1.00 0.00 H new ATOM 0 HG2 MET A 13 3.557 6.083 -7.105 1.00 0.00 H new ATOM 0 HG3 MET A 13 3.465 6.993 -5.610 1.00 0.00 H new ATOM 0 HE1 MET A 13 4.920 9.067 -8.812 1.00 0.00 H new ATOM 0 HE2 MET A 13 4.914 7.344 -9.255 1.00 0.00 H new ATOM 0 HE3 MET A 13 3.515 8.050 -8.411 1.00 0.00 H new ATOM 227 N ILE A 14 1.588 3.760 -5.600 1.00 0.00 N ATOM 228 CA ILE A 14 0.560 3.265 -6.496 1.00 0.00 C ATOM 229 C ILE A 14 -0.361 4.404 -6.931 1.00 0.00 C ATOM 230 O ILE A 14 -0.901 5.130 -6.097 1.00 0.00 O ATOM 231 CB ILE A 14 -0.262 2.145 -5.821 1.00 0.00 C ATOM 232 CG1 ILE A 14 -1.475 1.760 -6.676 1.00 0.00 C ATOM 233 CG2 ILE A 14 -0.700 2.569 -4.426 1.00 0.00 C ATOM 234 CD1 ILE A 14 -1.121 1.404 -8.103 1.00 0.00 C ATOM 0 H ILE A 14 1.239 4.064 -4.691 1.00 0.00 H new ATOM 0 HA ILE A 14 1.048 2.851 -7.378 1.00 0.00 H new ATOM 0 HB ILE A 14 0.376 1.266 -5.730 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.981 0.912 -6.214 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.183 2.589 -6.682 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.278 1.767 -3.967 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.179 2.778 -3.816 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.315 3.466 -4.495 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.028 1.142 -8.648 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -0.642 2.258 -8.583 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -0.437 0.555 -8.107 1.00 0.00 H new ATOM 246 N GLY A 15 -0.529 4.560 -8.240 1.00 0.00 N ATOM 247 CA GLY A 15 -1.376 5.619 -8.764 1.00 0.00 C ATOM 248 C GLY A 15 -0.658 6.457 -9.806 1.00 0.00 C ATOM 249 O GLY A 15 -0.471 6.019 -10.942 1.00 0.00 O ATOM 0 H GLY A 15 -0.093 3.971 -8.950 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -2.272 5.182 -9.205 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.703 6.260 -7.946 1.00 0.00 H new ATOM 253 N ASP A 16 -0.249 7.661 -9.418 1.00 0.00 N ATOM 254 CA ASP A 16 0.460 8.556 -10.331 1.00 0.00 C ATOM 255 C ASP A 16 1.200 9.668 -9.581 1.00 0.00 C ATOM 256 O ASP A 16 1.713 10.600 -10.199 1.00 0.00 O ATOM 257 CB ASP A 16 -0.517 9.170 -11.336 1.00 0.00 C ATOM 258 CG ASP A 16 -1.555 10.052 -10.672 1.00 0.00 C ATOM 259 OD1 ASP A 16 -1.162 11.047 -10.026 1.00 0.00 O ATOM 260 OD2 ASP A 16 -2.760 9.749 -10.797 1.00 0.00 O ATOM 0 H ASP A 16 -0.395 8.040 -8.482 1.00 0.00 H new ATOM 0 HA ASP A 16 1.202 7.959 -10.861 1.00 0.00 H new ATOM 0 HB2 ASP A 16 0.040 9.757 -12.067 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.019 8.372 -11.883 1.00 0.00 H new ATOM 265 N GLU A 17 1.256 9.566 -8.250 1.00 0.00 N ATOM 266 CA GLU A 17 1.935 10.563 -7.421 1.00 0.00 C ATOM 267 C GLU A 17 1.535 10.396 -5.956 1.00 0.00 C ATOM 268 O GLU A 17 1.100 11.346 -5.305 1.00 0.00 O ATOM 269 CB GLU A 17 1.604 11.986 -7.897 1.00 0.00 C ATOM 270 CG GLU A 17 2.791 12.713 -8.509 1.00 0.00 C ATOM 271 CD GLU A 17 2.512 14.183 -8.751 1.00 0.00 C ATOM 272 OE1 GLU A 17 1.550 14.712 -8.154 1.00 0.00 O ATOM 273 OE2 GLU A 17 3.255 14.807 -9.538 1.00 0.00 O ATOM 0 H GLU A 17 0.837 8.800 -7.723 1.00 0.00 H new ATOM 0 HA GLU A 17 3.010 10.408 -7.515 1.00 0.00 H new ATOM 0 HB2 GLU A 17 0.800 11.937 -8.632 1.00 0.00 H new ATOM 0 HB3 GLU A 17 1.229 12.565 -7.053 1.00 0.00 H new ATOM 0 HG2 GLU A 17 3.653 12.614 -7.849 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.057 12.237 -9.453 1.00 0.00 H new ATOM 280 N VAL A 18 1.681 9.180 -5.442 1.00 0.00 N ATOM 281 CA VAL A 18 1.332 8.886 -4.068 1.00 0.00 C ATOM 282 C VAL A 18 2.568 8.494 -3.254 1.00 0.00 C ATOM 283 O VAL A 18 3.694 8.823 -3.625 1.00 0.00 O ATOM 284 CB VAL A 18 0.284 7.759 -4.013 1.00 0.00 C ATOM 285 CG1 VAL A 18 -0.913 8.099 -4.888 1.00 0.00 C ATOM 286 CG2 VAL A 18 0.894 6.426 -4.427 1.00 0.00 C ATOM 0 H VAL A 18 2.041 8.381 -5.964 1.00 0.00 H new ATOM 0 HA VAL A 18 0.909 9.789 -3.629 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.059 7.665 -2.983 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.643 7.291 -4.836 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -1.370 9.024 -4.536 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.585 8.226 -5.920 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.133 5.647 -4.379 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.274 6.500 -5.446 1.00 0.00 H new ATOM 0 HG23 VAL A 18 1.712 6.175 -3.752 1.00 0.00 H new ATOM 296 N THR A 19 2.349 7.785 -2.146 1.00 0.00 N ATOM 297 CA THR A 19 3.434 7.339 -1.277 1.00 0.00 C ATOM 298 C THR A 19 2.865 6.844 0.048 1.00 0.00 C ATOM 299 O THR A 19 2.421 7.636 0.875 1.00 0.00 O ATOM 300 CB THR A 19 4.439 8.470 -1.029 1.00 0.00 C ATOM 301 OG1 THR A 19 5.218 8.210 0.126 1.00 0.00 O ATOM 302 CG2 THR A 19 3.789 9.826 -0.849 1.00 0.00 C ATOM 0 H THR A 19 1.421 7.506 -1.829 1.00 0.00 H new ATOM 0 HA THR A 19 3.958 6.522 -1.772 1.00 0.00 H new ATOM 0 HB THR A 19 5.060 8.500 -1.925 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.853 8.943 0.264 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.559 10.579 -0.678 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.225 10.081 -1.746 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.114 9.795 0.007 1.00 0.00 H new ATOM 310 N VAL A 20 2.874 5.532 0.246 1.00 0.00 N ATOM 311 CA VAL A 20 2.347 4.951 1.476 1.00 0.00 C ATOM 312 C VAL A 20 3.440 4.219 2.253 1.00 0.00 C ATOM 313 O VAL A 20 3.979 3.212 1.787 1.00 0.00 O ATOM 314 CB VAL A 20 1.191 3.968 1.194 1.00 0.00 C ATOM 315 CG1 VAL A 20 0.379 3.716 2.455 1.00 0.00 C ATOM 316 CG2 VAL A 20 0.297 4.484 0.075 1.00 0.00 C ATOM 0 H VAL A 20 3.237 4.854 -0.423 1.00 0.00 H new ATOM 0 HA VAL A 20 1.968 5.780 2.074 1.00 0.00 H new ATOM 0 HB VAL A 20 1.626 3.022 0.871 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -0.431 3.020 2.234 1.00 0.00 H new ATOM 0 HG12 VAL A 20 1.024 3.290 3.224 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -0.039 4.657 2.813 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.509 3.773 -0.104 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.125 5.447 0.362 1.00 0.00 H new ATOM 0 HG23 VAL A 20 0.885 4.602 -0.835 1.00 0.00 H new ATOM 326 N THR A 21 3.767 4.740 3.433 1.00 0.00 N ATOM 327 CA THR A 21 4.798 4.144 4.279 1.00 0.00 C ATOM 328 C THR A 21 4.182 3.519 5.529 1.00 0.00 C ATOM 329 O THR A 21 3.594 4.214 6.357 1.00 0.00 O ATOM 330 CB THR A 21 5.830 5.200 4.678 1.00 0.00 C ATOM 331 OG1 THR A 21 6.169 6.014 3.569 1.00 0.00 O ATOM 332 CG2 THR A 21 7.113 4.609 5.222 1.00 0.00 C ATOM 0 H THR A 21 3.332 5.575 3.826 1.00 0.00 H new ATOM 0 HA THR A 21 5.293 3.358 3.709 1.00 0.00 H new ATOM 0 HB THR A 21 5.355 5.784 5.467 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.829 6.684 3.845 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.801 5.413 5.485 1.00 0.00 H new ATOM 0 HG22 THR A 21 6.893 4.015 6.109 1.00 0.00 H new ATOM 0 HG23 THR A 21 7.571 3.973 4.464 1.00 0.00 H new ATOM 340 N VAL A 22 4.318 2.203 5.657 1.00 0.00 N ATOM 341 CA VAL A 22 3.768 1.485 6.802 1.00 0.00 C ATOM 342 C VAL A 22 4.682 1.588 8.023 1.00 0.00 C ATOM 343 O VAL A 22 5.318 0.612 8.423 1.00 0.00 O ATOM 344 CB VAL A 22 3.534 -0.003 6.465 1.00 0.00 C ATOM 345 CG1 VAL A 22 2.537 -0.144 5.323 1.00 0.00 C ATOM 346 CG2 VAL A 22 4.848 -0.690 6.122 1.00 0.00 C ATOM 0 H VAL A 22 4.804 1.612 4.982 1.00 0.00 H new ATOM 0 HA VAL A 22 2.813 1.954 7.039 1.00 0.00 H new ATOM 0 HB VAL A 22 3.115 -0.491 7.345 1.00 0.00 H new ATOM 0 HG11 VAL A 22 2.386 -1.200 5.101 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.587 0.306 5.612 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.924 0.361 4.438 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.660 -1.738 5.888 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.300 -0.201 5.259 1.00 0.00 H new ATOM 0 HG23 VAL A 22 5.526 -0.624 6.973 1.00 0.00 H new ATOM 356 N LEU A 23 4.741 2.775 8.617 1.00 0.00 N ATOM 357 CA LEU A 23 5.574 2.998 9.793 1.00 0.00 C ATOM 358 C LEU A 23 4.791 2.686 11.075 1.00 0.00 C ATOM 359 O LEU A 23 3.961 1.777 11.088 1.00 0.00 O ATOM 360 CB LEU A 23 6.093 4.444 9.801 1.00 0.00 C ATOM 361 CG LEU A 23 7.402 4.697 10.574 1.00 0.00 C ATOM 362 CD1 LEU A 23 7.988 3.405 11.140 1.00 0.00 C ATOM 363 CD2 LEU A 23 8.421 5.392 9.683 1.00 0.00 C ATOM 0 H LEU A 23 4.223 3.596 8.304 1.00 0.00 H new ATOM 0 HA LEU A 23 6.430 2.325 9.753 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.239 4.760 8.768 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.318 5.083 10.223 1.00 0.00 H new ATOM 0 HG LEU A 23 7.162 5.347 11.416 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.910 3.628 11.677 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.271 2.949 11.823 1.00 0.00 H new ATOM 0 HD13 LEU A 23 8.202 2.714 10.324 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.339 5.563 10.245 1.00 0.00 H new ATOM 0 HD22 LEU A 23 8.636 4.764 8.818 1.00 0.00 H new ATOM 0 HD23 LEU A 23 8.018 6.347 9.347 1.00 0.00 H new ATOM 375 N GLY A 24 5.056 3.430 12.152 1.00 0.00 N ATOM 376 CA GLY A 24 4.362 3.192 13.405 1.00 0.00 C ATOM 377 C GLY A 24 4.526 1.767 13.892 1.00 0.00 C ATOM 378 O GLY A 24 3.637 0.936 13.707 1.00 0.00 O ATOM 0 H GLY A 24 5.737 4.189 12.176 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.740 3.878 14.163 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.302 3.410 13.278 1.00 0.00 H new ATOM 382 N VAL A 25 5.669 1.479 14.504 1.00 0.00 N ATOM 383 CA VAL A 25 5.946 0.143 15.003 1.00 0.00 C ATOM 384 C VAL A 25 5.384 -0.060 16.407 1.00 0.00 C ATOM 385 O VAL A 25 5.903 0.486 17.381 1.00 0.00 O ATOM 386 CB VAL A 25 7.460 -0.139 15.026 1.00 0.00 C ATOM 387 CG1 VAL A 25 7.729 -1.602 15.346 1.00 0.00 C ATOM 388 CG2 VAL A 25 8.098 0.253 13.701 1.00 0.00 C ATOM 0 H VAL A 25 6.416 2.154 14.665 1.00 0.00 H new ATOM 0 HA VAL A 25 5.457 -0.553 14.321 1.00 0.00 H new ATOM 0 HB VAL A 25 7.910 0.467 15.812 1.00 0.00 H new ATOM 0 HG11 VAL A 25 8.804 -1.780 15.357 1.00 0.00 H new ATOM 0 HG12 VAL A 25 7.311 -1.844 16.323 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.265 -2.232 14.587 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.168 0.046 13.737 1.00 0.00 H new ATOM 0 HG22 VAL A 25 7.644 -0.322 12.894 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.940 1.316 13.522 1.00 0.00 H new ATOM 398 N LYS A 26 4.319 -0.849 16.499 1.00 0.00 N ATOM 399 CA LYS A 26 3.681 -1.128 17.781 1.00 0.00 C ATOM 400 C LYS A 26 3.146 -2.556 17.827 1.00 0.00 C ATOM 401 O LYS A 26 2.864 -3.158 16.790 1.00 0.00 O ATOM 402 CB LYS A 26 2.547 -0.132 18.036 1.00 0.00 C ATOM 403 CG LYS A 26 2.826 0.826 19.183 1.00 0.00 C ATOM 404 CD LYS A 26 1.555 1.177 19.938 1.00 0.00 C ATOM 405 CE LYS A 26 1.405 0.339 21.197 1.00 0.00 C ATOM 406 NZ LYS A 26 0.099 0.577 21.871 1.00 0.00 N ATOM 0 H LYS A 26 3.879 -1.307 15.701 1.00 0.00 H new ATOM 0 HA LYS A 26 4.432 -1.020 18.564 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.369 0.444 17.128 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.631 -0.683 18.249 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.544 0.376 19.868 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.283 1.736 18.795 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.568 2.234 20.203 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.692 1.021 19.291 1.00 0.00 H new ATOM 0 HE2 LYS A 26 1.495 -0.717 20.943 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.217 0.571 21.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.036 -0.013 22.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.023 1.580 22.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.676 0.331 21.223 1.00 0.00 H new ATOM 420 N GLY A 27 3.008 -3.091 19.036 1.00 0.00 N ATOM 421 CA GLY A 27 2.508 -4.443 19.197 1.00 0.00 C ATOM 422 C GLY A 27 1.033 -4.561 18.869 1.00 0.00 C ATOM 423 O GLY A 27 0.290 -3.583 18.953 1.00 0.00 O ATOM 0 H GLY A 27 3.234 -2.611 19.907 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.075 -5.115 18.553 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.675 -4.769 20.224 1.00 0.00 H new ATOM 427 N ASN A 28 0.610 -5.763 18.487 1.00 0.00 N ATOM 428 CA ASN A 28 -0.785 -6.013 18.135 1.00 0.00 C ATOM 429 C ASN A 28 -1.157 -5.278 16.848 1.00 0.00 C ATOM 430 O ASN A 28 -1.041 -5.834 15.756 1.00 0.00 O ATOM 431 CB ASN A 28 -1.714 -5.597 19.282 1.00 0.00 C ATOM 432 CG ASN A 28 -2.198 -6.783 20.093 1.00 0.00 C ATOM 433 OD1 ASN A 28 -2.189 -7.919 19.619 1.00 0.00 O ATOM 434 ND2 ASN A 28 -2.624 -6.523 21.324 1.00 0.00 N ATOM 0 H ASN A 28 1.215 -6.581 18.413 1.00 0.00 H new ATOM 0 HA ASN A 28 -0.908 -7.083 17.965 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.189 -4.902 19.937 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.573 -5.064 18.875 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -2.962 -7.281 21.918 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.614 -5.566 21.676 1.00 0.00 H new ATOM 441 N GLN A 29 -1.600 -4.029 16.976 1.00 0.00 N ATOM 442 CA GLN A 29 -1.979 -3.233 15.815 1.00 0.00 C ATOM 443 C GLN A 29 -0.907 -2.194 15.503 1.00 0.00 C ATOM 444 O GLN A 29 -0.511 -1.417 16.371 1.00 0.00 O ATOM 445 CB GLN A 29 -3.323 -2.543 16.059 1.00 0.00 C ATOM 446 CG GLN A 29 -4.488 -3.511 16.189 1.00 0.00 C ATOM 447 CD GLN A 29 -5.650 -2.925 16.966 1.00 0.00 C ATOM 448 OE1 GLN A 29 -5.553 -2.693 18.171 1.00 0.00 O ATOM 449 NE2 GLN A 29 -6.760 -2.682 16.277 1.00 0.00 N ATOM 0 H GLN A 29 -1.704 -3.549 17.870 1.00 0.00 H new ATOM 0 HA GLN A 29 -2.075 -3.901 14.959 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -3.255 -1.945 16.968 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.523 -1.855 15.238 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -4.829 -3.799 15.194 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.147 -4.420 16.684 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.797 -2.890 15.279 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -7.575 -2.288 16.746 1.00 0.00 H new ATOM 458 N VAL A 30 -0.425 -2.200 14.265 1.00 0.00 N ATOM 459 CA VAL A 30 0.621 -1.271 13.851 1.00 0.00 C ATOM 460 C VAL A 30 0.034 -0.009 13.230 1.00 0.00 C ATOM 461 O VAL A 30 -0.891 -0.073 12.421 1.00 0.00 O ATOM 462 CB VAL A 30 1.589 -1.922 12.845 1.00 0.00 C ATOM 463 CG1 VAL A 30 2.530 -2.883 13.555 1.00 0.00 C ATOM 464 CG2 VAL A 30 0.820 -2.634 11.743 1.00 0.00 C ATOM 0 H VAL A 30 -0.741 -2.836 13.532 1.00 0.00 H new ATOM 0 HA VAL A 30 1.171 -1.002 14.753 1.00 0.00 H new ATOM 0 HB VAL A 30 2.188 -1.135 12.386 1.00 0.00 H new ATOM 0 HG11 VAL A 30 3.206 -3.333 12.828 1.00 0.00 H new ATOM 0 HG12 VAL A 30 3.109 -2.340 14.302 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.950 -3.665 14.044 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.522 -3.087 11.043 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.192 -3.410 12.181 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.193 -1.916 11.214 1.00 0.00 H new ATOM 474 N ARG A 31 0.591 1.140 13.608 1.00 0.00 N ATOM 475 CA ARG A 31 0.141 2.414 13.087 1.00 0.00 C ATOM 476 C ARG A 31 0.727 2.649 11.701 1.00 0.00 C ATOM 477 O ARG A 31 1.894 3.015 11.565 1.00 0.00 O ATOM 478 CB ARG A 31 0.535 3.556 14.029 1.00 0.00 C ATOM 479 CG ARG A 31 0.541 3.167 15.500 1.00 0.00 C ATOM 480 CD ARG A 31 0.170 4.343 16.389 1.00 0.00 C ATOM 481 NE ARG A 31 0.828 4.275 17.691 1.00 0.00 N ATOM 482 CZ ARG A 31 0.506 5.048 18.726 1.00 0.00 C ATOM 483 NH1 ARG A 31 -0.464 5.946 18.615 1.00 0.00 N ATOM 484 NH2 ARG A 31 1.157 4.922 19.874 1.00 0.00 N ATOM 0 H ARG A 31 1.358 1.207 14.277 1.00 0.00 H new ATOM 0 HA ARG A 31 -0.946 2.391 13.013 1.00 0.00 H new ATOM 0 HB2 ARG A 31 1.527 3.915 13.754 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -0.156 4.387 13.886 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -0.161 2.350 15.664 1.00 0.00 H new ATOM 0 HG3 ARG A 31 1.529 2.798 15.776 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.445 5.274 15.892 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.911 4.364 16.530 1.00 0.00 H new ATOM 0 HE ARG A 31 1.578 3.595 17.815 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -0.967 6.047 17.734 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.707 6.536 19.411 1.00 0.00 H new ATOM 0 HH21 ARG A 31 1.904 4.233 19.964 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.911 5.514 20.667 1.00 0.00 H new ATOM 498 N ILE A 32 -0.081 2.415 10.676 1.00 0.00 N ATOM 499 CA ILE A 32 0.368 2.577 9.299 1.00 0.00 C ATOM 500 C ILE A 32 0.181 4.009 8.811 1.00 0.00 C ATOM 501 O ILE A 32 -0.874 4.610 9.006 1.00 0.00 O ATOM 502 CB ILE A 32 -0.387 1.619 8.359 1.00 0.00 C ATOM 503 CG1 ILE A 32 -0.410 0.206 8.950 1.00 0.00 C ATOM 504 CG2 ILE A 32 0.252 1.616 6.979 1.00 0.00 C ATOM 505 CD1 ILE A 32 0.956 -0.438 9.033 1.00 0.00 C ATOM 0 H ILE A 32 -1.050 2.112 10.771 1.00 0.00 H new ATOM 0 HA ILE A 32 1.432 2.339 9.282 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.415 1.966 8.257 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.845 0.246 9.949 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.062 -0.422 8.343 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.294 0.934 6.327 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.219 2.622 6.561 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.289 1.290 7.059 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.862 -1.436 9.461 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.385 -0.510 8.034 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.606 0.168 9.664 1.00 0.00 H new ATOM 517 N GLY A 33 1.215 4.546 8.170 1.00 0.00 N ATOM 518 CA GLY A 33 1.151 5.901 7.657 1.00 0.00 C ATOM 519 C GLY A 33 0.905 5.938 6.162 1.00 0.00 C ATOM 520 O GLY A 33 1.705 5.421 5.382 1.00 0.00 O ATOM 0 H GLY A 33 2.098 4.065 7.997 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.355 6.443 8.168 1.00 0.00 H new ATOM 0 HA3 GLY A 33 2.084 6.417 7.882 1.00 0.00 H new ATOM 524 N VAL A 34 -0.205 6.544 5.759 1.00 0.00 N ATOM 525 CA VAL A 34 -0.550 6.634 4.347 1.00 0.00 C ATOM 526 C VAL A 34 -0.415 8.061 3.829 1.00 0.00 C ATOM 527 O VAL A 34 -0.956 9.001 4.414 1.00 0.00 O ATOM 528 CB VAL A 34 -1.987 6.144 4.089 1.00 0.00 C ATOM 529 CG1 VAL A 34 -2.273 6.082 2.596 1.00 0.00 C ATOM 530 CG2 VAL A 34 -2.214 4.788 4.741 1.00 0.00 C ATOM 0 H VAL A 34 -0.880 6.979 6.388 1.00 0.00 H new ATOM 0 HA VAL A 34 0.151 5.992 3.814 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.679 6.857 4.537 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.293 5.734 2.435 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.156 7.075 2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.575 5.393 2.120 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.235 4.458 4.548 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.514 4.063 4.326 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.056 4.870 5.816 1.00 0.00 H new ATOM 540 N ASN A 35 0.293 8.211 2.715 1.00 0.00 N ATOM 541 CA ASN A 35 0.480 9.519 2.100 1.00 0.00 C ATOM 542 C ASN A 35 -0.009 9.496 0.655 1.00 0.00 C ATOM 543 O ASN A 35 0.622 8.904 -0.221 1.00 0.00 O ATOM 544 CB ASN A 35 1.950 9.941 2.157 1.00 0.00 C ATOM 545 CG ASN A 35 2.119 11.392 2.563 1.00 0.00 C ATOM 546 OD1 ASN A 35 1.670 11.806 3.631 1.00 0.00 O ATOM 547 ND2 ASN A 35 2.770 12.173 1.708 1.00 0.00 N ATOM 0 H ASN A 35 0.746 7.443 2.220 1.00 0.00 H new ATOM 0 HA ASN A 35 -0.106 10.248 2.659 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.481 9.304 2.865 1.00 0.00 H new ATOM 0 HB3 ASN A 35 2.409 9.784 1.181 1.00 0.00 H new ATOM 0 HD21 ASN A 35 2.915 13.159 1.926 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.125 11.787 0.833 1.00 0.00 H new ATOM 554 N ALA A 36 -1.144 10.140 0.421 1.00 0.00 N ATOM 555 CA ALA A 36 -1.732 10.192 -0.913 1.00 0.00 C ATOM 556 C ALA A 36 -2.317 11.569 -1.217 1.00 0.00 C ATOM 557 O ALA A 36 -2.826 12.250 -0.327 1.00 0.00 O ATOM 558 CB ALA A 36 -2.804 9.122 -1.055 1.00 0.00 C ATOM 0 H ALA A 36 -1.677 10.634 1.137 1.00 0.00 H new ATOM 0 HA ALA A 36 -0.937 10.003 -1.635 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.236 9.170 -2.055 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.360 8.139 -0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.585 9.289 -0.314 1.00 0.00 H new ATOM 564 N PRO A 37 -2.254 11.994 -2.492 1.00 0.00 N ATOM 565 CA PRO A 37 -2.779 13.288 -2.927 1.00 0.00 C ATOM 566 C PRO A 37 -4.278 13.241 -3.201 1.00 0.00 C ATOM 567 O PRO A 37 -4.833 12.178 -3.478 1.00 0.00 O ATOM 568 CB PRO A 37 -2.012 13.538 -4.221 1.00 0.00 C ATOM 569 CG PRO A 37 -1.816 12.178 -4.794 1.00 0.00 C ATOM 570 CD PRO A 37 -1.665 11.242 -3.619 1.00 0.00 C ATOM 0 HA PRO A 37 -2.654 14.064 -2.172 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.574 14.180 -4.900 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -1.059 14.032 -4.031 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.666 11.891 -5.413 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -0.932 12.148 -5.431 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.187 10.300 -3.788 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -0.619 10.998 -3.434 1.00 0.00 H new ATOM 578 N LYS A 38 -4.928 14.397 -3.126 1.00 0.00 N ATOM 579 CA LYS A 38 -6.363 14.482 -3.372 1.00 0.00 C ATOM 580 C LYS A 38 -6.664 14.645 -4.864 1.00 0.00 C ATOM 581 O LYS A 38 -7.775 15.018 -5.240 1.00 0.00 O ATOM 582 CB LYS A 38 -6.965 15.650 -2.586 1.00 0.00 C ATOM 583 CG LYS A 38 -8.140 15.251 -1.709 1.00 0.00 C ATOM 584 CD LYS A 38 -7.675 14.569 -0.432 1.00 0.00 C ATOM 585 CE LYS A 38 -7.607 15.547 0.730 1.00 0.00 C ATOM 586 NZ LYS A 38 -8.782 15.417 1.635 1.00 0.00 N ATOM 0 H LYS A 38 -4.485 15.287 -2.897 1.00 0.00 H new ATOM 0 HA LYS A 38 -6.816 13.550 -3.036 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.190 16.094 -1.961 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -7.290 16.419 -3.286 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -8.725 16.136 -1.458 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -8.797 14.580 -2.262 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -8.356 13.755 -0.184 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.693 14.125 -0.593 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.692 15.375 1.296 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -7.556 16.565 0.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -8.698 16.101 2.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.654 15.606 1.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.816 14.453 2.023 1.00 0.00 H new ATOM 600 N GLU A 39 -5.673 14.367 -5.709 1.00 0.00 N ATOM 601 CA GLU A 39 -5.844 14.487 -7.153 1.00 0.00 C ATOM 602 C GLU A 39 -6.215 13.142 -7.773 1.00 0.00 C ATOM 603 O GLU A 39 -7.037 13.078 -8.688 1.00 0.00 O ATOM 604 CB GLU A 39 -4.563 15.025 -7.796 1.00 0.00 C ATOM 605 CG GLU A 39 -4.805 16.168 -8.768 1.00 0.00 C ATOM 606 CD GLU A 39 -3.974 16.046 -10.030 1.00 0.00 C ATOM 607 OE1 GLU A 39 -4.093 15.013 -10.722 1.00 0.00 O ATOM 608 OE2 GLU A 39 -3.203 16.984 -10.326 1.00 0.00 O ATOM 0 H GLU A 39 -4.746 14.058 -5.418 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.658 15.187 -7.340 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.887 15.363 -7.011 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.061 14.212 -8.321 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -5.862 16.196 -9.034 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.575 17.113 -8.276 1.00 0.00 H new ATOM 615 N VAL A 40 -5.608 12.071 -7.271 1.00 0.00 N ATOM 616 CA VAL A 40 -5.881 10.731 -7.780 1.00 0.00 C ATOM 617 C VAL A 40 -7.065 10.104 -7.050 1.00 0.00 C ATOM 618 O VAL A 40 -7.230 10.288 -5.844 1.00 0.00 O ATOM 619 CB VAL A 40 -4.653 9.808 -7.643 1.00 0.00 C ATOM 620 CG1 VAL A 40 -4.825 8.561 -8.496 1.00 0.00 C ATOM 621 CG2 VAL A 40 -3.379 10.548 -8.022 1.00 0.00 C ATOM 0 H VAL A 40 -4.925 12.104 -6.514 1.00 0.00 H new ATOM 0 HA VAL A 40 -6.120 10.836 -8.838 1.00 0.00 H new ATOM 0 HB VAL A 40 -4.570 9.501 -6.600 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.949 7.922 -8.387 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -5.713 8.018 -8.172 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -4.937 8.848 -9.542 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.525 9.879 -7.918 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.450 10.889 -9.055 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.248 11.408 -7.365 1.00 0.00 H new ATOM 631 N SER A 41 -7.888 9.365 -7.789 1.00 0.00 N ATOM 632 CA SER A 41 -9.059 8.713 -7.210 1.00 0.00 C ATOM 633 C SER A 41 -8.664 7.815 -6.043 1.00 0.00 C ATOM 634 O SER A 41 -8.235 6.678 -6.240 1.00 0.00 O ATOM 635 CB SER A 41 -9.790 7.893 -8.275 1.00 0.00 C ATOM 636 OG SER A 41 -10.721 8.692 -8.985 1.00 0.00 O ATOM 0 H SER A 41 -7.766 9.203 -8.789 1.00 0.00 H new ATOM 0 HA SER A 41 -9.726 9.489 -6.836 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.067 7.467 -8.971 1.00 0.00 H new ATOM 0 HB3 SER A 41 -10.308 7.058 -7.803 1.00 0.00 H new ATOM 0 HG SER A 41 -11.173 8.145 -9.661 1.00 0.00 H new ATOM 642 N VAL A 42 -8.809 8.332 -4.827 1.00 0.00 N ATOM 643 CA VAL A 42 -8.466 7.575 -3.630 1.00 0.00 C ATOM 644 C VAL A 42 -9.668 7.445 -2.694 1.00 0.00 C ATOM 645 O VAL A 42 -10.217 8.447 -2.235 1.00 0.00 O ATOM 646 CB VAL A 42 -7.302 8.236 -2.866 1.00 0.00 C ATOM 647 CG1 VAL A 42 -7.696 9.622 -2.377 1.00 0.00 C ATOM 648 CG2 VAL A 42 -6.856 7.359 -1.705 1.00 0.00 C ATOM 0 H VAL A 42 -9.162 9.272 -4.645 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.160 6.582 -3.959 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.462 8.346 -3.552 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.860 10.070 -1.841 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.957 10.248 -3.230 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.554 9.542 -1.710 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -6.034 7.843 -1.178 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.690 7.212 -1.019 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.525 6.393 -2.085 1.00 0.00 H new ATOM 658 N HIS A 43 -10.068 6.209 -2.407 1.00 0.00 N ATOM 659 CA HIS A 43 -11.196 5.956 -1.520 1.00 0.00 C ATOM 660 C HIS A 43 -10.801 4.972 -0.423 1.00 0.00 C ATOM 661 O HIS A 43 -10.144 3.966 -0.689 1.00 0.00 O ATOM 662 CB HIS A 43 -12.386 5.411 -2.314 1.00 0.00 C ATOM 663 CG HIS A 43 -13.532 6.371 -2.408 1.00 0.00 C ATOM 664 ND1 HIS A 43 -13.994 6.878 -3.604 1.00 0.00 N ATOM 665 CD2 HIS A 43 -14.314 6.916 -1.446 1.00 0.00 C ATOM 666 CE1 HIS A 43 -15.007 7.693 -3.376 1.00 0.00 C ATOM 667 NE2 HIS A 43 -15.222 7.733 -2.074 1.00 0.00 N ATOM 0 H HIS A 43 -9.626 5.367 -2.777 1.00 0.00 H new ATOM 0 HA HIS A 43 -11.487 6.898 -1.055 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -12.054 5.154 -3.320 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -12.732 4.489 -1.847 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -14.238 6.741 -0.383 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -15.564 8.234 -4.126 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -15.945 8.282 -1.610 1.00 0.00 H new ATOM 675 N ARG A 44 -11.202 5.265 0.809 1.00 0.00 N ATOM 676 CA ARG A 44 -10.883 4.399 1.938 1.00 0.00 C ATOM 677 C ARG A 44 -11.877 4.598 3.078 1.00 0.00 C ATOM 678 O ARG A 44 -12.656 3.701 3.398 1.00 0.00 O ATOM 679 CB ARG A 44 -9.460 4.673 2.431 1.00 0.00 C ATOM 680 CG ARG A 44 -8.909 3.582 3.333 1.00 0.00 C ATOM 681 CD ARG A 44 -7.559 3.968 3.916 1.00 0.00 C ATOM 682 NE ARG A 44 -7.334 3.357 5.223 1.00 0.00 N ATOM 683 CZ ARG A 44 -6.364 3.723 6.057 1.00 0.00 C ATOM 684 NH1 ARG A 44 -5.522 4.693 5.723 1.00 0.00 N ATOM 685 NH2 ARG A 44 -6.236 3.116 7.229 1.00 0.00 N ATOM 0 H ARG A 44 -11.747 6.093 1.051 1.00 0.00 H new ATOM 0 HA ARG A 44 -10.951 3.365 1.600 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -8.802 4.788 1.570 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.447 5.620 2.971 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -9.613 3.387 4.142 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -8.810 2.656 2.767 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.768 3.662 3.232 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -7.500 5.053 4.008 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.958 2.604 5.514 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.616 5.163 4.822 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -4.781 4.969 6.367 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.881 2.370 7.490 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.493 3.395 7.870 1.00 0.00 H new ATOM 699 N GLU A 45 -11.845 5.779 3.686 1.00 0.00 N ATOM 700 CA GLU A 45 -12.744 6.094 4.790 1.00 0.00 C ATOM 701 C GLU A 45 -12.790 7.598 5.043 1.00 0.00 C ATOM 702 O GLU A 45 -11.766 8.225 5.319 1.00 0.00 O ATOM 703 CB GLU A 45 -12.305 5.360 6.060 1.00 0.00 C ATOM 704 CG GLU A 45 -13.417 4.555 6.713 1.00 0.00 C ATOM 705 CD GLU A 45 -14.024 3.532 5.773 1.00 0.00 C ATOM 706 OE1 GLU A 45 -13.400 2.470 5.568 1.00 0.00 O ATOM 707 OE2 GLU A 45 -15.125 3.793 5.243 1.00 0.00 O ATOM 0 H GLU A 45 -11.207 6.533 3.433 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.745 5.761 4.517 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.479 4.692 5.816 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.925 6.088 6.777 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.024 4.046 7.593 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.197 5.233 7.059 1.00 0.00 H new ATOM 714 N GLU A 46 -13.987 8.171 4.952 1.00 0.00 N ATOM 715 CA GLU A 46 -14.168 9.600 5.173 1.00 0.00 C ATOM 716 C GLU A 46 -13.672 10.001 6.558 1.00 0.00 C ATOM 717 O GLU A 46 -13.014 11.027 6.719 1.00 0.00 O ATOM 718 CB GLU A 46 -15.642 9.980 5.016 1.00 0.00 C ATOM 719 CG GLU A 46 -16.560 9.278 6.002 1.00 0.00 C ATOM 720 CD GLU A 46 -18.025 9.579 5.750 1.00 0.00 C ATOM 721 OE1 GLU A 46 -18.599 8.989 4.812 1.00 0.00 O ATOM 722 OE2 GLU A 46 -18.596 10.406 6.491 1.00 0.00 O ATOM 0 H GLU A 46 -14.845 7.667 4.727 1.00 0.00 H new ATOM 0 HA GLU A 46 -13.582 10.136 4.426 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -15.746 11.058 5.140 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -15.963 9.744 4.002 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -16.398 8.202 5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.299 9.582 7.016 1.00 0.00 H new ATOM 729 N ILE A 47 -13.988 9.180 7.554 1.00 0.00 N ATOM 730 CA ILE A 47 -13.569 9.447 8.924 1.00 0.00 C ATOM 731 C ILE A 47 -12.051 9.346 9.056 1.00 0.00 C ATOM 732 O ILE A 47 -11.422 10.151 9.742 1.00 0.00 O ATOM 733 CB ILE A 47 -14.241 8.471 9.918 1.00 0.00 C ATOM 734 CG1 ILE A 47 -13.722 8.701 11.342 1.00 0.00 C ATOM 735 CG2 ILE A 47 -14.011 7.027 9.492 1.00 0.00 C ATOM 736 CD1 ILE A 47 -14.810 9.058 12.332 1.00 0.00 C ATOM 0 H ILE A 47 -14.532 8.325 7.438 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.883 10.462 9.167 1.00 0.00 H new ATOM 0 HB ILE A 47 -15.314 8.665 9.910 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -13.212 7.800 11.684 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -12.981 9.500 11.325 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -14.492 6.357 10.204 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -14.436 6.868 8.501 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -12.941 6.822 9.466 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -14.370 9.206 13.318 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -15.305 9.976 12.014 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -15.540 8.250 12.378 1.00 0.00 H new ATOM 748 N TYR A 48 -11.471 8.346 8.401 1.00 0.00 N ATOM 749 CA TYR A 48 -10.030 8.130 8.449 1.00 0.00 C ATOM 750 C TYR A 48 -9.257 9.397 8.091 1.00 0.00 C ATOM 751 O TYR A 48 -8.301 9.761 8.773 1.00 0.00 O ATOM 752 CB TYR A 48 -9.636 6.991 7.504 1.00 0.00 C ATOM 753 CG TYR A 48 -9.822 5.608 8.096 1.00 0.00 C ATOM 754 CD1 TYR A 48 -10.607 5.407 9.227 1.00 0.00 C ATOM 755 CD2 TYR A 48 -9.210 4.503 7.521 1.00 0.00 C ATOM 756 CE1 TYR A 48 -10.774 4.145 9.765 1.00 0.00 C ATOM 757 CE2 TYR A 48 -9.373 3.237 8.052 1.00 0.00 C ATOM 758 CZ TYR A 48 -10.155 3.064 9.174 1.00 0.00 C ATOM 759 OH TYR A 48 -10.320 1.806 9.706 1.00 0.00 O ATOM 0 H TYR A 48 -11.979 7.671 7.829 1.00 0.00 H new ATOM 0 HA TYR A 48 -9.770 7.859 9.472 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -10.228 7.068 6.592 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -8.592 7.115 7.217 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -11.094 6.251 9.692 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.595 4.635 6.643 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -11.386 4.006 10.644 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -8.890 2.388 7.590 1.00 0.00 H new ATOM 0 HH TYR A 48 -9.819 1.156 9.171 1.00 0.00 H new ATOM 769 N GLN A 49 -9.664 10.060 7.013 1.00 0.00 N ATOM 770 CA GLN A 49 -8.990 11.279 6.569 1.00 0.00 C ATOM 771 C GLN A 49 -9.548 12.520 7.265 1.00 0.00 C ATOM 772 O GLN A 49 -8.810 13.265 7.911 1.00 0.00 O ATOM 773 CB GLN A 49 -9.123 11.432 5.053 1.00 0.00 C ATOM 774 CG GLN A 49 -8.075 10.658 4.270 1.00 0.00 C ATOM 775 CD GLN A 49 -8.576 10.209 2.911 1.00 0.00 C ATOM 776 OE1 GLN A 49 -9.781 10.091 2.689 1.00 0.00 O ATOM 777 NE2 GLN A 49 -7.650 9.954 1.993 1.00 0.00 N ATOM 0 H GLN A 49 -10.453 9.777 6.432 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.937 11.189 6.837 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -10.114 11.096 4.748 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.051 12.489 4.795 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -7.191 11.282 4.139 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.767 9.785 4.846 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -6.662 10.065 2.221 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -7.927 9.647 1.061 1.00 0.00 H new ATOM 786 N ARG A 50 -10.850 12.746 7.113 1.00 0.00 N ATOM 787 CA ARG A 50 -11.516 13.907 7.706 1.00 0.00 C ATOM 788 C ARG A 50 -11.176 14.087 9.188 1.00 0.00 C ATOM 789 O ARG A 50 -11.343 15.176 9.737 1.00 0.00 O ATOM 790 CB ARG A 50 -13.031 13.786 7.538 1.00 0.00 C ATOM 791 CG ARG A 50 -13.490 13.861 6.090 1.00 0.00 C ATOM 792 CD ARG A 50 -14.644 14.837 5.918 1.00 0.00 C ATOM 793 NE ARG A 50 -14.691 15.395 4.569 1.00 0.00 N ATOM 794 CZ ARG A 50 -15.534 16.354 4.193 1.00 0.00 C ATOM 795 NH1 ARG A 50 -16.399 16.865 5.060 1.00 0.00 N ATOM 796 NH2 ARG A 50 -15.512 16.803 2.945 1.00 0.00 N ATOM 0 H ARG A 50 -11.471 12.137 6.580 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.150 14.787 7.178 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.361 12.840 7.967 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.516 14.580 8.106 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -12.656 14.168 5.459 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -13.797 12.871 5.753 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -15.584 14.329 6.133 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -14.546 15.646 6.642 1.00 0.00 H new ATOM 0 HE ARG A 50 -14.040 15.028 3.875 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -16.420 16.523 6.021 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -17.042 17.600 4.766 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.849 16.413 2.274 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.158 17.538 2.656 1.00 0.00 H new ATOM 810 N ILE A 51 -10.712 13.024 9.837 1.00 0.00 N ATOM 811 CA ILE A 51 -10.369 13.089 11.253 1.00 0.00 C ATOM 812 C ILE A 51 -8.859 13.029 11.466 1.00 0.00 C ATOM 813 O ILE A 51 -8.286 13.885 12.141 1.00 0.00 O ATOM 814 CB ILE A 51 -11.039 11.949 12.046 1.00 0.00 C ATOM 815 CG1 ILE A 51 -12.544 11.915 11.762 1.00 0.00 C ATOM 816 CG2 ILE A 51 -10.779 12.109 13.539 1.00 0.00 C ATOM 817 CD1 ILE A 51 -13.245 13.229 12.033 1.00 0.00 C ATOM 0 H ILE A 51 -10.565 12.111 9.407 1.00 0.00 H new ATOM 0 HA ILE A 51 -10.740 14.045 11.621 1.00 0.00 H new ATOM 0 HB ILE A 51 -10.605 11.003 11.724 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -12.702 11.638 10.720 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -13.002 11.136 12.372 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -11.260 11.295 14.081 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.705 12.085 13.726 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -11.185 13.061 13.879 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -14.307 13.128 11.809 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -13.119 13.499 13.082 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -12.814 14.008 11.404 1.00 0.00 H new ATOM 829 N GLN A 52 -8.217 12.018 10.891 1.00 0.00 N ATOM 830 CA GLN A 52 -6.773 11.862 11.027 1.00 0.00 C ATOM 831 C GLN A 52 -6.038 12.993 10.318 1.00 0.00 C ATOM 832 O GLN A 52 -5.347 13.789 10.953 1.00 0.00 O ATOM 833 CB GLN A 52 -6.320 10.512 10.469 1.00 0.00 C ATOM 834 CG GLN A 52 -5.024 10.007 11.082 1.00 0.00 C ATOM 835 CD GLN A 52 -5.096 9.900 12.592 1.00 0.00 C ATOM 836 OE1 GLN A 52 -5.474 8.862 13.136 1.00 0.00 O ATOM 837 NE2 GLN A 52 -4.732 10.977 13.280 1.00 0.00 N ATOM 0 H GLN A 52 -8.670 11.298 10.329 1.00 0.00 H new ATOM 0 HA GLN A 52 -6.530 11.901 12.089 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.105 9.775 10.640 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.193 10.598 9.390 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -4.785 9.029 10.663 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.211 10.679 10.807 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.425 11.816 12.789 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -4.759 10.964 14.300 1.00 0.00 H new ATOM 846 N ALA A 53 -6.196 13.066 9.000 1.00 0.00 N ATOM 847 CA ALA A 53 -5.552 14.108 8.215 1.00 0.00 C ATOM 848 C ALA A 53 -6.196 15.460 8.488 1.00 0.00 C ATOM 849 O ALA A 53 -5.534 16.498 8.445 1.00 0.00 O ATOM 850 CB ALA A 53 -5.623 13.776 6.731 1.00 0.00 C ATOM 0 H ALA A 53 -6.764 12.416 8.456 1.00 0.00 H new ATOM 0 HA ALA A 53 -4.504 14.161 8.509 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -5.137 14.565 6.158 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -5.117 12.829 6.545 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.666 13.696 6.426 1.00 0.00 H new ATOM 856 N GLU A 54 -7.494 15.438 8.771 1.00 0.00 N ATOM 857 CA GLU A 54 -8.237 16.657 9.055 1.00 0.00 C ATOM 858 C GLU A 54 -8.621 16.726 10.529 1.00 0.00 C ATOM 859 O GLU A 54 -9.333 15.861 11.039 1.00 0.00 O ATOM 860 CB GLU A 54 -9.491 16.730 8.181 1.00 0.00 C ATOM 861 CG GLU A 54 -9.422 17.801 7.105 1.00 0.00 C ATOM 862 CD GLU A 54 -8.246 17.610 6.169 1.00 0.00 C ATOM 863 OE1 GLU A 54 -8.116 16.508 5.596 1.00 0.00 O ATOM 864 OE2 GLU A 54 -7.454 18.563 6.009 1.00 0.00 O ATOM 0 H GLU A 54 -8.053 14.586 8.809 1.00 0.00 H new ATOM 0 HA GLU A 54 -7.596 17.508 8.826 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -9.651 15.761 7.708 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.356 16.921 8.816 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.347 17.791 6.528 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -9.351 18.781 7.577 1.00 0.00 H new ATOM 871 N LYS A 55 -8.147 17.763 11.204 1.00 0.00 N ATOM 872 CA LYS A 55 -8.435 17.959 12.609 1.00 0.00 C ATOM 873 C LYS A 55 -9.930 18.158 12.829 1.00 0.00 C ATOM 874 O LYS A 55 -10.432 19.279 12.749 1.00 0.00 O ATOM 875 CB LYS A 55 -7.660 19.163 13.148 1.00 0.00 C ATOM 876 CG LYS A 55 -6.154 19.049 12.965 1.00 0.00 C ATOM 877 CD LYS A 55 -5.423 19.083 14.297 1.00 0.00 C ATOM 878 CE LYS A 55 -3.919 18.958 14.111 1.00 0.00 C ATOM 879 NZ LYS A 55 -3.548 17.693 13.418 1.00 0.00 N ATOM 0 H LYS A 55 -7.556 18.485 10.793 1.00 0.00 H new ATOM 0 HA LYS A 55 -8.121 17.066 13.150 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -8.011 20.065 12.647 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -7.881 19.281 14.209 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -5.920 18.120 12.445 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.801 19.865 12.335 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.650 20.015 14.814 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -5.781 18.271 14.930 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -3.553 19.808 13.535 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -3.429 18.996 15.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.529 17.520 13.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.082 16.902 13.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.773 17.773 12.406 1.00 0.00 H new ATOM 983 N MET B 1 0.685 13.527 6.208 1.00 0.00 N ATOM 984 CA MET B 1 0.721 12.074 6.520 1.00 0.00 C ATOM 985 C MET B 1 -0.449 11.673 7.413 1.00 0.00 C ATOM 986 O MET B 1 -0.880 12.441 8.273 1.00 0.00 O ATOM 987 CB MET B 1 2.050 11.757 7.209 1.00 0.00 C ATOM 988 CG MET B 1 2.973 10.883 6.375 1.00 0.00 C ATOM 989 SD MET B 1 3.878 9.680 7.369 1.00 0.00 S ATOM 990 CE MET B 1 3.861 8.260 6.278 1.00 0.00 C ATOM 0 H1 MET B 1 1.648 13.862 6.002 1.00 0.00 H new ATOM 0 H2 MET B 1 0.077 13.689 5.380 1.00 0.00 H new ATOM 0 H3 MET B 1 0.304 14.048 7.024 1.00 0.00 H new ATOM 0 HA MET B 1 0.634 11.505 5.594 1.00 0.00 H new ATOM 0 HB2 MET B 1 2.561 12.691 7.443 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.849 11.258 8.157 1.00 0.00 H new ATOM 0 HG2 MET B 1 2.386 10.358 5.621 1.00 0.00 H new ATOM 0 HG3 MET B 1 3.683 11.516 5.842 1.00 0.00 H new ATOM 0 HE1 MET B 1 4.273 7.396 6.799 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.836 8.046 5.975 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.464 8.472 5.395 1.00 0.00 H new ATOM 1002 N LEU B 2 -0.957 10.462 7.205 1.00 0.00 N ATOM 1003 CA LEU B 2 -2.074 9.954 7.992 1.00 0.00 C ATOM 1004 C LEU B 2 -1.698 8.653 8.691 1.00 0.00 C ATOM 1005 O LEU B 2 -1.465 7.637 8.038 1.00 0.00 O ATOM 1006 CB LEU B 2 -3.294 9.726 7.097 1.00 0.00 C ATOM 1007 CG LEU B 2 -4.005 10.997 6.633 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -3.391 11.510 5.339 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -5.494 10.738 6.452 1.00 0.00 C ATOM 0 H LEU B 2 -0.612 9.814 6.497 1.00 0.00 H new ATOM 0 HA LEU B 2 -2.319 10.698 8.750 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -2.980 9.163 6.218 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -4.009 9.104 7.636 1.00 0.00 H new ATOM 0 HG LEU B 2 -3.879 11.762 7.399 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -3.910 12.415 5.024 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -2.336 11.734 5.500 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -3.486 10.749 4.564 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -5.985 11.653 6.121 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -5.639 9.958 5.705 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -5.925 10.417 7.400 1.00 0.00 H new ATOM 1021 N ILE B 3 -1.651 8.681 10.020 1.00 0.00 N ATOM 1022 CA ILE B 3 -1.314 7.490 10.789 1.00 0.00 C ATOM 1023 C ILE B 3 -2.580 6.780 11.260 1.00 0.00 C ATOM 1024 O ILE B 3 -3.246 7.224 12.195 1.00 0.00 O ATOM 1025 CB ILE B 3 -0.432 7.836 12.008 1.00 0.00 C ATOM 1026 CG1 ILE B 3 0.867 8.511 11.554 1.00 0.00 C ATOM 1027 CG2 ILE B 3 -0.130 6.587 12.826 1.00 0.00 C ATOM 1028 CD1 ILE B 3 1.851 7.564 10.888 1.00 0.00 C ATOM 0 H ILE B 3 -1.841 9.510 10.583 1.00 0.00 H new ATOM 0 HA ILE B 3 -0.751 6.827 10.132 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.980 8.533 12.642 1.00 0.00 H new ATOM 0 HG12 ILE B 3 0.624 9.315 10.859 1.00 0.00 H new ATOM 0 HG13 ILE B 3 1.348 8.971 12.418 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.493 6.853 13.680 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -1.063 6.149 13.180 1.00 0.00 H new ATOM 0 HG23 ILE B 3 0.397 5.863 12.204 1.00 0.00 H new ATOM 0 HD11 ILE B 3 2.745 8.115 10.595 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.125 6.774 11.587 1.00 0.00 H new ATOM 0 HD13 ILE B 3 1.390 7.123 10.004 1.00 0.00 H new ATOM 1040 N LEU B 4 -2.896 5.667 10.607 1.00 0.00 N ATOM 1041 CA LEU B 4 -4.070 4.875 10.953 1.00 0.00 C ATOM 1042 C LEU B 4 -3.681 3.429 11.243 1.00 0.00 C ATOM 1043 O LEU B 4 -3.165 2.737 10.366 1.00 0.00 O ATOM 1044 CB LEU B 4 -5.097 4.915 9.815 1.00 0.00 C ATOM 1045 CG LEU B 4 -5.902 6.214 9.690 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -6.340 6.719 11.057 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -5.092 7.275 8.960 1.00 0.00 C ATOM 0 H LEU B 4 -2.352 5.291 9.831 1.00 0.00 H new ATOM 0 HA LEU B 4 -4.514 5.306 11.850 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -4.576 4.740 8.874 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -5.795 4.089 9.951 1.00 0.00 H new ATOM 0 HG LEU B 4 -6.799 6.002 9.107 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -6.909 7.641 10.939 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -6.964 5.967 11.540 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -5.461 6.911 11.673 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -5.679 8.190 8.880 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -4.176 7.479 9.514 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -4.840 6.918 7.962 1.00 0.00 H new ATOM 1059 N THR B 5 -3.930 2.966 12.464 1.00 0.00 N ATOM 1060 CA THR B 5 -3.599 1.590 12.827 1.00 0.00 C ATOM 1061 C THR B 5 -4.266 0.613 11.867 1.00 0.00 C ATOM 1062 O THR B 5 -5.415 0.808 11.469 1.00 0.00 O ATOM 1063 CB THR B 5 -4.023 1.285 14.264 1.00 0.00 C ATOM 1064 OG1 THR B 5 -4.535 2.445 14.898 1.00 0.00 O ATOM 1065 CG2 THR B 5 -2.888 0.758 15.113 1.00 0.00 C ATOM 0 H THR B 5 -4.355 3.515 13.212 1.00 0.00 H new ATOM 0 HA THR B 5 -2.517 1.474 12.757 1.00 0.00 H new ATOM 0 HB THR B 5 -4.790 0.515 14.185 1.00 0.00 H new ATOM 0 HG1 THR B 5 -4.801 2.226 15.815 1.00 0.00 H new ATOM 0 HG21 THR B 5 -3.250 0.560 16.122 1.00 0.00 H new ATOM 0 HG22 THR B 5 -2.506 -0.165 14.677 1.00 0.00 H new ATOM 0 HG23 THR B 5 -2.089 1.499 15.153 1.00 0.00 H new ATOM 1073 N ARG B 6 -3.541 -0.433 11.493 1.00 0.00 N ATOM 1074 CA ARG B 6 -4.070 -1.431 10.572 1.00 0.00 C ATOM 1075 C ARG B 6 -3.444 -2.800 10.812 1.00 0.00 C ATOM 1076 O ARG B 6 -2.281 -2.907 11.208 1.00 0.00 O ATOM 1077 CB ARG B 6 -3.827 -1.013 9.119 1.00 0.00 C ATOM 1078 CG ARG B 6 -4.409 0.343 8.749 1.00 0.00 C ATOM 1079 CD ARG B 6 -3.748 0.908 7.501 1.00 0.00 C ATOM 1080 NE ARG B 6 -4.698 1.082 6.406 1.00 0.00 N ATOM 1081 CZ ARG B 6 -4.386 1.634 5.235 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -3.150 2.059 5.002 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -5.311 1.759 4.294 1.00 0.00 N ATOM 0 H ARG B 6 -2.589 -0.612 11.811 1.00 0.00 H new ATOM 0 HA ARG B 6 -5.142 -1.500 10.755 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -2.753 -0.997 8.933 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -4.253 -1.770 8.460 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -5.482 0.247 8.583 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -4.276 1.037 9.579 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -3.289 1.868 7.738 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -2.947 0.241 7.182 1.00 0.00 H new ATOM 0 HE ARG B 6 -5.656 0.762 6.546 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -2.434 1.963 5.722 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -2.917 2.481 4.103 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -6.262 1.432 4.467 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -5.072 2.182 3.397 1.00 0.00 H new ATOM 1097 N ARG B 7 -4.231 -3.841 10.555 1.00 0.00 N ATOM 1098 CA ARG B 7 -3.779 -5.219 10.717 1.00 0.00 C ATOM 1099 C ARG B 7 -4.923 -6.195 10.447 1.00 0.00 C ATOM 1100 O ARG B 7 -5.011 -6.772 9.364 1.00 0.00 O ATOM 1101 CB ARG B 7 -3.206 -5.447 12.119 1.00 0.00 C ATOM 1102 CG ARG B 7 -2.746 -6.877 12.360 1.00 0.00 C ATOM 1103 CD ARG B 7 -2.706 -7.209 13.843 1.00 0.00 C ATOM 1104 NE ARG B 7 -1.462 -7.874 14.220 1.00 0.00 N ATOM 1105 CZ ARG B 7 -1.295 -8.548 15.356 1.00 0.00 C ATOM 1106 NH1 ARG B 7 -2.291 -8.652 16.226 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -0.128 -9.120 15.622 1.00 0.00 N ATOM 0 H ARG B 7 -5.194 -3.754 10.231 1.00 0.00 H new ATOM 0 HA ARG B 7 -2.987 -5.400 9.991 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -2.364 -4.772 12.273 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -3.963 -5.187 12.859 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -3.418 -7.567 11.850 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -1.755 -7.019 11.928 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -2.818 -6.293 14.423 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -3.551 -7.850 14.094 1.00 0.00 H new ATOM 0 HE ARG B 7 -0.674 -7.819 13.575 1.00 0.00 H new ATOM 0 HH11 ARG B 7 -3.190 -8.214 16.026 1.00 0.00 H new ATOM 0 HH12 ARG B 7 -2.157 -9.170 17.095 1.00 0.00 H new ATOM 0 HH21 ARG B 7 0.641 -9.043 14.956 1.00 0.00 H new ATOM 0 HH22 ARG B 7 0.000 -9.636 16.492 1.00 0.00 H new ATOM 1121 N VAL B 8 -5.789 -6.379 11.446 1.00 0.00 N ATOM 1122 CA VAL B 8 -6.932 -7.292 11.341 1.00 0.00 C ATOM 1123 C VAL B 8 -7.493 -7.360 9.920 1.00 0.00 C ATOM 1124 O VAL B 8 -7.375 -8.385 9.248 1.00 0.00 O ATOM 1125 CB VAL B 8 -8.064 -6.881 12.303 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -9.171 -7.925 12.308 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -7.521 -6.666 13.707 1.00 0.00 C ATOM 0 H VAL B 8 -5.720 -5.903 12.346 1.00 0.00 H new ATOM 0 HA VAL B 8 -6.556 -8.278 11.614 1.00 0.00 H new ATOM 0 HB VAL B 8 -8.486 -5.939 11.952 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -9.960 -7.615 12.993 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -9.582 -8.025 11.303 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -8.765 -8.884 12.631 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -8.335 -6.376 14.372 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -7.069 -7.590 14.068 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -6.769 -5.877 13.689 1.00 0.00 H new ATOM 1137 N GLY B 9 -8.105 -6.270 9.467 1.00 0.00 N ATOM 1138 CA GLY B 9 -8.671 -6.247 8.130 1.00 0.00 C ATOM 1139 C GLY B 9 -8.821 -4.844 7.574 1.00 0.00 C ATOM 1140 O GLY B 9 -9.669 -4.076 8.027 1.00 0.00 O ATOM 0 H GLY B 9 -8.219 -5.407 9.998 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -8.037 -6.830 7.463 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -9.647 -6.732 8.146 1.00 0.00 H new ATOM 1144 N GLU B 10 -8.000 -4.514 6.582 1.00 0.00 N ATOM 1145 CA GLU B 10 -8.047 -3.199 5.951 1.00 0.00 C ATOM 1146 C GLU B 10 -8.517 -3.316 4.505 1.00 0.00 C ATOM 1147 O GLU B 10 -8.900 -4.397 4.057 1.00 0.00 O ATOM 1148 CB GLU B 10 -6.670 -2.536 6.000 1.00 0.00 C ATOM 1149 CG GLU B 10 -6.470 -1.632 7.205 1.00 0.00 C ATOM 1150 CD GLU B 10 -7.567 -0.595 7.348 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -7.484 0.454 6.676 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -8.510 -0.833 8.132 1.00 0.00 O ATOM 0 H GLU B 10 -7.293 -5.140 6.197 1.00 0.00 H new ATOM 0 HA GLU B 10 -8.757 -2.581 6.501 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -5.903 -3.311 6.007 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -6.525 -1.952 5.091 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -6.431 -2.241 8.108 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -5.508 -1.127 7.120 1.00 0.00 H new ATOM 1159 N THR B 11 -8.478 -2.202 3.775 1.00 0.00 N ATOM 1160 CA THR B 11 -8.896 -2.190 2.374 1.00 0.00 C ATOM 1161 C THR B 11 -9.019 -0.765 1.841 1.00 0.00 C ATOM 1162 O THR B 11 -10.091 -0.162 1.903 1.00 0.00 O ATOM 1163 CB THR B 11 -10.233 -2.919 2.200 1.00 0.00 C ATOM 1164 OG1 THR B 11 -10.820 -2.603 0.950 1.00 0.00 O ATOM 1165 CG2 THR B 11 -11.242 -2.584 3.278 1.00 0.00 C ATOM 0 H THR B 11 -8.162 -1.299 4.129 1.00 0.00 H new ATOM 0 HA THR B 11 -8.127 -2.709 1.802 1.00 0.00 H new ATOM 0 HB THR B 11 -9.993 -3.980 2.266 1.00 0.00 H new ATOM 0 HG1 THR B 11 -11.671 -3.080 0.859 1.00 0.00 H new ATOM 0 HG21 THR B 11 -12.166 -3.133 3.095 1.00 0.00 H new ATOM 0 HG22 THR B 11 -10.840 -2.863 4.252 1.00 0.00 H new ATOM 0 HG23 THR B 11 -11.448 -1.514 3.264 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.925 -0.239 1.299 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.928 1.109 0.735 1.00 0.00 C ATOM 1175 C LEU B 12 -7.729 1.041 -0.775 1.00 0.00 C ATOM 1176 O LEU B 12 -7.146 0.085 -1.286 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.839 1.978 1.383 1.00 0.00 C ATOM 1178 CG LEU B 12 -5.446 1.875 0.753 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -4.627 3.124 1.042 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.732 0.635 1.258 1.00 0.00 C ATOM 0 H LEU B 12 -7.029 -0.722 1.238 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.893 1.570 0.945 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -7.159 3.019 1.344 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.763 1.707 2.436 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.562 1.793 -0.328 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.642 3.027 0.585 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -5.135 3.996 0.629 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.516 3.245 2.120 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.744 0.574 0.803 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.630 0.690 2.342 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -5.309 -0.251 0.993 1.00 0.00 H new ATOM 1192 N MET B 13 -8.213 2.050 -1.490 1.00 0.00 N ATOM 1193 CA MET B 13 -8.073 2.075 -2.939 1.00 0.00 C ATOM 1194 C MET B 13 -7.531 3.411 -3.421 1.00 0.00 C ATOM 1195 O MET B 13 -8.263 4.394 -3.532 1.00 0.00 O ATOM 1196 CB MET B 13 -9.415 1.774 -3.610 1.00 0.00 C ATOM 1197 CG MET B 13 -9.351 1.772 -5.128 1.00 0.00 C ATOM 1198 SD MET B 13 -10.916 1.303 -5.891 1.00 0.00 S ATOM 1199 CE MET B 13 -10.953 2.413 -7.296 1.00 0.00 C ATOM 0 H MET B 13 -8.701 2.853 -1.094 1.00 0.00 H new ATOM 0 HA MET B 13 -7.356 1.302 -3.218 1.00 0.00 H new ATOM 0 HB2 MET B 13 -9.772 0.802 -3.269 1.00 0.00 H new ATOM 0 HB3 MET B 13 -10.147 2.514 -3.287 1.00 0.00 H new ATOM 0 HG2 MET B 13 -9.065 2.764 -5.477 1.00 0.00 H new ATOM 0 HG3 MET B 13 -8.572 1.083 -5.454 1.00 0.00 H new ATOM 0 HE1 MET B 13 -11.574 1.984 -8.083 1.00 0.00 H new ATOM 0 HE2 MET B 13 -11.368 3.373 -6.990 1.00 0.00 H new ATOM 0 HE3 MET B 13 -9.940 2.558 -7.672 1.00 0.00 H new ATOM 1209 N ILE B 14 -6.238 3.429 -3.715 1.00 0.00 N ATOM 1210 CA ILE B 14 -5.573 4.625 -4.195 1.00 0.00 C ATOM 1211 C ILE B 14 -5.148 4.448 -5.653 1.00 0.00 C ATOM 1212 O ILE B 14 -4.480 3.475 -6.000 1.00 0.00 O ATOM 1213 CB ILE B 14 -4.343 4.958 -3.321 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -3.519 6.092 -3.938 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -3.483 3.718 -3.113 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -4.329 7.331 -4.248 1.00 0.00 C ATOM 0 H ILE B 14 -5.626 2.618 -3.627 1.00 0.00 H new ATOM 0 HA ILE B 14 -6.277 5.454 -4.130 1.00 0.00 H new ATOM 0 HB ILE B 14 -4.701 5.296 -2.349 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -2.713 6.357 -3.254 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -3.054 5.733 -4.856 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.622 3.972 -2.495 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -4.071 2.947 -2.616 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -3.140 3.347 -4.079 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -3.680 8.091 -4.682 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -5.119 7.081 -4.956 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -4.773 7.715 -3.329 1.00 0.00 H new ATOM 1228 N GLY B 15 -5.548 5.390 -6.502 1.00 0.00 N ATOM 1229 CA GLY B 15 -5.209 5.315 -7.914 1.00 0.00 C ATOM 1230 C GLY B 15 -6.434 5.457 -8.799 1.00 0.00 C ATOM 1231 O GLY B 15 -6.964 6.556 -8.964 1.00 0.00 O ATOM 0 H GLY B 15 -6.101 6.205 -6.238 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -4.493 6.100 -8.157 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -4.721 4.362 -8.120 1.00 0.00 H new ATOM 1235 N ASP B 16 -6.888 4.342 -9.364 1.00 0.00 N ATOM 1236 CA ASP B 16 -8.065 4.351 -10.230 1.00 0.00 C ATOM 1237 C ASP B 16 -8.654 2.948 -10.410 1.00 0.00 C ATOM 1238 O ASP B 16 -9.546 2.749 -11.235 1.00 0.00 O ATOM 1239 CB ASP B 16 -7.712 4.944 -11.596 1.00 0.00 C ATOM 1240 CG ASP B 16 -6.695 4.106 -12.347 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -6.990 2.925 -12.626 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -5.605 4.631 -12.655 1.00 0.00 O ATOM 0 H ASP B 16 -6.462 3.424 -9.239 1.00 0.00 H new ATOM 0 HA ASP B 16 -8.820 4.970 -9.746 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -8.618 5.033 -12.195 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -7.319 5.952 -11.461 1.00 0.00 H new ATOM 1247 N GLU B 17 -8.156 1.980 -9.636 1.00 0.00 N ATOM 1248 CA GLU B 17 -8.636 0.599 -9.712 1.00 0.00 C ATOM 1249 C GLU B 17 -7.663 -0.340 -9.000 1.00 0.00 C ATOM 1250 O GLU B 17 -7.205 -1.330 -9.570 1.00 0.00 O ATOM 1251 CB GLU B 17 -8.813 0.163 -11.174 1.00 0.00 C ATOM 1252 CG GLU B 17 -10.265 -0.053 -11.571 1.00 0.00 C ATOM 1253 CD GLU B 17 -10.406 -0.709 -12.930 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -9.413 -1.294 -13.414 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -11.509 -0.638 -13.512 1.00 0.00 O ATOM 0 H GLU B 17 -7.418 2.129 -8.948 1.00 0.00 H new ATOM 0 HA GLU B 17 -9.605 0.548 -9.216 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -8.375 0.919 -11.826 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -8.258 -0.761 -11.339 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -10.755 -0.673 -10.820 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -10.782 0.906 -11.579 1.00 0.00 H new ATOM 1262 N VAL B 18 -7.346 -0.020 -7.750 1.00 0.00 N ATOM 1263 CA VAL B 18 -6.429 -0.823 -6.967 1.00 0.00 C ATOM 1264 C VAL B 18 -7.135 -1.457 -5.765 1.00 0.00 C ATOM 1265 O VAL B 18 -8.358 -1.601 -5.760 1.00 0.00 O ATOM 1266 CB VAL B 18 -5.243 0.035 -6.490 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -4.586 0.739 -7.668 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -5.685 1.042 -5.438 1.00 0.00 C ATOM 0 H VAL B 18 -7.715 0.795 -7.260 1.00 0.00 H new ATOM 0 HA VAL B 18 -6.057 -1.625 -7.604 1.00 0.00 H new ATOM 0 HB VAL B 18 -4.509 -0.627 -6.031 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -3.750 1.341 -7.312 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -4.222 -0.003 -8.379 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -5.315 1.384 -8.159 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -4.828 1.635 -5.119 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -6.444 1.700 -5.861 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -6.100 0.513 -4.580 1.00 0.00 H new ATOM 1278 N THR B 19 -6.357 -1.828 -4.748 1.00 0.00 N ATOM 1279 CA THR B 19 -6.895 -2.441 -3.537 1.00 0.00 C ATOM 1280 C THR B 19 -5.762 -3.038 -2.712 1.00 0.00 C ATOM 1281 O THR B 19 -5.195 -4.065 -3.076 1.00 0.00 O ATOM 1282 CB THR B 19 -7.925 -3.524 -3.880 1.00 0.00 C ATOM 1283 OG1 THR B 19 -8.112 -4.407 -2.788 1.00 0.00 O ATOM 1284 CG2 THR B 19 -7.543 -4.357 -5.085 1.00 0.00 C ATOM 0 H THR B 19 -5.344 -1.713 -4.741 1.00 0.00 H new ATOM 0 HA THR B 19 -7.397 -1.668 -2.954 1.00 0.00 H new ATOM 0 HB THR B 19 -8.843 -2.983 -4.110 1.00 0.00 H new ATOM 0 HG1 THR B 19 -8.774 -5.089 -3.028 1.00 0.00 H new ATOM 0 HG21 THR B 19 -8.315 -5.103 -5.271 1.00 0.00 H new ATOM 0 HG22 THR B 19 -7.445 -3.711 -5.957 1.00 0.00 H new ATOM 0 HG23 THR B 19 -6.593 -4.857 -4.895 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.428 -2.391 -1.603 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.352 -2.872 -0.744 1.00 0.00 C ATOM 1294 C VAL B 20 -4.876 -3.241 0.643 1.00 0.00 C ATOM 1295 O VAL B 20 -5.340 -2.378 1.392 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.230 -1.822 -0.591 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -1.953 -2.469 -0.080 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -2.977 -1.099 -1.906 1.00 0.00 C ATOM 0 H VAL B 20 -5.882 -1.538 -1.278 1.00 0.00 H new ATOM 0 HA VAL B 20 -3.943 -3.759 -1.227 1.00 0.00 H new ATOM 0 HB VAL B 20 -3.557 -1.085 0.142 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.176 -1.711 0.020 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.141 -2.927 0.891 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -1.625 -3.233 -0.785 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -2.182 -0.365 -1.771 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -2.679 -1.821 -2.666 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -3.888 -0.593 -2.224 1.00 0.00 H new ATOM 1308 N THR B 21 -4.806 -4.529 0.971 1.00 0.00 N ATOM 1309 CA THR B 21 -5.275 -5.021 2.264 1.00 0.00 C ATOM 1310 C THR B 21 -4.102 -5.472 3.132 1.00 0.00 C ATOM 1311 O THR B 21 -3.386 -6.411 2.786 1.00 0.00 O ATOM 1312 CB THR B 21 -6.253 -6.179 2.065 1.00 0.00 C ATOM 1313 OG1 THR B 21 -7.159 -5.896 1.014 1.00 0.00 O ATOM 1314 CG2 THR B 21 -7.067 -6.495 3.301 1.00 0.00 C ATOM 0 H THR B 21 -4.428 -5.252 0.358 1.00 0.00 H new ATOM 0 HA THR B 21 -5.787 -4.205 2.774 1.00 0.00 H new ATOM 0 HB THR B 21 -5.632 -7.043 1.829 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.775 -6.650 0.901 1.00 0.00 H new ATOM 0 HG21 THR B 21 -7.740 -7.326 3.091 1.00 0.00 H new ATOM 0 HG22 THR B 21 -6.398 -6.768 4.117 1.00 0.00 H new ATOM 0 HG23 THR B 21 -7.650 -5.619 3.587 1.00 0.00 H new ATOM 1322 N VAL B 22 -3.909 -4.794 4.259 1.00 0.00 N ATOM 1323 CA VAL B 22 -2.818 -5.121 5.172 1.00 0.00 C ATOM 1324 C VAL B 22 -3.173 -6.304 6.072 1.00 0.00 C ATOM 1325 O VAL B 22 -3.387 -6.144 7.274 1.00 0.00 O ATOM 1326 CB VAL B 22 -2.443 -3.908 6.048 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -1.974 -2.746 5.183 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -3.618 -3.491 6.921 1.00 0.00 C ATOM 0 H VAL B 22 -4.493 -4.015 4.562 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.962 -5.395 4.555 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.621 -4.199 6.702 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -1.714 -1.900 5.820 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -1.099 -3.050 4.609 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -2.773 -2.455 4.501 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.332 -2.634 7.531 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -4.463 -3.220 6.288 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -3.901 -4.320 7.570 1.00 0.00 H new ATOM 1338 N LEU B 23 -3.229 -7.496 5.486 1.00 0.00 N ATOM 1339 CA LEU B 23 -3.554 -8.701 6.241 1.00 0.00 C ATOM 1340 C LEU B 23 -2.282 -9.334 6.820 1.00 0.00 C ATOM 1341 O LEU B 23 -1.351 -8.621 7.194 1.00 0.00 O ATOM 1342 CB LEU B 23 -4.306 -9.694 5.343 1.00 0.00 C ATOM 1343 CG LEU B 23 -5.223 -10.706 6.059 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -5.266 -10.468 7.567 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -6.629 -10.652 5.478 1.00 0.00 C ATOM 0 H LEU B 23 -3.054 -7.653 4.493 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.201 -8.433 7.076 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -4.910 -9.126 4.636 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -3.572 -10.251 4.760 1.00 0.00 H new ATOM 0 HG LEU B 23 -4.805 -11.699 5.893 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -5.923 -11.202 8.033 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -4.262 -10.566 7.980 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -5.644 -9.465 7.766 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -7.264 -11.372 5.994 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -7.038 -9.650 5.607 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -6.593 -10.895 4.416 1.00 0.00 H new ATOM 1357 N GLY B 24 -2.242 -10.667 6.900 1.00 0.00 N ATOM 1358 CA GLY B 24 -1.076 -11.340 7.442 1.00 0.00 C ATOM 1359 C GLY B 24 -0.743 -10.876 8.845 1.00 0.00 C ATOM 1360 O GLY B 24 0.147 -10.048 9.036 1.00 0.00 O ATOM 0 H GLY B 24 -2.995 -11.286 6.600 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -1.251 -12.416 7.450 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -0.221 -11.161 6.790 1.00 0.00 H new ATOM 1364 N VAL B 25 -1.467 -11.401 9.828 1.00 0.00 N ATOM 1365 CA VAL B 25 -1.249 -11.023 11.213 1.00 0.00 C ATOM 1366 C VAL B 25 -0.149 -11.860 11.858 1.00 0.00 C ATOM 1367 O VAL B 25 -0.336 -13.044 12.138 1.00 0.00 O ATOM 1368 CB VAL B 25 -2.539 -11.174 12.041 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -2.360 -10.581 13.430 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -3.715 -10.528 11.322 1.00 0.00 C ATOM 0 H VAL B 25 -2.208 -12.088 9.688 1.00 0.00 H new ATOM 0 HA VAL B 25 -0.942 -9.977 11.205 1.00 0.00 H new ATOM 0 HB VAL B 25 -2.752 -12.237 12.154 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -3.283 -10.699 13.998 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -1.550 -11.097 13.944 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -2.119 -9.521 13.345 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -4.617 -10.645 11.922 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -3.513 -9.467 11.174 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -3.858 -11.009 10.354 1.00 0.00 H new ATOM 1380 N LYS B 26 1.001 -11.234 12.088 1.00 0.00 N ATOM 1381 CA LYS B 26 2.136 -11.917 12.698 1.00 0.00 C ATOM 1382 C LYS B 26 2.921 -10.972 13.603 1.00 0.00 C ATOM 1383 O LYS B 26 2.882 -9.753 13.429 1.00 0.00 O ATOM 1384 CB LYS B 26 3.054 -12.491 11.615 1.00 0.00 C ATOM 1385 CG LYS B 26 3.066 -14.010 11.573 1.00 0.00 C ATOM 1386 CD LYS B 26 4.434 -14.546 11.183 1.00 0.00 C ATOM 1387 CE LYS B 26 5.235 -14.968 12.403 1.00 0.00 C ATOM 1388 NZ LYS B 26 6.625 -15.366 12.045 1.00 0.00 N ATOM 0 H LYS B 26 1.171 -10.254 11.861 1.00 0.00 H new ATOM 0 HA LYS B 26 1.751 -12.734 13.308 1.00 0.00 H new ATOM 0 HB2 LYS B 26 2.738 -12.111 10.643 1.00 0.00 H new ATOM 0 HB3 LYS B 26 4.069 -12.132 11.783 1.00 0.00 H new ATOM 0 HG2 LYS B 26 2.785 -14.404 12.549 1.00 0.00 H new ATOM 0 HG3 LYS B 26 2.320 -14.361 10.860 1.00 0.00 H new ATOM 0 HD2 LYS B 26 4.315 -15.397 10.512 1.00 0.00 H new ATOM 0 HD3 LYS B 26 4.982 -13.781 10.633 1.00 0.00 H new ATOM 0 HE2 LYS B 26 5.266 -14.147 13.119 1.00 0.00 H new ATOM 0 HE3 LYS B 26 4.734 -15.802 12.895 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 7.138 -15.647 12.905 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 6.597 -16.166 11.382 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 7.112 -14.563 11.598 1.00 0.00 H new ATOM 1402 N GLY B 27 3.631 -11.543 14.571 1.00 0.00 N ATOM 1403 CA GLY B 27 4.414 -10.740 15.491 1.00 0.00 C ATOM 1404 C GLY B 27 5.629 -10.118 14.831 1.00 0.00 C ATOM 1405 O GLY B 27 6.131 -10.630 13.831 1.00 0.00 O ATOM 0 H GLY B 27 3.678 -12.549 14.734 1.00 0.00 H new ATOM 0 HA2 GLY B 27 3.786 -9.951 15.905 1.00 0.00 H new ATOM 0 HA3 GLY B 27 4.737 -11.361 16.326 1.00 0.00 H new ATOM 1409 N ASN B 28 6.098 -9.007 15.391 1.00 0.00 N ATOM 1410 CA ASN B 28 7.258 -8.303 14.854 1.00 0.00 C ATOM 1411 C ASN B 28 6.934 -7.691 13.491 1.00 0.00 C ATOM 1412 O ASN B 28 6.508 -6.540 13.409 1.00 0.00 O ATOM 1413 CB ASN B 28 8.461 -9.247 14.748 1.00 0.00 C ATOM 1414 CG ASN B 28 9.454 -9.047 15.875 1.00 0.00 C ATOM 1415 OD1 ASN B 28 9.487 -7.992 16.509 1.00 0.00 O ATOM 1416 ND2 ASN B 28 10.272 -10.062 16.131 1.00 0.00 N ATOM 0 H ASN B 28 5.691 -8.573 16.220 1.00 0.00 H new ATOM 0 HA ASN B 28 7.515 -7.496 15.540 1.00 0.00 H new ATOM 0 HB2 ASN B 28 8.111 -10.279 14.755 1.00 0.00 H new ATOM 0 HB3 ASN B 28 8.962 -9.087 13.793 1.00 0.00 H new ATOM 0 HD21 ASN B 28 10.962 -9.985 16.878 1.00 0.00 H new ATOM 0 HD22 ASN B 28 10.210 -10.918 15.580 1.00 0.00 H new ATOM 1423 N GLN B 29 7.131 -8.462 12.424 1.00 0.00 N ATOM 1424 CA GLN B 29 6.850 -7.982 11.076 1.00 0.00 C ATOM 1425 C GLN B 29 5.558 -8.594 10.546 1.00 0.00 C ATOM 1426 O GLN B 29 5.392 -9.814 10.546 1.00 0.00 O ATOM 1427 CB GLN B 29 8.012 -8.319 10.140 1.00 0.00 C ATOM 1428 CG GLN B 29 9.301 -7.591 10.485 1.00 0.00 C ATOM 1429 CD GLN B 29 10.533 -8.309 9.970 1.00 0.00 C ATOM 1430 OE1 GLN B 29 10.877 -9.394 10.441 1.00 0.00 O ATOM 1431 NE2 GLN B 29 11.206 -7.706 8.996 1.00 0.00 N ATOM 0 H GLN B 29 7.483 -9.418 12.468 1.00 0.00 H new ATOM 0 HA GLN B 29 6.730 -6.899 11.116 1.00 0.00 H new ATOM 0 HB2 GLN B 29 8.192 -9.394 10.170 1.00 0.00 H new ATOM 0 HB3 GLN B 29 7.727 -8.072 9.117 1.00 0.00 H new ATOM 0 HG2 GLN B 29 9.269 -6.585 10.065 1.00 0.00 H new ATOM 0 HG3 GLN B 29 9.374 -7.483 11.567 1.00 0.00 H new ATOM 0 HE21 GLN B 29 10.886 -6.807 8.635 1.00 0.00 H new ATOM 0 HE22 GLN B 29 12.043 -8.142 8.609 1.00 0.00 H new ATOM 1440 N VAL B 30 4.636 -7.740 10.115 1.00 0.00 N ATOM 1441 CA VAL B 30 3.349 -8.202 9.607 1.00 0.00 C ATOM 1442 C VAL B 30 3.375 -8.378 8.094 1.00 0.00 C ATOM 1443 O VAL B 30 3.897 -7.532 7.367 1.00 0.00 O ATOM 1444 CB VAL B 30 2.213 -7.229 9.980 1.00 0.00 C ATOM 1445 CG1 VAL B 30 1.845 -7.376 11.448 1.00 0.00 C ATOM 1446 CG2 VAL B 30 2.609 -5.795 9.663 1.00 0.00 C ATOM 0 H VAL B 30 4.755 -6.727 10.107 1.00 0.00 H new ATOM 0 HA VAL B 30 3.160 -9.168 10.075 1.00 0.00 H new ATOM 0 HB VAL B 30 1.336 -7.478 9.382 1.00 0.00 H new ATOM 0 HG11 VAL B 30 1.042 -6.681 11.693 1.00 0.00 H new ATOM 0 HG12 VAL B 30 1.513 -8.397 11.640 1.00 0.00 H new ATOM 0 HG13 VAL B 30 2.716 -7.156 12.065 1.00 0.00 H new ATOM 0 HG21 VAL B 30 1.794 -5.124 9.934 1.00 0.00 H new ATOM 0 HG22 VAL B 30 3.501 -5.530 10.231 1.00 0.00 H new ATOM 0 HG23 VAL B 30 2.817 -5.702 8.597 1.00 0.00 H new ATOM 1456 N ARG B 31 2.796 -9.480 7.625 1.00 0.00 N ATOM 1457 CA ARG B 31 2.736 -9.769 6.207 1.00 0.00 C ATOM 1458 C ARG B 31 1.614 -8.970 5.557 1.00 0.00 C ATOM 1459 O ARG B 31 0.441 -9.325 5.669 1.00 0.00 O ATOM 1460 CB ARG B 31 2.528 -11.267 5.965 1.00 0.00 C ATOM 1461 CG ARG B 31 3.183 -12.157 7.010 1.00 0.00 C ATOM 1462 CD ARG B 31 3.632 -13.480 6.412 1.00 0.00 C ATOM 1463 NE ARG B 31 3.572 -14.569 7.384 1.00 0.00 N ATOM 1464 CZ ARG B 31 4.116 -15.768 7.188 1.00 0.00 C ATOM 1465 NH1 ARG B 31 4.762 -16.036 6.060 1.00 0.00 N ATOM 1466 NH2 ARG B 31 4.014 -16.703 8.124 1.00 0.00 N ATOM 0 H ARG B 31 2.361 -10.188 8.216 1.00 0.00 H new ATOM 0 HA ARG B 31 3.685 -9.479 5.757 1.00 0.00 H new ATOM 0 HB2 ARG B 31 1.459 -11.476 5.943 1.00 0.00 H new ATOM 0 HB3 ARG B 31 2.924 -11.525 4.983 1.00 0.00 H new ATOM 0 HG2 ARG B 31 4.041 -11.642 7.442 1.00 0.00 H new ATOM 0 HG3 ARG B 31 2.481 -12.343 7.823 1.00 0.00 H new ATOM 0 HD2 ARG B 31 3.002 -13.723 5.556 1.00 0.00 H new ATOM 0 HD3 ARG B 31 4.652 -13.382 6.040 1.00 0.00 H new ATOM 0 HE ARG B 31 3.085 -14.401 8.264 1.00 0.00 H new ATOM 0 HH11 ARG B 31 4.844 -15.321 5.337 1.00 0.00 H new ATOM 0 HH12 ARG B 31 5.177 -16.957 5.916 1.00 0.00 H new ATOM 0 HH21 ARG B 31 3.519 -16.503 8.993 1.00 0.00 H new ATOM 0 HH22 ARG B 31 4.431 -17.622 7.974 1.00 0.00 H new ATOM 1480 N ILE B 32 1.978 -7.878 4.898 1.00 0.00 N ATOM 1481 CA ILE B 32 0.998 -7.013 4.254 1.00 0.00 C ATOM 1482 C ILE B 32 0.685 -7.475 2.836 1.00 0.00 C ATOM 1483 O ILE B 32 1.586 -7.778 2.056 1.00 0.00 O ATOM 1484 CB ILE B 32 1.495 -5.556 4.213 1.00 0.00 C ATOM 1485 CG1 ILE B 32 2.033 -5.141 5.586 1.00 0.00 C ATOM 1486 CG2 ILE B 32 0.376 -4.626 3.769 1.00 0.00 C ATOM 1487 CD1 ILE B 32 0.971 -5.088 6.662 1.00 0.00 C ATOM 0 H ILE B 32 2.945 -7.570 4.795 1.00 0.00 H new ATOM 0 HA ILE B 32 0.086 -7.070 4.849 1.00 0.00 H new ATOM 0 HB ILE B 32 2.306 -5.483 3.489 1.00 0.00 H new ATOM 0 HG12 ILE B 32 2.811 -5.842 5.889 1.00 0.00 H new ATOM 0 HG13 ILE B 32 2.502 -4.161 5.502 1.00 0.00 H new ATOM 0 HG21 ILE B 32 0.743 -3.600 3.745 1.00 0.00 H new ATOM 0 HG22 ILE B 32 0.038 -4.913 2.774 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -0.456 -4.697 4.470 1.00 0.00 H new ATOM 0 HD11 ILE B 32 1.425 -4.787 7.606 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.204 -4.366 6.381 1.00 0.00 H new ATOM 0 HD13 ILE B 32 0.518 -6.073 6.775 1.00 0.00 H new ATOM 1499 N GLY B 33 -0.604 -7.521 2.509 1.00 0.00 N ATOM 1500 CA GLY B 33 -1.022 -7.942 1.186 1.00 0.00 C ATOM 1501 C GLY B 33 -1.401 -6.771 0.303 1.00 0.00 C ATOM 1502 O GLY B 33 -2.323 -6.020 0.620 1.00 0.00 O ATOM 0 H GLY B 33 -1.367 -7.273 3.139 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.216 -8.504 0.714 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -1.873 -8.618 1.274 1.00 0.00 H new ATOM 1506 N VAL B 34 -0.687 -6.608 -0.804 1.00 0.00 N ATOM 1507 CA VAL B 34 -0.957 -5.513 -1.725 1.00 0.00 C ATOM 1508 C VAL B 34 -1.569 -6.015 -3.028 1.00 0.00 C ATOM 1509 O VAL B 34 -1.041 -6.927 -3.665 1.00 0.00 O ATOM 1510 CB VAL B 34 0.327 -4.725 -2.050 1.00 0.00 C ATOM 1511 CG1 VAL B 34 0.004 -3.485 -2.871 1.00 0.00 C ATOM 1512 CG2 VAL B 34 1.061 -4.351 -0.771 1.00 0.00 C ATOM 0 H VAL B 34 0.081 -7.218 -1.084 1.00 0.00 H new ATOM 0 HA VAL B 34 -1.669 -4.856 -1.226 1.00 0.00 H new ATOM 0 HB VAL B 34 0.981 -5.363 -2.645 1.00 0.00 H new ATOM 0 HG11 VAL B 34 0.924 -2.943 -3.089 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -0.473 -3.781 -3.805 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -0.671 -2.841 -2.307 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.965 -3.795 -1.020 1.00 0.00 H new ATOM 0 HG22 VAL B 34 0.415 -3.733 -0.148 1.00 0.00 H new ATOM 0 HG23 VAL B 34 1.330 -5.257 -0.228 1.00 0.00 H new ATOM 1522 N ASN B 35 -2.675 -5.396 -3.427 1.00 0.00 N ATOM 1523 CA ASN B 35 -3.349 -5.760 -4.666 1.00 0.00 C ATOM 1524 C ASN B 35 -3.478 -4.542 -5.574 1.00 0.00 C ATOM 1525 O ASN B 35 -4.272 -3.636 -5.314 1.00 0.00 O ATOM 1526 CB ASN B 35 -4.728 -6.359 -4.379 1.00 0.00 C ATOM 1527 CG ASN B 35 -5.010 -7.589 -5.218 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -4.268 -8.570 -5.173 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -6.089 -7.543 -5.992 1.00 0.00 N ATOM 0 H ASN B 35 -3.123 -4.640 -2.910 1.00 0.00 H new ATOM 0 HA ASN B 35 -2.749 -6.515 -5.174 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -4.795 -6.620 -3.323 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -5.494 -5.608 -4.571 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -6.330 -8.341 -6.580 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -6.677 -6.709 -5.999 1.00 0.00 H new ATOM 1536 N ALA B 36 -2.684 -4.526 -6.635 1.00 0.00 N ATOM 1537 CA ALA B 36 -2.696 -3.417 -7.583 1.00 0.00 C ATOM 1538 C ALA B 36 -2.569 -3.907 -9.024 1.00 0.00 C ATOM 1539 O ALA B 36 -1.896 -4.901 -9.295 1.00 0.00 O ATOM 1540 CB ALA B 36 -1.578 -2.438 -7.259 1.00 0.00 C ATOM 0 H ALA B 36 -2.022 -5.268 -6.863 1.00 0.00 H new ATOM 0 HA ALA B 36 -3.656 -2.909 -7.489 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -1.597 -1.615 -7.973 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -1.717 -2.047 -6.251 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -0.617 -2.949 -7.320 1.00 0.00 H new ATOM 1546 N PRO B 37 -3.216 -3.203 -9.970 1.00 0.00 N ATOM 1547 CA PRO B 37 -3.178 -3.553 -11.389 1.00 0.00 C ATOM 1548 C PRO B 37 -1.935 -3.012 -12.084 1.00 0.00 C ATOM 1549 O PRO B 37 -1.333 -2.038 -11.629 1.00 0.00 O ATOM 1550 CB PRO B 37 -4.428 -2.870 -11.933 1.00 0.00 C ATOM 1551 CG PRO B 37 -4.558 -1.640 -11.103 1.00 0.00 C ATOM 1552 CD PRO B 37 -4.040 -1.999 -9.731 1.00 0.00 C ATOM 0 HA PRO B 37 -3.147 -4.630 -11.552 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -4.322 -2.628 -12.991 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -5.305 -3.510 -11.838 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -3.985 -0.819 -11.533 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.596 -1.312 -11.053 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.450 -1.189 -9.301 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.855 -2.203 -9.036 1.00 0.00 H new ATOM 1560 N LYS B 38 -1.555 -3.643 -13.189 1.00 0.00 N ATOM 1561 CA LYS B 38 -0.383 -3.217 -13.947 1.00 0.00 C ATOM 1562 C LYS B 38 -0.738 -2.113 -14.946 1.00 0.00 C ATOM 1563 O LYS B 38 0.034 -1.828 -15.862 1.00 0.00 O ATOM 1564 CB LYS B 38 0.233 -4.410 -14.682 1.00 0.00 C ATOM 1565 CG LYS B 38 1.714 -4.601 -14.397 1.00 0.00 C ATOM 1566 CD LYS B 38 1.940 -5.256 -13.044 1.00 0.00 C ATOM 1567 CE LYS B 38 2.143 -6.756 -13.178 1.00 0.00 C ATOM 1568 NZ LYS B 38 3.581 -7.133 -13.085 1.00 0.00 N ATOM 0 H LYS B 38 -2.040 -4.450 -13.580 1.00 0.00 H new ATOM 0 HA LYS B 38 0.344 -2.815 -13.242 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -0.303 -5.316 -14.400 1.00 0.00 H new ATOM 0 HB3 LYS B 38 0.092 -4.278 -15.755 1.00 0.00 H new ATOM 0 HG2 LYS B 38 2.160 -5.215 -15.179 1.00 0.00 H new ATOM 0 HG3 LYS B 38 2.218 -3.635 -14.424 1.00 0.00 H new ATOM 0 HD2 LYS B 38 2.812 -4.811 -12.564 1.00 0.00 H new ATOM 0 HD3 LYS B 38 1.085 -5.060 -12.396 1.00 0.00 H new ATOM 0 HE2 LYS B 38 1.582 -7.269 -12.397 1.00 0.00 H new ATOM 0 HE3 LYS B 38 1.741 -7.093 -14.133 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 3.676 -8.164 -13.181 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 4.113 -6.664 -13.846 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 3.959 -6.835 -12.163 1.00 0.00 H new ATOM 1582 N GLU B 39 -1.905 -1.496 -14.769 1.00 0.00 N ATOM 1583 CA GLU B 39 -2.347 -0.429 -15.660 1.00 0.00 C ATOM 1584 C GLU B 39 -1.991 0.942 -15.091 1.00 0.00 C ATOM 1585 O GLU B 39 -1.603 1.847 -15.830 1.00 0.00 O ATOM 1586 CB GLU B 39 -3.858 -0.524 -15.891 1.00 0.00 C ATOM 1587 CG GLU B 39 -4.256 -0.428 -17.355 1.00 0.00 C ATOM 1588 CD GLU B 39 -5.477 0.445 -17.571 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -5.437 1.629 -17.177 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -6.472 -0.056 -18.135 1.00 0.00 O ATOM 0 H GLU B 39 -2.559 -1.717 -14.018 1.00 0.00 H new ATOM 0 HA GLU B 39 -1.832 -0.549 -16.613 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -4.221 -1.469 -15.486 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -4.353 0.272 -15.335 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -3.421 -0.027 -17.929 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -4.456 -1.428 -17.740 1.00 0.00 H new ATOM 1597 N VAL B 40 -2.121 1.089 -13.776 1.00 0.00 N ATOM 1598 CA VAL B 40 -1.809 2.351 -13.115 1.00 0.00 C ATOM 1599 C VAL B 40 -0.334 2.414 -12.733 1.00 0.00 C ATOM 1600 O VAL B 40 0.255 1.412 -12.328 1.00 0.00 O ATOM 1601 CB VAL B 40 -2.670 2.562 -11.852 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -2.604 4.010 -11.396 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -4.111 2.143 -12.107 1.00 0.00 C ATOM 0 H VAL B 40 -2.440 0.351 -13.148 1.00 0.00 H new ATOM 0 HA VAL B 40 -2.035 3.145 -13.827 1.00 0.00 H new ATOM 0 HB VAL B 40 -2.269 1.934 -11.056 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.217 4.139 -10.504 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -1.571 4.273 -11.167 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -2.976 4.659 -12.189 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -4.701 2.300 -11.204 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -4.525 2.740 -12.919 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -4.140 1.088 -12.381 1.00 0.00 H new ATOM 1613 N SER B 41 0.260 3.597 -12.866 1.00 0.00 N ATOM 1614 CA SER B 41 1.669 3.789 -12.538 1.00 0.00 C ATOM 1615 C SER B 41 1.958 3.364 -11.102 1.00 0.00 C ATOM 1616 O SER B 41 1.724 4.122 -10.161 1.00 0.00 O ATOM 1617 CB SER B 41 2.066 5.253 -12.738 1.00 0.00 C ATOM 1618 OG SER B 41 2.456 5.498 -14.078 1.00 0.00 O ATOM 0 H SER B 41 -0.213 4.437 -13.199 1.00 0.00 H new ATOM 0 HA SER B 41 2.260 3.164 -13.208 1.00 0.00 H new ATOM 0 HB2 SER B 41 1.228 5.899 -12.476 1.00 0.00 H new ATOM 0 HB3 SER B 41 2.886 5.506 -12.066 1.00 0.00 H new ATOM 0 HG SER B 41 2.703 6.441 -14.180 1.00 0.00 H new ATOM 1624 N VAL B 42 2.466 2.146 -10.940 1.00 0.00 N ATOM 1625 CA VAL B 42 2.786 1.622 -9.618 1.00 0.00 C ATOM 1626 C VAL B 42 4.259 1.227 -9.520 1.00 0.00 C ATOM 1627 O VAL B 42 4.731 0.375 -10.272 1.00 0.00 O ATOM 1628 CB VAL B 42 1.912 0.398 -9.277 1.00 0.00 C ATOM 1629 CG1 VAL B 42 2.181 -0.742 -10.248 1.00 0.00 C ATOM 1630 CG2 VAL B 42 2.149 -0.046 -7.840 1.00 0.00 C ATOM 0 H VAL B 42 2.665 1.504 -11.708 1.00 0.00 H new ATOM 0 HA VAL B 42 2.582 2.419 -8.903 1.00 0.00 H new ATOM 0 HB VAL B 42 0.865 0.686 -9.375 1.00 0.00 H new ATOM 0 HG11 VAL B 42 1.554 -1.596 -9.990 1.00 0.00 H new ATOM 0 HG12 VAL B 42 1.952 -0.417 -11.263 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.230 -1.031 -10.188 1.00 0.00 H new ATOM 0 HG21 VAL B 42 1.523 -0.911 -7.618 1.00 0.00 H new ATOM 0 HG22 VAL B 42 3.198 -0.314 -7.710 1.00 0.00 H new ATOM 0 HG23 VAL B 42 1.896 0.768 -7.161 1.00 0.00 H new ATOM 1640 N HIS B 43 4.979 1.843 -8.586 1.00 0.00 N ATOM 1641 CA HIS B 43 6.393 1.546 -8.389 1.00 0.00 C ATOM 1642 C HIS B 43 6.671 1.228 -6.924 1.00 0.00 C ATOM 1643 O HIS B 43 6.178 1.913 -6.028 1.00 0.00 O ATOM 1644 CB HIS B 43 7.253 2.728 -8.845 1.00 0.00 C ATOM 1645 CG HIS B 43 8.049 2.446 -10.081 1.00 0.00 C ATOM 1646 ND1 HIS B 43 7.887 3.145 -11.258 1.00 0.00 N ATOM 1647 CD2 HIS B 43 9.022 1.534 -10.321 1.00 0.00 C ATOM 1648 CE1 HIS B 43 8.722 2.678 -12.168 1.00 0.00 C ATOM 1649 NE2 HIS B 43 9.422 1.699 -11.625 1.00 0.00 N ATOM 0 H HIS B 43 4.605 2.551 -7.954 1.00 0.00 H new ATOM 0 HA HIS B 43 6.650 0.673 -8.990 1.00 0.00 H new ATOM 0 HB2 HIS B 43 6.608 3.588 -9.026 1.00 0.00 H new ATOM 0 HB3 HIS B 43 7.933 3.004 -8.039 1.00 0.00 H new ATOM 0 HD2 HIS B 43 9.411 0.812 -9.618 1.00 0.00 H new ATOM 0 HE1 HIS B 43 8.816 3.036 -13.183 1.00 0.00 H new ATOM 0 HE2 HIS B 43 10.143 1.153 -12.097 1.00 0.00 H new ATOM 1657 N ARG B 44 7.459 0.186 -6.683 1.00 0.00 N ATOM 1658 CA ARG B 44 7.794 -0.215 -5.321 1.00 0.00 C ATOM 1659 C ARG B 44 9.097 -1.008 -5.291 1.00 0.00 C ATOM 1660 O ARG B 44 10.102 -0.548 -4.749 1.00 0.00 O ATOM 1661 CB ARG B 44 6.661 -1.047 -4.719 1.00 0.00 C ATOM 1662 CG ARG B 44 6.744 -1.184 -3.208 1.00 0.00 C ATOM 1663 CD ARG B 44 5.688 -2.139 -2.675 1.00 0.00 C ATOM 1664 NE ARG B 44 6.127 -2.812 -1.456 1.00 0.00 N ATOM 1665 CZ ARG B 44 5.515 -3.870 -0.930 1.00 0.00 C ATOM 1666 NH1 ARG B 44 4.433 -4.377 -1.509 1.00 0.00 N ATOM 1667 NH2 ARG B 44 5.987 -4.423 0.179 1.00 0.00 N ATOM 0 H ARG B 44 7.877 -0.395 -7.410 1.00 0.00 H new ATOM 0 HA ARG B 44 7.927 0.688 -4.725 1.00 0.00 H new ATOM 0 HB2 ARG B 44 5.707 -0.591 -4.982 1.00 0.00 H new ATOM 0 HB3 ARG B 44 6.673 -2.041 -5.167 1.00 0.00 H new ATOM 0 HG2 ARG B 44 7.735 -1.543 -2.928 1.00 0.00 H new ATOM 0 HG3 ARG B 44 6.617 -0.205 -2.746 1.00 0.00 H new ATOM 0 HD2 ARG B 44 4.769 -1.588 -2.475 1.00 0.00 H new ATOM 0 HD3 ARG B 44 5.454 -2.883 -3.436 1.00 0.00 H new ATOM 0 HE ARG B 44 6.952 -2.449 -0.979 1.00 0.00 H new ATOM 0 HH11 ARG B 44 4.066 -3.955 -2.362 1.00 0.00 H new ATOM 0 HH12 ARG B 44 3.969 -5.188 -1.101 1.00 0.00 H new ATOM 0 HH21 ARG B 44 6.818 -4.037 0.627 1.00 0.00 H new ATOM 0 HH22 ARG B 44 5.519 -5.234 0.584 1.00 0.00 H new ATOM 1681 N GLU B 45 9.072 -2.202 -5.874 1.00 0.00 N ATOM 1682 CA GLU B 45 10.253 -3.057 -5.913 1.00 0.00 C ATOM 1683 C GLU B 45 10.092 -4.160 -6.955 1.00 0.00 C ATOM 1684 O GLU B 45 9.157 -4.960 -6.891 1.00 0.00 O ATOM 1685 CB GLU B 45 10.509 -3.670 -4.533 1.00 0.00 C ATOM 1686 CG GLU B 45 11.926 -3.454 -4.026 1.00 0.00 C ATOM 1687 CD GLU B 45 12.303 -1.988 -3.958 1.00 0.00 C ATOM 1688 OE1 GLU B 45 11.877 -1.308 -3.001 1.00 0.00 O ATOM 1689 OE2 GLU B 45 13.026 -1.519 -4.862 1.00 0.00 O ATOM 0 H GLU B 45 8.248 -2.599 -6.325 1.00 0.00 H new ATOM 0 HA GLU B 45 11.109 -2.443 -6.193 1.00 0.00 H new ATOM 0 HB2 GLU B 45 9.807 -3.241 -3.818 1.00 0.00 H new ATOM 0 HB3 GLU B 45 10.306 -4.740 -4.576 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.025 -3.897 -3.035 1.00 0.00 H new ATOM 0 HG3 GLU B 45 12.625 -3.975 -4.680 1.00 0.00 H new ATOM 1696 N GLU B 46 11.013 -4.198 -7.914 1.00 0.00 N ATOM 1697 CA GLU B 46 10.977 -5.203 -8.969 1.00 0.00 C ATOM 1698 C GLU B 46 11.000 -6.608 -8.378 1.00 0.00 C ATOM 1699 O GLU B 46 10.268 -7.491 -8.822 1.00 0.00 O ATOM 1700 CB GLU B 46 12.158 -5.017 -9.922 1.00 0.00 C ATOM 1701 CG GLU B 46 13.513 -5.158 -9.248 1.00 0.00 C ATOM 1702 CD GLU B 46 14.664 -4.853 -10.186 1.00 0.00 C ATOM 1703 OE1 GLU B 46 14.926 -3.658 -10.437 1.00 0.00 O ATOM 1704 OE2 GLU B 46 15.305 -5.810 -10.670 1.00 0.00 O ATOM 0 H GLU B 46 11.793 -3.544 -7.981 1.00 0.00 H new ATOM 0 HA GLU B 46 10.049 -5.077 -9.527 1.00 0.00 H new ATOM 0 HB2 GLU B 46 12.084 -5.749 -10.726 1.00 0.00 H new ATOM 0 HB3 GLU B 46 12.091 -4.031 -10.382 1.00 0.00 H new ATOM 0 HG2 GLU B 46 13.560 -4.487 -8.391 1.00 0.00 H new ATOM 0 HG3 GLU B 46 13.620 -6.173 -8.865 1.00 0.00 H new ATOM 1711 N ILE B 47 11.842 -6.806 -7.369 1.00 0.00 N ATOM 1712 CA ILE B 47 11.956 -8.102 -6.714 1.00 0.00 C ATOM 1713 C ILE B 47 10.669 -8.448 -5.969 1.00 0.00 C ATOM 1714 O ILE B 47 10.215 -9.592 -5.988 1.00 0.00 O ATOM 1715 CB ILE B 47 13.149 -8.133 -5.729 1.00 0.00 C ATOM 1716 CG1 ILE B 47 13.202 -9.469 -4.979 1.00 0.00 C ATOM 1717 CG2 ILE B 47 13.064 -6.972 -4.748 1.00 0.00 C ATOM 1718 CD1 ILE B 47 14.497 -10.226 -5.183 1.00 0.00 C ATOM 0 H ILE B 47 12.455 -6.085 -6.988 1.00 0.00 H new ATOM 0 HA ILE B 47 12.129 -8.844 -7.493 1.00 0.00 H new ATOM 0 HB ILE B 47 14.068 -8.030 -6.306 1.00 0.00 H new ATOM 0 HG12 ILE B 47 13.062 -9.284 -3.914 1.00 0.00 H new ATOM 0 HG13 ILE B 47 12.370 -10.093 -5.306 1.00 0.00 H new ATOM 0 HG21 ILE B 47 13.912 -7.011 -4.064 1.00 0.00 H new ATOM 0 HG22 ILE B 47 13.083 -6.030 -5.296 1.00 0.00 H new ATOM 0 HG23 ILE B 47 12.136 -7.042 -4.181 1.00 0.00 H new ATOM 0 HD11 ILE B 47 14.464 -11.161 -4.623 1.00 0.00 H new ATOM 0 HD12 ILE B 47 14.629 -10.442 -6.243 1.00 0.00 H new ATOM 0 HD13 ILE B 47 15.332 -9.621 -4.830 1.00 0.00 H new ATOM 1730 N TYR B 48 10.090 -7.452 -5.306 1.00 0.00 N ATOM 1731 CA TYR B 48 8.860 -7.647 -4.545 1.00 0.00 C ATOM 1732 C TYR B 48 7.772 -8.303 -5.392 1.00 0.00 C ATOM 1733 O TYR B 48 7.112 -9.241 -4.946 1.00 0.00 O ATOM 1734 CB TYR B 48 8.361 -6.306 -3.994 1.00 0.00 C ATOM 1735 CG TYR B 48 9.042 -5.880 -2.709 1.00 0.00 C ATOM 1736 CD1 TYR B 48 10.234 -6.466 -2.293 1.00 0.00 C ATOM 1737 CD2 TYR B 48 8.488 -4.889 -1.911 1.00 0.00 C ATOM 1738 CE1 TYR B 48 10.850 -6.075 -1.120 1.00 0.00 C ATOM 1739 CE2 TYR B 48 9.099 -4.492 -0.736 1.00 0.00 C ATOM 1740 CZ TYR B 48 10.279 -5.088 -0.346 1.00 0.00 C ATOM 1741 OH TYR B 48 10.891 -4.695 0.822 1.00 0.00 O ATOM 0 H TYR B 48 10.454 -6.499 -5.280 1.00 0.00 H new ATOM 0 HA TYR B 48 9.086 -8.317 -3.715 1.00 0.00 H new ATOM 0 HB2 TYR B 48 8.515 -5.534 -4.748 1.00 0.00 H new ATOM 0 HB3 TYR B 48 7.287 -6.373 -3.820 1.00 0.00 H new ATOM 0 HD1 TYR B 48 10.685 -7.239 -2.897 1.00 0.00 H new ATOM 0 HD2 TYR B 48 7.563 -4.420 -2.213 1.00 0.00 H new ATOM 0 HE1 TYR B 48 11.774 -6.540 -0.811 1.00 0.00 H new ATOM 0 HE2 TYR B 48 8.654 -3.719 -0.127 1.00 0.00 H new ATOM 0 HH TYR B 48 10.361 -3.989 1.248 1.00 0.00 H new ATOM 1751 N GLN B 49 7.578 -7.802 -6.608 1.00 0.00 N ATOM 1752 CA GLN B 49 6.554 -8.344 -7.499 1.00 0.00 C ATOM 1753 C GLN B 49 7.080 -9.522 -8.318 1.00 0.00 C ATOM 1754 O GLN B 49 6.525 -10.620 -8.270 1.00 0.00 O ATOM 1755 CB GLN B 49 6.041 -7.249 -8.436 1.00 0.00 C ATOM 1756 CG GLN B 49 4.947 -6.389 -7.825 1.00 0.00 C ATOM 1757 CD GLN B 49 4.947 -4.973 -8.367 1.00 0.00 C ATOM 1758 OE1 GLN B 49 5.962 -4.488 -8.867 1.00 0.00 O ATOM 1759 NE2 GLN B 49 3.805 -4.302 -8.271 1.00 0.00 N ATOM 0 H GLN B 49 8.112 -7.026 -6.999 1.00 0.00 H new ATOM 0 HA GLN B 49 5.736 -8.708 -6.878 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.875 -6.610 -8.725 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.662 -7.711 -9.348 1.00 0.00 H new ATOM 0 HG2 GLN B 49 3.978 -6.848 -8.019 1.00 0.00 H new ATOM 0 HG3 GLN B 49 5.075 -6.360 -6.743 1.00 0.00 H new ATOM 0 HE21 GLN B 49 2.988 -4.743 -7.849 1.00 0.00 H new ATOM 0 HE22 GLN B 49 3.745 -3.345 -8.619 1.00 0.00 H new ATOM 1768 N ARG B 50 8.141 -9.280 -9.083 1.00 0.00 N ATOM 1769 CA ARG B 50 8.740 -10.309 -9.936 1.00 0.00 C ATOM 1770 C ARG B 50 8.988 -11.623 -9.190 1.00 0.00 C ATOM 1771 O ARG B 50 9.138 -12.674 -9.813 1.00 0.00 O ATOM 1772 CB ARG B 50 10.055 -9.800 -10.528 1.00 0.00 C ATOM 1773 CG ARG B 50 9.878 -8.644 -11.500 1.00 0.00 C ATOM 1774 CD ARG B 50 10.646 -8.875 -12.792 1.00 0.00 C ATOM 1775 NE ARG B 50 10.042 -8.172 -13.921 1.00 0.00 N ATOM 1776 CZ ARG B 50 10.456 -8.299 -15.180 1.00 0.00 C ATOM 1777 NH1 ARG B 50 11.472 -9.100 -15.475 1.00 0.00 N ATOM 1778 NH2 ARG B 50 9.852 -7.622 -16.147 1.00 0.00 N ATOM 0 H ARG B 50 8.608 -8.375 -9.131 1.00 0.00 H new ATOM 0 HA ARG B 50 8.025 -10.516 -10.732 1.00 0.00 H new ATOM 0 HB2 ARG B 50 10.711 -9.484 -9.717 1.00 0.00 H new ATOM 0 HB3 ARG B 50 10.555 -10.622 -11.041 1.00 0.00 H new ATOM 0 HG2 ARG B 50 8.819 -8.515 -11.724 1.00 0.00 H new ATOM 0 HG3 ARG B 50 10.220 -7.720 -11.033 1.00 0.00 H new ATOM 0 HD2 ARG B 50 11.676 -8.541 -12.666 1.00 0.00 H new ATOM 0 HD3 ARG B 50 10.681 -9.943 -13.007 1.00 0.00 H new ATOM 0 HE ARG B 50 9.257 -7.548 -13.734 1.00 0.00 H new ATOM 0 HH11 ARG B 50 11.941 -9.623 -14.735 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.784 -9.193 -16.442 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.071 -7.004 -15.926 1.00 0.00 H new ATOM 0 HH22 ARG B 50 10.169 -7.719 -17.112 1.00 0.00 H new ATOM 1792 N ILE B 51 9.041 -11.565 -7.863 1.00 0.00 N ATOM 1793 CA ILE B 51 9.282 -12.758 -7.060 1.00 0.00 C ATOM 1794 C ILE B 51 8.026 -13.190 -6.308 1.00 0.00 C ATOM 1795 O ILE B 51 7.609 -14.345 -6.395 1.00 0.00 O ATOM 1796 CB ILE B 51 10.426 -12.532 -6.049 1.00 0.00 C ATOM 1797 CG1 ILE B 51 11.668 -11.987 -6.762 1.00 0.00 C ATOM 1798 CG2 ILE B 51 10.753 -13.825 -5.312 1.00 0.00 C ATOM 1799 CD1 ILE B 51 12.142 -12.854 -7.910 1.00 0.00 C ATOM 0 H ILE B 51 8.921 -10.708 -7.323 1.00 0.00 H new ATOM 0 HA ILE B 51 9.569 -13.549 -7.753 1.00 0.00 H new ATOM 0 HB ILE B 51 10.099 -11.795 -5.315 1.00 0.00 H new ATOM 0 HG12 ILE B 51 11.450 -10.988 -7.139 1.00 0.00 H new ATOM 0 HG13 ILE B 51 12.476 -11.885 -6.038 1.00 0.00 H new ATOM 0 HG21 ILE B 51 11.562 -13.646 -4.604 1.00 0.00 H new ATOM 0 HG22 ILE B 51 9.870 -14.171 -4.774 1.00 0.00 H new ATOM 0 HG23 ILE B 51 11.061 -14.585 -6.030 1.00 0.00 H new ATOM 0 HD11 ILE B 51 13.024 -12.404 -8.365 1.00 0.00 H new ATOM 0 HD12 ILE B 51 12.393 -13.847 -7.537 1.00 0.00 H new ATOM 0 HD13 ILE B 51 11.351 -12.936 -8.655 1.00 0.00 H new ATOM 1811 N GLN B 52 7.426 -12.261 -5.571 1.00 0.00 N ATOM 1812 CA GLN B 52 6.218 -12.562 -4.811 1.00 0.00 C ATOM 1813 C GLN B 52 5.051 -12.858 -5.746 1.00 0.00 C ATOM 1814 O GLN B 52 4.524 -13.970 -5.761 1.00 0.00 O ATOM 1815 CB GLN B 52 5.862 -11.402 -3.880 1.00 0.00 C ATOM 1816 CG GLN B 52 5.044 -11.826 -2.671 1.00 0.00 C ATOM 1817 CD GLN B 52 5.730 -12.903 -1.852 1.00 0.00 C ATOM 1818 OE1 GLN B 52 6.493 -12.609 -0.933 1.00 0.00 O ATOM 1819 NE2 GLN B 52 5.460 -14.160 -2.185 1.00 0.00 N ATOM 0 H GLN B 52 7.754 -11.299 -5.484 1.00 0.00 H new ATOM 0 HA GLN B 52 6.414 -13.448 -4.207 1.00 0.00 H new ATOM 0 HB2 GLN B 52 6.781 -10.925 -3.538 1.00 0.00 H new ATOM 0 HB3 GLN B 52 5.304 -10.653 -4.442 1.00 0.00 H new ATOM 0 HG2 GLN B 52 4.858 -10.957 -2.039 1.00 0.00 H new ATOM 0 HG3 GLN B 52 4.073 -12.191 -3.004 1.00 0.00 H new ATOM 0 HE21 GLN B 52 4.821 -14.358 -2.955 1.00 0.00 H new ATOM 0 HE22 GLN B 52 5.892 -14.928 -1.671 1.00 0.00 H new ATOM 1828 N ALA B 53 4.656 -11.861 -6.532 1.00 0.00 N ATOM 1829 CA ALA B 53 3.558 -12.025 -7.473 1.00 0.00 C ATOM 1830 C ALA B 53 3.972 -12.929 -8.627 1.00 0.00 C ATOM 1831 O ALA B 53 3.155 -13.664 -9.180 1.00 0.00 O ATOM 1832 CB ALA B 53 3.100 -10.671 -7.996 1.00 0.00 C ATOM 0 H ALA B 53 5.080 -10.933 -6.535 1.00 0.00 H new ATOM 0 HA ALA B 53 2.725 -12.495 -6.951 1.00 0.00 H new ATOM 0 HB1 ALA B 53 2.278 -10.811 -8.698 1.00 0.00 H new ATOM 0 HB2 ALA B 53 2.764 -10.054 -7.163 1.00 0.00 H new ATOM 0 HB3 ALA B 53 3.929 -10.177 -8.502 1.00 0.00 H new ATOM 1838 N GLU B 54 5.252 -12.868 -8.981 1.00 0.00 N ATOM 1839 CA GLU B 54 5.784 -13.681 -10.066 1.00 0.00 C ATOM 1840 C GLU B 54 6.684 -14.784 -9.519 1.00 0.00 C ATOM 1841 O GLU B 54 7.693 -14.516 -8.865 1.00 0.00 O ATOM 1842 CB GLU B 54 6.552 -12.807 -11.058 1.00 0.00 C ATOM 1843 CG GLU B 54 5.849 -12.648 -12.396 1.00 0.00 C ATOM 1844 CD GLU B 54 4.461 -12.053 -12.258 1.00 0.00 C ATOM 1845 OE1 GLU B 54 4.338 -10.968 -11.651 1.00 0.00 O ATOM 1846 OE2 GLU B 54 3.498 -12.672 -12.756 1.00 0.00 O ATOM 0 H GLU B 54 5.939 -12.263 -8.531 1.00 0.00 H new ATOM 0 HA GLU B 54 4.949 -14.148 -10.588 1.00 0.00 H new ATOM 0 HB2 GLU B 54 6.706 -11.822 -10.618 1.00 0.00 H new ATOM 0 HB3 GLU B 54 7.538 -13.240 -11.224 1.00 0.00 H new ATOM 0 HG2 GLU B 54 6.450 -12.011 -13.045 1.00 0.00 H new ATOM 0 HG3 GLU B 54 5.777 -13.621 -12.882 1.00 0.00 H new ATOM 1853 N LYS B 55 6.300 -16.025 -9.791 1.00 0.00 N ATOM 1854 CA LYS B 55 7.048 -17.193 -9.331 1.00 0.00 C ATOM 1855 C LYS B 55 8.531 -17.080 -9.672 1.00 0.00 C ATOM 1856 O LYS B 55 8.935 -17.292 -10.816 1.00 0.00 O ATOM 1857 CB LYS B 55 6.465 -18.466 -9.948 1.00 0.00 C ATOM 1858 CG LYS B 55 5.743 -19.351 -8.946 1.00 0.00 C ATOM 1859 CD LYS B 55 4.254 -19.048 -8.906 1.00 0.00 C ATOM 1860 CE LYS B 55 3.904 -18.127 -7.748 1.00 0.00 C ATOM 1861 NZ LYS B 55 4.449 -18.628 -6.456 1.00 0.00 N ATOM 0 H LYS B 55 5.466 -16.252 -10.333 1.00 0.00 H new ATOM 0 HA LYS B 55 6.957 -17.241 -8.246 1.00 0.00 H new ATOM 0 HB2 LYS B 55 5.772 -18.190 -10.743 1.00 0.00 H new ATOM 0 HB3 LYS B 55 7.270 -19.037 -10.411 1.00 0.00 H new ATOM 0 HG2 LYS B 55 5.895 -20.398 -9.208 1.00 0.00 H new ATOM 0 HG3 LYS B 55 6.172 -19.205 -7.955 1.00 0.00 H new ATOM 0 HD2 LYS B 55 3.950 -18.585 -9.845 1.00 0.00 H new ATOM 0 HD3 LYS B 55 3.694 -19.979 -8.814 1.00 0.00 H new ATOM 0 HE2 LYS B 55 4.297 -17.130 -7.946 1.00 0.00 H new ATOM 0 HE3 LYS B 55 2.821 -18.033 -7.673 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 3.810 -18.358 -5.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 4.530 -19.664 -6.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 5.388 -18.213 -6.291 1.00 0.00 H new