USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1290 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 45 MET CE :methyl -142:sc= -1.26 (180deg=-0.866) USER MOD Set 1.2: A 49 GLN : amide:sc= -0.381 K(o=-3.9,f=-6.1) USER MOD Set 1.3: B 49 GLN : amide:sc= -1.76 K(o=-3.9,f=-5.2) USER MOD Set 1.4: B 50 ASN : amide:sc= -0.359 X(o=-3.9,f=-3.9) USER MOD Set 1.5: B 61 LYS NZ :NH3+ -155:sc= -0.133 (180deg=0) USER MOD Set 2.1: A 35 MET CE :methyl -156:sc= -2.4! (180deg=-3.2!) USER MOD Set 2.2: B 12 THR OG1 : rot -174:sc= 1.01 USER MOD Set 3.1: A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 28 SER OG : rot -71:sc= 0.471 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= -0.124 (180deg=-0.192) USER MOD Single : A 4 SER OG : rot 180:sc= -0.977 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -135:sc= -0.205 (180deg=-0.785) USER MOD Single : A 12 THR OG1 : rot 153:sc= 1.18 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 THR OG1 : rot -103:sc= -0.952 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0682 X(o=-0.068,f=-0.52) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.034 USER MOD Single : A 50 ASN : amide:sc= -1.08 K(o=-1.1,f=-4.3!) USER MOD Single : A 51 LYS NZ :NH3+ 163:sc= -4.98! (180deg=-6.05!) USER MOD Single : A 53 LYS NZ :NH3+ -131:sc= -0.284 (180deg=-2.25!) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0.35) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -150:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -130:sc= 0 (180deg=-0.128) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ -156:sc= -0.127 (180deg=-0.333) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ -154:sc= 0.00535 (180deg=0) USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= 0 X(o=0,f=-0.0076) USER MOD Single : B 23 THR OG1 : rot -82:sc= -1.97! USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot -66:sc= 0.496 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : B 35 MET CE :methyl -168:sc= -1.76 (180deg=-2.02) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0175 USER MOD Single : B 45 MET CE :methyl 148:sc= -2.57 (180deg=-4.8!) USER MOD Single : B 51 LYS NZ :NH3+ 147:sc= -1.32 (180deg=-4.04!) USER MOD Single : B 53 LYS NZ :NH3+ -133:sc= -0.416 (180deg=-2.18!) USER MOD Single : B 56 ASN : amide:sc= -0.219 K(o=-0.22,f=-2.7!) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 SER OG : rot 65:sc= 1.16 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.092 17.819 -20.972 1.00 0.00 N ATOM 2 CA MET A 1 8.257 18.618 -21.907 1.00 0.00 C ATOM 3 C MET A 1 7.026 19.185 -21.203 1.00 0.00 C ATOM 4 O MET A 1 6.701 20.363 -21.355 1.00 0.00 O ATOM 5 CB MET A 1 7.836 17.723 -23.077 1.00 0.00 C ATOM 6 CG MET A 1 6.872 16.614 -22.686 1.00 0.00 C ATOM 7 SD MET A 1 6.554 15.464 -24.039 1.00 0.00 S ATOM 8 CE MET A 1 4.949 16.030 -24.597 1.00 0.00 C ATOM 0 H1 MET A 1 9.834 17.323 -21.506 1.00 0.00 H new ATOM 0 H2 MET A 1 9.532 18.451 -20.273 1.00 0.00 H new ATOM 0 H3 MET A 1 8.495 17.123 -20.481 1.00 0.00 H new ATOM 0 HA MET A 1 8.841 19.462 -22.274 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.372 18.341 -23.846 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.727 17.278 -23.520 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.279 16.066 -21.836 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.930 17.055 -22.359 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.617 15.415 -25.433 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.231 15.951 -23.781 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.021 17.069 -24.917 1.00 0.00 H new ATOM 20 N VAL A 2 6.348 18.341 -20.431 1.00 0.00 N ATOM 21 CA VAL A 2 5.156 18.761 -19.704 1.00 0.00 C ATOM 22 C VAL A 2 4.950 17.912 -18.455 1.00 0.00 C ATOM 23 O VAL A 2 5.463 16.798 -18.357 1.00 0.00 O ATOM 24 CB VAL A 2 3.896 18.671 -20.586 1.00 0.00 C ATOM 25 CG1 VAL A 2 2.699 19.279 -19.871 1.00 0.00 C ATOM 26 CG2 VAL A 2 4.129 19.354 -21.925 1.00 0.00 C ATOM 0 H VAL A 2 6.604 17.363 -20.293 1.00 0.00 H new ATOM 0 HA VAL A 2 5.312 19.800 -19.415 1.00 0.00 H new ATOM 0 HB VAL A 2 3.682 17.619 -20.774 1.00 0.00 H new ATOM 0 HG11 VAL A 2 1.818 19.206 -20.509 1.00 0.00 H new ATOM 0 HG12 VAL A 2 2.518 18.740 -18.941 1.00 0.00 H new ATOM 0 HG13 VAL A 2 2.901 20.327 -19.650 1.00 0.00 H new ATOM 0 HG21 VAL A 2 3.228 19.279 -22.533 1.00 0.00 H new ATOM 0 HG22 VAL A 2 4.370 20.404 -21.761 1.00 0.00 H new ATOM 0 HG23 VAL A 2 4.957 18.868 -22.442 1.00 0.00 H new ATOM 36 N GLU A 3 4.194 18.447 -17.501 1.00 0.00 N ATOM 37 CA GLU A 3 3.919 17.739 -16.256 1.00 0.00 C ATOM 38 C GLU A 3 2.581 17.011 -16.329 1.00 0.00 C ATOM 39 O GLU A 3 1.634 17.355 -15.621 1.00 0.00 O ATOM 40 CB GLU A 3 3.921 18.716 -15.078 1.00 0.00 C ATOM 41 CG GLU A 3 3.658 18.052 -13.737 1.00 0.00 C ATOM 42 CD GLU A 3 3.972 18.959 -12.564 1.00 0.00 C ATOM 43 OE1 GLU A 3 5.169 19.225 -12.323 1.00 0.00 O ATOM 44 OE2 GLU A 3 3.022 19.406 -11.887 1.00 0.00 O ATOM 0 H GLU A 3 3.761 19.368 -17.567 1.00 0.00 H new ATOM 0 HA GLU A 3 4.705 17.000 -16.105 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.885 19.224 -15.040 1.00 0.00 H new ATOM 0 HB3 GLU A 3 3.164 19.481 -15.250 1.00 0.00 H new ATOM 0 HG2 GLU A 3 2.613 17.747 -13.686 1.00 0.00 H new ATOM 0 HG3 GLU A 3 4.258 17.145 -13.661 1.00 0.00 H new ATOM 51 N SER A 4 2.506 16.003 -17.192 1.00 0.00 N ATOM 52 CA SER A 4 1.283 15.226 -17.357 1.00 0.00 C ATOM 53 C SER A 4 1.465 14.138 -18.410 1.00 0.00 C ATOM 54 O SER A 4 1.048 12.996 -18.216 1.00 0.00 O ATOM 55 CB SER A 4 0.119 16.140 -17.746 1.00 0.00 C ATOM 56 OG SER A 4 -1.048 15.388 -18.032 1.00 0.00 O ATOM 0 H SER A 4 3.278 15.705 -17.788 1.00 0.00 H new ATOM 0 HA SER A 4 1.057 14.748 -16.404 1.00 0.00 H new ATOM 0 HB2 SER A 4 -0.085 16.839 -16.935 1.00 0.00 H new ATOM 0 HB3 SER A 4 0.395 16.734 -18.617 1.00 0.00 H new ATOM 0 HG SER A 4 -1.777 15.996 -18.276 1.00 0.00 H new ATOM 62 N LYS A 5 2.090 14.501 -19.526 1.00 0.00 N ATOM 63 CA LYS A 5 2.327 13.555 -20.610 1.00 0.00 C ATOM 64 C LYS A 5 3.645 12.815 -20.407 1.00 0.00 C ATOM 65 O LYS A 5 3.732 11.609 -20.635 1.00 0.00 O ATOM 66 CB LYS A 5 2.340 14.284 -21.956 1.00 0.00 C ATOM 67 CG LYS A 5 0.979 14.344 -22.628 1.00 0.00 C ATOM 68 CD LYS A 5 -0.054 15.013 -21.736 1.00 0.00 C ATOM 69 CE LYS A 5 -0.917 13.988 -21.016 1.00 0.00 C ATOM 70 NZ LYS A 5 -2.257 13.847 -21.650 1.00 0.00 N ATOM 0 H LYS A 5 2.441 15.442 -19.703 1.00 0.00 H new ATOM 0 HA LYS A 5 1.517 12.825 -20.607 1.00 0.00 H new ATOM 0 HB2 LYS A 5 2.707 15.299 -21.806 1.00 0.00 H new ATOM 0 HB3 LYS A 5 3.044 13.786 -22.623 1.00 0.00 H new ATOM 0 HG2 LYS A 5 1.060 14.892 -23.567 1.00 0.00 H new ATOM 0 HG3 LYS A 5 0.649 13.335 -22.875 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.450 15.644 -21.004 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -0.687 15.665 -22.337 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -0.411 13.022 -21.017 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -1.038 14.283 -19.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.814 13.139 -21.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.750 14.762 -21.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.143 13.541 -22.637 1.00 0.00 H new ATOM 84 N LYS A 6 4.668 13.546 -19.977 1.00 0.00 N ATOM 85 CA LYS A 6 5.982 12.960 -19.745 1.00 0.00 C ATOM 86 C LYS A 6 6.228 12.750 -18.254 1.00 0.00 C ATOM 87 O LYS A 6 6.564 11.649 -17.819 1.00 0.00 O ATOM 88 CB LYS A 6 7.073 13.857 -20.331 1.00 0.00 C ATOM 89 CG LYS A 6 8.445 13.203 -20.374 1.00 0.00 C ATOM 90 CD LYS A 6 9.475 14.107 -21.034 1.00 0.00 C ATOM 91 CE LYS A 6 10.532 14.568 -20.044 1.00 0.00 C ATOM 92 NZ LYS A 6 11.842 14.816 -20.705 1.00 0.00 N ATOM 0 H LYS A 6 4.612 14.546 -19.782 1.00 0.00 H new ATOM 0 HA LYS A 6 6.013 11.990 -20.241 1.00 0.00 H new ATOM 0 HB2 LYS A 6 6.787 14.148 -21.342 1.00 0.00 H new ATOM 0 HB3 LYS A 6 7.135 14.772 -19.741 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.766 12.963 -19.360 1.00 0.00 H new ATOM 0 HG3 LYS A 6 8.383 12.262 -20.920 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.953 13.575 -21.856 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.975 14.975 -21.464 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.195 15.481 -19.552 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.655 13.814 -19.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 12.535 15.129 -19.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 12.176 13.939 -21.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.731 15.554 -21.429 1.00 0.00 H new ATOM 106 N ILE A 7 6.059 13.815 -17.477 1.00 0.00 N ATOM 107 CA ILE A 7 6.263 13.748 -16.034 1.00 0.00 C ATOM 108 C ILE A 7 4.931 13.686 -15.295 1.00 0.00 C ATOM 109 O ILE A 7 4.396 14.712 -14.874 1.00 0.00 O ATOM 110 CB ILE A 7 7.063 14.962 -15.525 1.00 0.00 C ATOM 111 CG1 ILE A 7 8.312 15.175 -16.383 1.00 0.00 C ATOM 112 CG2 ILE A 7 7.443 14.771 -14.064 1.00 0.00 C ATOM 113 CD1 ILE A 7 8.899 16.565 -16.259 1.00 0.00 C ATOM 0 H ILE A 7 5.782 14.734 -17.822 1.00 0.00 H new ATOM 0 HA ILE A 7 6.830 12.838 -15.835 1.00 0.00 H new ATOM 0 HB ILE A 7 6.436 15.850 -15.604 1.00 0.00 H new ATOM 0 HG12 ILE A 7 9.068 14.443 -16.098 1.00 0.00 H new ATOM 0 HG13 ILE A 7 8.063 14.986 -17.427 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.008 15.637 -13.719 1.00 0.00 H new ATOM 0 HG22 ILE A 7 6.539 14.664 -13.464 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.054 13.875 -13.961 1.00 0.00 H new ATOM 0 HD11 ILE A 7 9.781 16.645 -16.894 1.00 0.00 H new ATOM 0 HD12 ILE A 7 8.159 17.302 -16.571 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.180 16.750 -15.222 1.00 0.00 H new ATOM 125 N ALA A 8 4.398 12.479 -15.141 1.00 0.00 N ATOM 126 CA ALA A 8 3.127 12.289 -14.453 1.00 0.00 C ATOM 127 C ALA A 8 2.965 10.850 -13.972 1.00 0.00 C ATOM 128 O ALA A 8 3.867 10.027 -14.120 1.00 0.00 O ATOM 129 CB ALA A 8 1.972 12.679 -15.365 1.00 0.00 C ATOM 0 H ALA A 8 4.826 11.619 -15.483 1.00 0.00 H new ATOM 0 HA ALA A 8 3.119 12.935 -13.575 1.00 0.00 H new ATOM 0 HB1 ALA A 8 1.028 12.533 -14.840 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.070 13.727 -15.649 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.989 12.057 -16.260 1.00 0.00 H new ATOM 135 N LYS A 9 1.805 10.555 -13.400 1.00 0.00 N ATOM 136 CA LYS A 9 1.519 9.217 -12.894 1.00 0.00 C ATOM 137 C LYS A 9 1.250 8.250 -14.039 1.00 0.00 C ATOM 138 O LYS A 9 0.406 8.509 -14.898 1.00 0.00 O ATOM 139 CB LYS A 9 0.318 9.255 -11.959 1.00 0.00 C ATOM 140 CG LYS A 9 -0.912 9.790 -12.638 1.00 0.00 C ATOM 141 CD LYS A 9 -1.781 10.601 -11.688 1.00 0.00 C ATOM 142 CE LYS A 9 -2.012 12.011 -12.206 1.00 0.00 C ATOM 143 NZ LYS A 9 -2.893 12.023 -13.407 1.00 0.00 N ATOM 0 H LYS A 9 1.046 11.224 -13.274 1.00 0.00 H new ATOM 0 HA LYS A 9 2.393 8.868 -12.344 1.00 0.00 H new ATOM 0 HB2 LYS A 9 0.118 8.250 -11.586 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.552 9.875 -11.094 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.618 10.414 -13.482 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.493 8.961 -13.042 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.740 10.100 -11.554 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.306 10.646 -10.708 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -2.461 12.618 -11.420 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -1.054 12.469 -12.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -3.026 13.003 -13.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.453 11.465 -14.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.816 11.610 -13.165 1.00 0.00 H new ATOM 157 N LYS A 10 1.972 7.134 -14.048 1.00 0.00 N ATOM 158 CA LYS A 10 1.810 6.130 -15.088 1.00 0.00 C ATOM 159 C LYS A 10 1.134 4.886 -14.519 1.00 0.00 C ATOM 160 O LYS A 10 1.512 4.395 -13.461 1.00 0.00 O ATOM 161 CB LYS A 10 3.173 5.768 -15.684 1.00 0.00 C ATOM 162 CG LYS A 10 3.867 6.928 -16.380 1.00 0.00 C ATOM 163 CD LYS A 10 5.341 7.001 -16.004 1.00 0.00 C ATOM 164 CE LYS A 10 6.194 7.453 -17.178 1.00 0.00 C ATOM 165 NZ LYS A 10 6.679 6.301 -17.988 1.00 0.00 N ATOM 0 H LYS A 10 2.675 6.904 -13.345 1.00 0.00 H new ATOM 0 HA LYS A 10 1.179 6.538 -15.877 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.819 5.395 -14.889 1.00 0.00 H new ATOM 0 HB3 LYS A 10 3.042 4.954 -16.397 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.771 6.816 -17.460 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.375 7.863 -16.111 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.471 7.692 -15.171 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.679 6.023 -15.663 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.613 8.124 -17.812 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.047 8.022 -16.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.257 6.651 -18.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.254 5.674 -17.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.865 5.772 -18.362 1.00 0.00 H new ATOM 179 N LYS A 11 0.129 4.378 -15.217 1.00 0.00 N ATOM 180 CA LYS A 11 -0.580 3.194 -14.745 1.00 0.00 C ATOM 181 C LYS A 11 0.364 2.003 -14.679 1.00 0.00 C ATOM 182 O LYS A 11 0.772 1.462 -15.707 1.00 0.00 O ATOM 183 CB LYS A 11 -1.761 2.876 -15.659 1.00 0.00 C ATOM 184 CG LYS A 11 -2.832 3.954 -15.666 1.00 0.00 C ATOM 185 CD LYS A 11 -3.781 3.803 -14.489 1.00 0.00 C ATOM 186 CE LYS A 11 -4.809 4.922 -14.454 1.00 0.00 C ATOM 187 NZ LYS A 11 -5.770 4.760 -13.327 1.00 0.00 N ATOM 0 H LYS A 11 -0.212 4.759 -16.100 1.00 0.00 H new ATOM 0 HA LYS A 11 -0.960 3.398 -13.744 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.395 2.733 -16.676 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.209 1.933 -15.346 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.361 4.936 -15.632 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.395 3.903 -16.598 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.291 2.842 -14.552 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.212 3.801 -13.559 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.299 5.881 -14.361 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.356 4.942 -15.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.737 4.931 -13.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.702 3.793 -12.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.542 5.442 -12.576 1.00 0.00 H new ATOM 201 N THR A 12 0.716 1.602 -13.461 1.00 0.00 N ATOM 202 CA THR A 12 1.622 0.479 -13.268 1.00 0.00 C ATOM 203 C THR A 12 0.939 -0.671 -12.537 1.00 0.00 C ATOM 204 O THR A 12 0.070 -0.451 -11.694 1.00 0.00 O ATOM 205 CB THR A 12 2.862 0.921 -12.494 1.00 0.00 C ATOM 206 OG1 THR A 12 3.512 1.992 -13.154 1.00 0.00 O ATOM 207 CG2 THR A 12 3.877 -0.187 -12.306 1.00 0.00 C ATOM 0 H THR A 12 0.389 2.037 -12.598 1.00 0.00 H new ATOM 0 HA THR A 12 1.921 0.125 -14.255 1.00 0.00 H new ATOM 0 HB THR A 12 2.496 1.227 -11.514 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.994 2.537 -12.497 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.733 0.194 -11.749 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.421 -1.008 -11.753 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.209 -0.545 -13.280 1.00 0.00 H new ATOM 215 N THR A 13 1.342 -1.898 -12.858 1.00 0.00 N ATOM 216 CA THR A 13 0.766 -3.075 -12.217 1.00 0.00 C ATOM 217 C THR A 13 1.702 -3.651 -11.170 1.00 0.00 C ATOM 218 O THR A 13 2.921 -3.663 -11.338 1.00 0.00 O ATOM 219 CB THR A 13 0.442 -4.164 -13.237 1.00 0.00 C ATOM 220 OG1 THR A 13 0.262 -3.616 -14.530 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.801 -4.947 -12.882 1.00 0.00 C ATOM 0 H THR A 13 2.060 -2.102 -13.553 1.00 0.00 H new ATOM 0 HA THR A 13 -0.155 -2.746 -11.736 1.00 0.00 H new ATOM 0 HB THR A 13 1.297 -4.839 -13.225 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.057 -4.335 -15.164 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.982 -5.707 -13.642 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.664 -5.428 -11.914 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.655 -4.272 -12.834 1.00 0.00 H new ATOM 229 N LEU A 14 1.111 -4.149 -10.097 1.00 0.00 N ATOM 230 CA LEU A 14 1.858 -4.761 -9.013 1.00 0.00 C ATOM 231 C LEU A 14 1.067 -5.944 -8.476 1.00 0.00 C ATOM 232 O LEU A 14 -0.134 -5.829 -8.231 1.00 0.00 O ATOM 233 CB LEU A 14 2.135 -3.737 -7.908 1.00 0.00 C ATOM 234 CG LEU A 14 2.598 -2.358 -8.399 1.00 0.00 C ATOM 235 CD1 LEU A 14 1.892 -1.250 -7.638 1.00 0.00 C ATOM 236 CD2 LEU A 14 4.108 -2.217 -8.267 1.00 0.00 C ATOM 0 H LEU A 14 0.101 -4.140 -9.954 1.00 0.00 H new ATOM 0 HA LEU A 14 2.821 -5.113 -9.383 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.228 -3.609 -7.317 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.896 -4.142 -7.241 1.00 0.00 H new ATOM 0 HG LEU A 14 2.336 -2.270 -9.453 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.236 -0.282 -8.003 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.816 -1.333 -7.789 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.117 -1.338 -6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.414 -1.232 -8.621 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.394 -2.332 -7.222 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.599 -2.986 -8.864 1.00 0.00 H new ATOM 248 N ALA A 15 1.719 -7.094 -8.332 1.00 0.00 N ATOM 249 CA ALA A 15 1.021 -8.284 -7.868 1.00 0.00 C ATOM 250 C ALA A 15 0.984 -8.393 -6.358 1.00 0.00 C ATOM 251 O ALA A 15 1.882 -8.958 -5.736 1.00 0.00 O ATOM 252 CB ALA A 15 1.650 -9.531 -8.471 1.00 0.00 C ATOM 0 H ALA A 15 2.712 -7.225 -8.526 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.012 -8.196 -8.203 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.119 -10.414 -8.116 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.586 -9.481 -9.558 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.696 -9.592 -8.171 1.00 0.00 H new ATOM 258 N PHE A 16 -0.109 -7.897 -5.794 1.00 0.00 N ATOM 259 CA PHE A 16 -0.358 -7.971 -4.371 1.00 0.00 C ATOM 260 C PHE A 16 -1.819 -7.735 -4.070 1.00 0.00 C ATOM 261 O PHE A 16 -2.602 -7.394 -4.948 1.00 0.00 O ATOM 262 CB PHE A 16 0.498 -7.011 -3.558 1.00 0.00 C ATOM 263 CG PHE A 16 0.460 -5.571 -4.004 1.00 0.00 C ATOM 264 CD1 PHE A 16 -0.402 -5.143 -5.004 1.00 0.00 C ATOM 265 CD2 PHE A 16 1.299 -4.641 -3.410 1.00 0.00 C ATOM 266 CE1 PHE A 16 -0.423 -3.819 -5.398 1.00 0.00 C ATOM 267 CE2 PHE A 16 1.280 -3.319 -3.800 1.00 0.00 C ATOM 268 CZ PHE A 16 0.419 -2.907 -4.795 1.00 0.00 C ATOM 0 H PHE A 16 -0.849 -7.430 -6.319 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.078 -8.980 -4.070 1.00 0.00 H new ATOM 0 HB2 PHE A 16 0.179 -7.059 -2.517 1.00 0.00 H new ATOM 0 HB3 PHE A 16 1.531 -7.356 -3.591 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -1.063 -5.852 -5.479 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.977 -4.957 -2.631 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.098 -3.498 -6.178 1.00 0.00 H new ATOM 0 HE2 PHE A 16 1.939 -2.606 -3.326 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.404 -1.872 -5.102 1.00 0.00 H new ATOM 278 N ASP A 17 -2.165 -7.909 -2.813 1.00 0.00 N ATOM 279 CA ASP A 17 -3.520 -7.708 -2.339 1.00 0.00 C ATOM 280 C ASP A 17 -3.712 -8.461 -1.057 1.00 0.00 C ATOM 281 O ASP A 17 -4.396 -8.006 -0.148 1.00 0.00 O ATOM 282 CB ASP A 17 -4.561 -8.167 -3.349 1.00 0.00 C ATOM 283 CG ASP A 17 -5.132 -7.020 -4.164 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.218 -7.196 -4.756 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.492 -5.948 -4.208 1.00 0.00 O ATOM 0 H ASP A 17 -1.511 -8.196 -2.085 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.659 -6.638 -2.185 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.111 -8.897 -4.022 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.371 -8.674 -2.825 1.00 0.00 H new ATOM 290 N GLU A 18 -3.092 -9.617 -0.973 1.00 0.00 N ATOM 291 CA GLU A 18 -3.213 -10.406 0.225 1.00 0.00 C ATOM 292 C GLU A 18 -2.994 -9.514 1.443 1.00 0.00 C ATOM 293 O GLU A 18 -3.915 -9.264 2.231 1.00 0.00 O ATOM 294 CB GLU A 18 -2.203 -11.553 0.223 1.00 0.00 C ATOM 295 CG GLU A 18 -2.692 -12.796 0.948 1.00 0.00 C ATOM 296 CD GLU A 18 -2.587 -12.669 2.455 1.00 0.00 C ATOM 297 OE1 GLU A 18 -1.486 -12.903 2.997 1.00 0.00 O ATOM 298 OE2 GLU A 18 -3.607 -12.334 3.094 1.00 0.00 O ATOM 0 H GLU A 18 -2.510 -10.023 -1.706 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.214 -10.837 0.264 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.965 -11.814 -0.808 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.278 -11.212 0.688 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.730 -12.988 0.674 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.111 -13.657 0.618 1.00 0.00 H new ATOM 305 N ASP A 19 -1.776 -9.004 1.565 1.00 0.00 N ATOM 306 CA ASP A 19 -1.432 -8.122 2.672 1.00 0.00 C ATOM 307 C ASP A 19 -1.798 -6.678 2.370 1.00 0.00 C ATOM 308 O ASP A 19 -2.384 -5.995 3.210 1.00 0.00 O ATOM 309 CB ASP A 19 0.060 -8.229 2.994 1.00 0.00 C ATOM 310 CG ASP A 19 0.438 -9.592 3.537 1.00 0.00 C ATOM 311 OD1 ASP A 19 0.060 -9.899 4.687 1.00 0.00 O ATOM 312 OD2 ASP A 19 1.111 -10.354 2.812 1.00 0.00 O ATOM 0 H ASP A 19 -1.012 -9.185 0.914 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.010 -8.440 3.540 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.639 -8.027 2.093 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.327 -7.464 3.723 1.00 0.00 H new ATOM 317 N VAL A 20 -1.457 -6.206 1.177 1.00 0.00 N ATOM 318 CA VAL A 20 -1.769 -4.836 0.811 1.00 0.00 C ATOM 319 C VAL A 20 -3.277 -4.606 0.808 1.00 0.00 C ATOM 320 O VAL A 20 -3.747 -3.618 1.353 1.00 0.00 O ATOM 321 CB VAL A 20 -1.161 -4.434 -0.549 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.321 -4.765 -0.586 1.00 0.00 C ATOM 323 CG2 VAL A 20 -1.883 -5.111 -1.697 1.00 0.00 C ATOM 0 H VAL A 20 -0.972 -6.744 0.459 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.314 -4.198 1.568 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.284 -3.357 -0.665 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.735 -4.475 -1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.835 -4.221 0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.458 -5.836 -0.439 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.431 -4.807 -2.641 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.805 -6.193 -1.589 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.934 -4.821 -1.688 1.00 0.00 H new ATOM 333 N TYR A 21 -4.042 -5.526 0.217 1.00 0.00 N ATOM 334 CA TYR A 21 -5.495 -5.373 0.195 1.00 0.00 C ATOM 335 C TYR A 21 -6.052 -5.418 1.612 1.00 0.00 C ATOM 336 O TYR A 21 -6.869 -4.575 1.981 1.00 0.00 O ATOM 337 CB TYR A 21 -6.182 -6.435 -0.677 1.00 0.00 C ATOM 338 CG TYR A 21 -7.499 -5.976 -1.259 1.00 0.00 C ATOM 339 CD1 TYR A 21 -8.679 -6.099 -0.537 1.00 0.00 C ATOM 340 CD2 TYR A 21 -7.562 -5.417 -2.529 1.00 0.00 C ATOM 341 CE1 TYR A 21 -9.886 -5.681 -1.064 1.00 0.00 C ATOM 342 CE2 TYR A 21 -8.764 -4.995 -3.064 1.00 0.00 C ATOM 343 CZ TYR A 21 -9.923 -5.130 -2.328 1.00 0.00 C ATOM 344 OH TYR A 21 -11.122 -4.711 -2.857 1.00 0.00 O ATOM 0 H TYR A 21 -3.689 -6.366 -0.242 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.709 -4.401 -0.250 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.512 -6.715 -1.490 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.350 -7.331 -0.080 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.653 -6.529 0.453 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.656 -5.310 -3.108 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -10.795 -5.785 -0.490 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -8.796 -4.562 -4.053 1.00 0.00 H new ATOM 0 HH TYR A 21 -10.974 -4.346 -3.754 1.00 0.00 H new ATOM 354 N HIS A 22 -5.604 -6.384 2.423 1.00 0.00 N ATOM 355 CA HIS A 22 -6.089 -6.460 3.798 1.00 0.00 C ATOM 356 C HIS A 22 -5.643 -5.227 4.571 1.00 0.00 C ATOM 357 O HIS A 22 -6.445 -4.591 5.253 1.00 0.00 O ATOM 358 CB HIS A 22 -5.593 -7.734 4.488 1.00 0.00 C ATOM 359 CG HIS A 22 -6.695 -8.656 4.907 1.00 0.00 C ATOM 360 ND1 HIS A 22 -7.305 -8.589 6.141 1.00 0.00 N ATOM 361 CD2 HIS A 22 -7.298 -9.673 4.246 1.00 0.00 C ATOM 362 CE1 HIS A 22 -8.234 -9.525 6.224 1.00 0.00 C ATOM 363 NE2 HIS A 22 -8.250 -10.196 5.086 1.00 0.00 N ATOM 0 H HIS A 22 -4.928 -7.101 2.159 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.178 -6.495 3.779 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -4.923 -8.266 3.813 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -5.008 -7.458 5.365 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.072 -10.010 3.245 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -8.871 -9.710 7.076 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -8.869 -10.976 4.867 1.00 0.00 H new ATOM 372 N THR A 23 -4.367 -4.874 4.444 1.00 0.00 N ATOM 373 CA THR A 23 -3.851 -3.693 5.122 1.00 0.00 C ATOM 374 C THR A 23 -4.562 -2.453 4.603 1.00 0.00 C ATOM 375 O THR A 23 -5.021 -1.617 5.377 1.00 0.00 O ATOM 376 CB THR A 23 -2.347 -3.553 4.917 1.00 0.00 C ATOM 377 OG1 THR A 23 -2.026 -3.556 3.538 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.543 -4.649 5.582 1.00 0.00 C ATOM 0 H THR A 23 -3.681 -5.382 3.886 1.00 0.00 H new ATOM 0 HA THR A 23 -4.038 -3.802 6.190 1.00 0.00 H new ATOM 0 HB THR A 23 -2.082 -2.603 5.381 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.656 -4.429 3.290 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.482 -4.486 5.395 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.728 -4.636 6.656 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.839 -5.616 5.175 1.00 0.00 H new ATOM 386 N LEU A 24 -4.685 -2.359 3.278 1.00 0.00 N ATOM 387 CA LEU A 24 -5.379 -1.235 2.657 1.00 0.00 C ATOM 388 C LEU A 24 -6.777 -1.100 3.249 1.00 0.00 C ATOM 389 O LEU A 24 -7.402 -0.044 3.155 1.00 0.00 O ATOM 390 CB LEU A 24 -5.469 -1.417 1.135 1.00 0.00 C ATOM 391 CG LEU A 24 -4.433 -0.635 0.315 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.311 0.794 0.815 1.00 0.00 C ATOM 393 CD2 LEU A 24 -3.078 -1.323 0.352 1.00 0.00 C ATOM 0 H LEU A 24 -4.315 -3.044 2.619 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.811 -0.327 2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.363 -2.477 0.906 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.465 -1.119 0.809 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.779 -0.610 -0.718 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.571 1.327 0.218 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.276 1.294 0.727 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.999 0.789 1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.362 -0.749 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.731 -1.388 1.383 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.168 -2.326 -0.064 1.00 0.00 H new ATOM 405 N LYS A 25 -7.261 -2.178 3.864 1.00 0.00 N ATOM 406 CA LYS A 25 -8.577 -2.178 4.471 1.00 0.00 C ATOM 407 C LYS A 25 -8.618 -1.288 5.707 1.00 0.00 C ATOM 408 O LYS A 25 -9.516 -0.459 5.847 1.00 0.00 O ATOM 409 CB LYS A 25 -9.007 -3.601 4.835 1.00 0.00 C ATOM 410 CG LYS A 25 -10.496 -3.736 5.116 1.00 0.00 C ATOM 411 CD LYS A 25 -11.336 -3.197 3.967 1.00 0.00 C ATOM 412 CE LYS A 25 -12.046 -1.908 4.351 1.00 0.00 C ATOM 413 NZ LYS A 25 -12.718 -1.276 3.182 1.00 0.00 N ATOM 0 H LYS A 25 -6.756 -3.060 3.951 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.276 -1.776 3.737 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.738 -4.272 4.020 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.449 -3.926 5.713 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.741 -4.785 5.285 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.744 -3.199 6.031 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.698 -3.018 3.102 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.072 -3.945 3.671 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.784 -2.117 5.125 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.326 -1.210 4.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.190 -0.400 3.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.010 -1.053 2.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.423 -1.932 2.790 1.00 0.00 H new ATOM 427 N LEU A 26 -7.649 -1.452 6.606 1.00 0.00 N ATOM 428 CA LEU A 26 -7.618 -0.635 7.815 1.00 0.00 C ATOM 429 C LEU A 26 -7.281 0.808 7.465 1.00 0.00 C ATOM 430 O LEU A 26 -7.906 1.740 7.967 1.00 0.00 O ATOM 431 CB LEU A 26 -6.649 -1.193 8.864 1.00 0.00 C ATOM 432 CG LEU A 26 -5.306 -1.673 8.335 1.00 0.00 C ATOM 433 CD1 LEU A 26 -4.392 -0.490 8.080 1.00 0.00 C ATOM 434 CD2 LEU A 26 -4.666 -2.651 9.309 1.00 0.00 C ATOM 0 H LEU A 26 -6.890 -2.129 6.523 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.612 -0.664 8.262 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.469 -0.421 9.612 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.135 -2.024 9.375 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.468 -2.194 7.391 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.434 -0.846 7.702 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.850 0.171 7.344 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.235 0.056 9.010 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.706 -2.983 8.913 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.512 -2.159 10.270 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.321 -3.512 9.443 1.00 0.00 H new ATOM 446 N VAL A 27 -6.313 0.985 6.576 1.00 0.00 N ATOM 447 CA VAL A 27 -5.916 2.320 6.130 1.00 0.00 C ATOM 448 C VAL A 27 -7.043 2.989 5.374 1.00 0.00 C ATOM 449 O VAL A 27 -7.319 4.166 5.574 1.00 0.00 O ATOM 450 CB VAL A 27 -4.673 2.293 5.223 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.425 2.691 5.990 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.495 0.946 4.602 1.00 0.00 C ATOM 0 H VAL A 27 -5.787 0.224 6.148 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.676 2.882 7.033 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.830 3.022 4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.563 2.663 5.323 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.546 3.700 6.383 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.268 1.996 6.815 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.610 0.953 3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.373 0.198 5.385 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.372 0.703 4.001 1.00 0.00 H new ATOM 462 N SER A 28 -7.693 2.249 4.492 1.00 0.00 N ATOM 463 CA SER A 28 -8.776 2.825 3.720 1.00 0.00 C ATOM 464 C SER A 28 -9.926 3.246 4.625 1.00 0.00 C ATOM 465 O SER A 28 -10.551 4.287 4.410 1.00 0.00 O ATOM 466 CB SER A 28 -9.271 1.846 2.654 1.00 0.00 C ATOM 467 OG SER A 28 -9.781 0.663 3.244 1.00 0.00 O ATOM 0 H SER A 28 -7.494 1.268 4.296 1.00 0.00 H new ATOM 0 HA SER A 28 -8.389 3.712 3.219 1.00 0.00 H new ATOM 0 HB2 SER A 28 -10.047 2.320 2.053 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.453 1.596 1.978 1.00 0.00 H new ATOM 0 HG SER A 28 -9.041 0.135 3.610 1.00 0.00 H new ATOM 473 N VAL A 29 -10.195 2.437 5.643 1.00 0.00 N ATOM 474 CA VAL A 29 -11.261 2.720 6.586 1.00 0.00 C ATOM 475 C VAL A 29 -10.836 3.805 7.567 1.00 0.00 C ATOM 476 O VAL A 29 -11.579 4.751 7.830 1.00 0.00 O ATOM 477 CB VAL A 29 -11.654 1.430 7.344 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.363 1.529 8.833 1.00 0.00 C ATOM 479 CG2 VAL A 29 -13.115 1.083 7.099 1.00 0.00 C ATOM 0 H VAL A 29 -9.684 1.575 5.834 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.128 3.081 6.033 1.00 0.00 H new ATOM 0 HB VAL A 29 -11.035 0.624 6.949 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.655 0.600 9.323 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.297 1.700 8.985 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.928 2.358 9.260 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.369 0.172 7.642 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.746 1.901 7.447 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.278 0.927 6.033 1.00 0.00 H new ATOM 489 N TYR A 30 -9.637 3.648 8.112 1.00 0.00 N ATOM 490 CA TYR A 30 -9.108 4.606 9.077 1.00 0.00 C ATOM 491 C TYR A 30 -8.657 5.898 8.403 1.00 0.00 C ATOM 492 O TYR A 30 -8.610 6.948 9.043 1.00 0.00 O ATOM 493 CB TYR A 30 -7.945 3.997 9.863 1.00 0.00 C ATOM 494 CG TYR A 30 -8.382 3.209 11.079 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.701 1.860 10.980 1.00 0.00 C ATOM 496 CD2 TYR A 30 -8.478 3.816 12.325 1.00 0.00 C ATOM 497 CE1 TYR A 30 -9.101 1.139 12.088 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.877 3.102 13.438 1.00 0.00 C ATOM 499 CZ TYR A 30 -9.187 1.763 13.314 1.00 0.00 C ATOM 500 OH TYR A 30 -9.584 1.048 14.421 1.00 0.00 O ATOM 0 H TYR A 30 -9.013 2.869 7.904 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.917 4.848 9.765 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -7.374 3.344 9.203 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -7.274 4.795 10.180 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -8.635 1.367 10.021 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -8.237 4.864 12.425 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.345 0.091 11.994 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -8.946 3.589 14.400 1.00 0.00 H new ATOM 0 HH TYR A 30 -9.591 1.636 15.205 1.00 0.00 H new ATOM 510 N LEU A 31 -8.324 5.831 7.113 1.00 0.00 N ATOM 511 CA LEU A 31 -7.884 7.022 6.397 1.00 0.00 C ATOM 512 C LEU A 31 -8.968 7.510 5.437 1.00 0.00 C ATOM 513 O LEU A 31 -8.788 8.517 4.752 1.00 0.00 O ATOM 514 CB LEU A 31 -6.583 6.754 5.619 1.00 0.00 C ATOM 515 CG LEU A 31 -5.462 6.001 6.365 1.00 0.00 C ATOM 516 CD1 LEU A 31 -4.112 6.641 6.076 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.705 5.952 7.868 1.00 0.00 C ATOM 0 H LEU A 31 -8.351 4.979 6.553 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.692 7.797 7.139 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.835 6.186 4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.184 7.712 5.286 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.463 4.975 5.998 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.331 6.099 6.609 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.913 6.604 5.005 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.123 7.680 6.407 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.890 5.412 8.351 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.752 6.967 8.262 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.647 5.441 8.068 1.00 0.00 H new ATOM 529 N ASN A 32 -10.091 6.789 5.380 1.00 0.00 N ATOM 530 CA ASN A 32 -11.187 7.159 4.491 1.00 0.00 C ATOM 531 C ASN A 32 -10.658 7.385 3.081 1.00 0.00 C ATOM 532 O ASN A 32 -11.149 8.242 2.346 1.00 0.00 O ATOM 533 CB ASN A 32 -11.887 8.421 4.998 1.00 0.00 C ATOM 534 CG ASN A 32 -13.335 8.497 4.555 1.00 0.00 C ATOM 535 OD1 ASN A 32 -14.070 7.512 4.620 1.00 0.00 O ATOM 536 ND2 ASN A 32 -13.754 9.673 4.100 1.00 0.00 N ATOM 0 H ASN A 32 -10.261 5.951 5.937 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.912 6.345 4.474 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.841 8.446 6.087 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -11.353 9.300 4.636 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.719 9.785 3.788 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.111 10.464 4.063 1.00 0.00 H new ATOM 543 N ARG A 33 -9.640 6.612 2.724 1.00 0.00 N ATOM 544 CA ARG A 33 -9.017 6.722 1.411 1.00 0.00 C ATOM 545 C ARG A 33 -9.159 5.426 0.628 1.00 0.00 C ATOM 546 O ARG A 33 -9.572 4.401 1.171 1.00 0.00 O ATOM 547 CB ARG A 33 -7.533 7.069 1.566 1.00 0.00 C ATOM 548 CG ARG A 33 -7.289 8.469 2.106 1.00 0.00 C ATOM 549 CD ARG A 33 -6.147 9.160 1.378 1.00 0.00 C ATOM 550 NE ARG A 33 -6.615 9.927 0.226 1.00 0.00 N ATOM 551 CZ ARG A 33 -7.241 11.098 0.321 1.00 0.00 C ATOM 552 NH1 ARG A 33 -7.474 11.639 1.510 1.00 0.00 N ATOM 553 NH2 ARG A 33 -7.634 11.730 -0.777 1.00 0.00 N ATOM 0 H ARG A 33 -9.227 5.900 3.327 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.523 7.515 0.860 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -7.067 6.345 2.234 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -7.042 6.971 0.598 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -8.198 9.062 2.004 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -7.062 8.414 3.171 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -5.627 9.824 2.068 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.424 8.414 1.047 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.453 9.543 -0.705 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -7.173 11.157 2.357 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.954 12.536 1.577 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -7.457 11.319 -1.693 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.114 12.627 -0.705 1.00 0.00 H new ATOM 567 N ASP A 34 -8.792 5.473 -0.646 1.00 0.00 N ATOM 568 CA ASP A 34 -8.854 4.297 -1.500 1.00 0.00 C ATOM 569 C ASP A 34 -7.530 3.551 -1.428 1.00 0.00 C ATOM 570 O ASP A 34 -6.513 4.123 -1.041 1.00 0.00 O ATOM 571 CB ASP A 34 -9.167 4.695 -2.945 1.00 0.00 C ATOM 572 CG ASP A 34 -10.463 4.088 -3.443 1.00 0.00 C ATOM 573 OD1 ASP A 34 -10.633 2.858 -3.307 1.00 0.00 O ATOM 574 OD2 ASP A 34 -11.308 4.842 -3.969 1.00 0.00 O ATOM 0 H ASP A 34 -8.448 6.314 -1.110 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.654 3.644 -1.151 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.227 5.781 -3.015 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.349 4.379 -3.592 1.00 0.00 H new ATOM 579 N MET A 35 -7.540 2.276 -1.793 1.00 0.00 N ATOM 580 CA MET A 35 -6.329 1.479 -1.750 1.00 0.00 C ATOM 581 C MET A 35 -5.244 2.104 -2.625 1.00 0.00 C ATOM 582 O MET A 35 -4.061 2.048 -2.295 1.00 0.00 O ATOM 583 CB MET A 35 -6.633 0.039 -2.179 1.00 0.00 C ATOM 584 CG MET A 35 -5.627 -0.536 -3.156 1.00 0.00 C ATOM 585 SD MET A 35 -5.898 -2.288 -3.490 1.00 0.00 S ATOM 586 CE MET A 35 -4.238 -2.811 -3.915 1.00 0.00 C ATOM 0 H MET A 35 -8.368 1.778 -2.119 1.00 0.00 H new ATOM 0 HA MET A 35 -5.954 1.457 -0.727 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.667 -0.594 -1.293 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.624 0.007 -2.632 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.678 0.020 -4.092 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.622 -0.398 -2.758 1.00 0.00 H new ATOM 0 HE1 MET A 35 -4.286 -3.705 -4.537 1.00 0.00 H new ATOM 0 HE2 MET A 35 -3.734 -2.014 -4.463 1.00 0.00 H new ATOM 0 HE3 MET A 35 -3.682 -3.033 -3.004 1.00 0.00 H new ATOM 596 N THR A 36 -5.658 2.709 -3.733 1.00 0.00 N ATOM 597 CA THR A 36 -4.719 3.353 -4.641 1.00 0.00 C ATOM 598 C THR A 36 -4.299 4.710 -4.086 1.00 0.00 C ATOM 599 O THR A 36 -3.170 5.152 -4.290 1.00 0.00 O ATOM 600 CB THR A 36 -5.338 3.514 -6.034 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.443 2.644 -6.195 1.00 0.00 O ATOM 602 CG2 THR A 36 -4.371 3.241 -7.168 1.00 0.00 C ATOM 0 H THR A 36 -6.634 2.766 -4.022 1.00 0.00 H new ATOM 0 HA THR A 36 -3.835 2.721 -4.731 1.00 0.00 H new ATOM 0 HB THR A 36 -5.642 4.559 -6.088 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.825 2.763 -7.089 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.881 3.375 -8.122 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.532 3.934 -7.105 1.00 0.00 H new ATOM 0 HG23 THR A 36 -4.003 2.218 -7.094 1.00 0.00 H new ATOM 610 N GLU A 37 -5.210 5.357 -3.365 1.00 0.00 N ATOM 611 CA GLU A 37 -4.922 6.653 -2.761 1.00 0.00 C ATOM 612 C GLU A 37 -4.006 6.466 -1.557 1.00 0.00 C ATOM 613 O GLU A 37 -3.075 7.240 -1.338 1.00 0.00 O ATOM 614 CB GLU A 37 -6.220 7.347 -2.339 1.00 0.00 C ATOM 615 CG GLU A 37 -6.593 8.527 -3.222 1.00 0.00 C ATOM 616 CD GLU A 37 -6.800 8.127 -4.671 1.00 0.00 C ATOM 617 OE1 GLU A 37 -5.805 7.757 -5.332 1.00 0.00 O ATOM 618 OE2 GLU A 37 -7.954 8.183 -5.144 1.00 0.00 O ATOM 0 H GLU A 37 -6.151 5.006 -3.185 1.00 0.00 H new ATOM 0 HA GLU A 37 -4.421 7.283 -3.496 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -7.033 6.621 -2.355 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -6.120 7.691 -1.310 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.505 8.987 -2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.808 9.281 -3.165 1.00 0.00 H new ATOM 625 N ILE A 38 -4.274 5.412 -0.793 1.00 0.00 N ATOM 626 CA ILE A 38 -3.477 5.083 0.382 1.00 0.00 C ATOM 627 C ILE A 38 -2.067 4.682 -0.034 1.00 0.00 C ATOM 628 O ILE A 38 -1.084 5.203 0.484 1.00 0.00 O ATOM 629 CB ILE A 38 -4.096 3.903 1.153 1.00 0.00 C ATOM 630 CG1 ILE A 38 -5.370 4.309 1.900 1.00 0.00 C ATOM 631 CG2 ILE A 38 -3.101 3.301 2.127 1.00 0.00 C ATOM 632 CD1 ILE A 38 -6.538 3.390 1.624 1.00 0.00 C ATOM 0 H ILE A 38 -5.044 4.767 -0.969 1.00 0.00 H new ATOM 0 HA ILE A 38 -3.451 5.968 1.018 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.364 3.152 0.409 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.168 4.319 2.971 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.641 5.326 1.617 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.567 2.470 2.656 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.230 2.940 1.580 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.790 4.060 2.845 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.410 3.731 2.182 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.764 3.399 0.558 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.284 2.376 1.933 1.00 0.00 H new ATOM 644 N ILE A 39 -1.981 3.734 -0.969 1.00 0.00 N ATOM 645 CA ILE A 39 -0.694 3.251 -1.446 1.00 0.00 C ATOM 646 C ILE A 39 0.086 4.368 -2.112 1.00 0.00 C ATOM 647 O ILE A 39 1.297 4.492 -1.928 1.00 0.00 O ATOM 648 CB ILE A 39 -0.858 2.098 -2.452 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.724 2.553 -3.625 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.468 0.878 -1.775 1.00 0.00 C ATOM 651 CD1 ILE A 39 -0.931 3.079 -4.803 1.00 0.00 C ATOM 0 H ILE A 39 -2.788 3.290 -1.407 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.151 2.887 -0.574 1.00 0.00 H new ATOM 0 HB ILE A 39 0.125 1.817 -2.829 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.338 1.716 -3.957 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.405 3.331 -3.281 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.576 0.074 -2.503 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.818 0.549 -0.964 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.447 1.137 -1.373 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.615 3.382 -5.596 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -0.337 3.937 -4.488 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.269 2.297 -5.175 1.00 0.00 H new ATOM 663 N GLU A 40 -0.616 5.182 -2.891 1.00 0.00 N ATOM 664 CA GLU A 40 0.017 6.287 -3.583 1.00 0.00 C ATOM 665 C GLU A 40 0.350 7.402 -2.605 1.00 0.00 C ATOM 666 O GLU A 40 1.288 8.169 -2.821 1.00 0.00 O ATOM 667 CB GLU A 40 -0.877 6.816 -4.707 1.00 0.00 C ATOM 668 CG GLU A 40 -0.122 7.598 -5.768 1.00 0.00 C ATOM 669 CD GLU A 40 -0.998 8.604 -6.486 1.00 0.00 C ATOM 670 OE1 GLU A 40 -0.450 9.571 -7.053 1.00 0.00 O ATOM 671 OE2 GLU A 40 -2.236 8.424 -6.481 1.00 0.00 O ATOM 0 H GLU A 40 -1.619 5.095 -3.056 1.00 0.00 H new ATOM 0 HA GLU A 40 0.942 5.922 -4.029 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.386 5.977 -5.180 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.648 7.455 -4.276 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.716 8.118 -5.303 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.298 6.903 -6.495 1.00 0.00 H new ATOM 678 N GLU A 41 -0.407 7.479 -1.513 1.00 0.00 N ATOM 679 CA GLU A 41 -0.147 8.496 -0.504 1.00 0.00 C ATOM 680 C GLU A 41 0.926 8.001 0.457 1.00 0.00 C ATOM 681 O GLU A 41 1.758 8.773 0.939 1.00 0.00 O ATOM 682 CB GLU A 41 -1.431 8.838 0.257 1.00 0.00 C ATOM 683 CG GLU A 41 -1.212 9.767 1.441 1.00 0.00 C ATOM 684 CD GLU A 41 -2.452 9.916 2.300 1.00 0.00 C ATOM 685 OE1 GLU A 41 -3.286 8.986 2.306 1.00 0.00 O ATOM 686 OE2 GLU A 41 -2.589 10.962 2.969 1.00 0.00 O ATOM 0 H GLU A 41 -1.191 6.860 -1.308 1.00 0.00 H new ATOM 0 HA GLU A 41 0.207 9.402 -0.996 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.138 9.302 -0.431 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.890 7.915 0.611 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -0.395 9.385 2.052 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.906 10.748 1.077 1.00 0.00 H new ATOM 693 N ALA A 42 0.898 6.699 0.721 1.00 0.00 N ATOM 694 CA ALA A 42 1.860 6.076 1.617 1.00 0.00 C ATOM 695 C ALA A 42 3.217 5.938 0.946 1.00 0.00 C ATOM 696 O ALA A 42 4.255 6.128 1.580 1.00 0.00 O ATOM 697 CB ALA A 42 1.351 4.716 2.070 1.00 0.00 C ATOM 0 H ALA A 42 0.215 6.054 0.324 1.00 0.00 H new ATOM 0 HA ALA A 42 1.979 6.716 2.491 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.080 4.260 2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.403 4.838 2.594 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.205 4.074 1.201 1.00 0.00 H new ATOM 703 N VAL A 43 3.207 5.606 -0.341 1.00 0.00 N ATOM 704 CA VAL A 43 4.447 5.445 -1.090 1.00 0.00 C ATOM 705 C VAL A 43 5.297 6.692 -1.005 1.00 0.00 C ATOM 706 O VAL A 43 6.411 6.673 -0.487 1.00 0.00 O ATOM 707 CB VAL A 43 4.185 5.145 -2.587 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.161 6.088 -3.174 1.00 0.00 C ATOM 709 CG2 VAL A 43 5.466 5.241 -3.389 1.00 0.00 C ATOM 0 H VAL A 43 2.359 5.444 -0.884 1.00 0.00 H new ATOM 0 HA VAL A 43 4.968 4.600 -0.639 1.00 0.00 H new ATOM 0 HB VAL A 43 3.796 4.128 -2.643 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.004 5.846 -4.225 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.220 5.985 -2.634 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.519 7.114 -3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.256 5.026 -4.437 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.877 6.247 -3.300 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.189 4.519 -3.008 1.00 0.00 H new ATOM 719 N VAL A 44 4.751 7.770 -1.524 1.00 0.00 N ATOM 720 CA VAL A 44 5.432 9.044 -1.532 1.00 0.00 C ATOM 721 C VAL A 44 5.868 9.422 -0.127 1.00 0.00 C ATOM 722 O VAL A 44 7.052 9.599 0.136 1.00 0.00 O ATOM 723 CB VAL A 44 4.521 10.130 -2.138 1.00 0.00 C ATOM 724 CG1 VAL A 44 4.644 11.464 -1.407 1.00 0.00 C ATOM 725 CG2 VAL A 44 4.808 10.303 -3.620 1.00 0.00 C ATOM 0 H VAL A 44 3.825 7.787 -1.951 1.00 0.00 H new ATOM 0 HA VAL A 44 6.325 8.962 -2.151 1.00 0.00 H new ATOM 0 HB VAL A 44 3.492 9.791 -2.015 1.00 0.00 H new ATOM 0 HG11 VAL A 44 3.983 12.196 -1.871 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.363 11.333 -0.362 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.674 11.817 -1.465 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.155 11.074 -4.030 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.848 10.598 -3.757 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.627 9.361 -4.138 1.00 0.00 H new ATOM 735 N MET A 45 4.910 9.529 0.779 1.00 0.00 N ATOM 736 CA MET A 45 5.229 9.878 2.154 1.00 0.00 C ATOM 737 C MET A 45 6.295 8.943 2.709 1.00 0.00 C ATOM 738 O MET A 45 7.093 9.342 3.558 1.00 0.00 O ATOM 739 CB MET A 45 3.989 9.839 3.043 1.00 0.00 C ATOM 740 CG MET A 45 4.278 10.234 4.483 1.00 0.00 C ATOM 741 SD MET A 45 5.080 11.845 4.615 1.00 0.00 S ATOM 742 CE MET A 45 5.558 11.850 6.342 1.00 0.00 C ATOM 0 H MET A 45 3.918 9.382 0.592 1.00 0.00 H new ATOM 0 HA MET A 45 5.614 10.898 2.152 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.233 10.509 2.633 1.00 0.00 H new ATOM 0 HB3 MET A 45 3.567 8.834 3.025 1.00 0.00 H new ATOM 0 HG2 MET A 45 3.344 10.250 5.045 1.00 0.00 H new ATOM 0 HG3 MET A 45 4.914 9.477 4.942 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.425 12.851 6.753 1.00 0.00 H new ATOM 0 HE2 MET A 45 4.936 11.145 6.894 1.00 0.00 H new ATOM 0 HE3 MET A 45 6.604 11.557 6.431 1.00 0.00 H new ATOM 752 N TRP A 46 6.324 7.701 2.222 1.00 0.00 N ATOM 753 CA TRP A 46 7.321 6.752 2.686 1.00 0.00 C ATOM 754 C TRP A 46 8.689 7.157 2.166 1.00 0.00 C ATOM 755 O TRP A 46 9.611 7.392 2.942 1.00 0.00 O ATOM 756 CB TRP A 46 6.978 5.329 2.240 1.00 0.00 C ATOM 757 CG TRP A 46 7.993 4.312 2.666 1.00 0.00 C ATOM 758 CD1 TRP A 46 9.034 3.832 1.924 1.00 0.00 C ATOM 759 CD2 TRP A 46 8.065 3.650 3.935 1.00 0.00 C ATOM 760 NE1 TRP A 46 9.748 2.912 2.653 1.00 0.00 N ATOM 761 CE2 TRP A 46 9.174 2.783 3.890 1.00 0.00 C ATOM 762 CE3 TRP A 46 7.300 3.706 5.102 1.00 0.00 C ATOM 763 CZ2 TRP A 46 9.535 1.981 4.970 1.00 0.00 C ATOM 764 CZ3 TRP A 46 7.660 2.910 6.173 1.00 0.00 C ATOM 765 CH2 TRP A 46 8.768 2.057 6.100 1.00 0.00 C ATOM 0 H TRP A 46 5.679 7.339 1.520 1.00 0.00 H new ATOM 0 HA TRP A 46 7.332 6.763 3.776 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.005 5.053 2.647 1.00 0.00 H new ATOM 0 HB3 TRP A 46 6.887 5.308 1.154 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.263 4.132 0.912 1.00 0.00 H new ATOM 0 HE1 TRP A 46 10.572 2.407 2.326 1.00 0.00 H new ATOM 0 HE3 TRP A 46 6.443 4.359 5.166 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.390 1.323 4.917 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 7.077 2.947 7.081 1.00 0.00 H new ATOM 0 HH2 TRP A 46 9.022 1.446 6.954 1.00 0.00 H new ATOM 776 N LEU A 47 8.810 7.264 0.849 1.00 0.00 N ATOM 777 CA LEU A 47 10.069 7.671 0.246 1.00 0.00 C ATOM 778 C LEU A 47 10.475 9.033 0.761 1.00 0.00 C ATOM 779 O LEU A 47 11.631 9.273 1.098 1.00 0.00 O ATOM 780 CB LEU A 47 9.971 7.759 -1.276 1.00 0.00 C ATOM 781 CG LEU A 47 8.637 8.244 -1.834 1.00 0.00 C ATOM 782 CD1 LEU A 47 8.677 9.750 -2.023 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.321 7.547 -3.149 1.00 0.00 C ATOM 0 H LEU A 47 8.059 7.076 0.185 1.00 0.00 H new ATOM 0 HA LEU A 47 10.806 6.914 0.515 1.00 0.00 H new ATOM 0 HB2 LEU A 47 10.755 8.427 -1.633 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.179 6.773 -1.691 1.00 0.00 H new ATOM 0 HG LEU A 47 7.847 7.998 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.722 10.092 -2.422 1.00 0.00 H new ATOM 0 HD12 LEU A 47 8.863 10.232 -1.063 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.475 10.008 -2.720 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.366 7.907 -3.531 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.106 7.764 -3.873 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.265 6.471 -2.986 1.00 0.00 H new ATOM 795 N ILE A 48 9.504 9.929 0.788 1.00 0.00 N ATOM 796 CA ILE A 48 9.725 11.284 1.220 1.00 0.00 C ATOM 797 C ILE A 48 10.284 11.336 2.633 1.00 0.00 C ATOM 798 O ILE A 48 11.211 12.095 2.913 1.00 0.00 O ATOM 799 CB ILE A 48 8.409 12.085 1.123 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.542 13.167 0.064 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.017 12.688 2.463 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.433 12.654 -1.354 1.00 0.00 C ATOM 0 H ILE A 48 8.543 9.731 0.510 1.00 0.00 H new ATOM 0 HA ILE A 48 10.467 11.735 0.562 1.00 0.00 H new ATOM 0 HB ILE A 48 7.614 11.398 0.835 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.770 13.919 0.228 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.504 13.665 0.187 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.086 13.244 2.353 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.880 11.891 3.194 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.804 13.361 2.803 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.538 13.486 -2.051 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.221 11.924 -1.539 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.461 12.182 -1.496 1.00 0.00 H new ATOM 814 N GLN A 49 9.711 10.543 3.525 1.00 0.00 N ATOM 815 CA GLN A 49 10.162 10.537 4.903 1.00 0.00 C ATOM 816 C GLN A 49 11.367 9.621 5.109 1.00 0.00 C ATOM 817 O GLN A 49 12.227 9.896 5.946 1.00 0.00 O ATOM 818 CB GLN A 49 9.019 10.120 5.834 1.00 0.00 C ATOM 819 CG GLN A 49 8.728 8.625 5.822 1.00 0.00 C ATOM 820 CD GLN A 49 7.413 8.281 6.495 1.00 0.00 C ATOM 821 OE1 GLN A 49 6.789 9.128 7.134 1.00 0.00 O ATOM 822 NE2 GLN A 49 6.985 7.031 6.353 1.00 0.00 N ATOM 0 H GLN A 49 8.943 9.904 3.321 1.00 0.00 H new ATOM 0 HA GLN A 49 10.476 11.552 5.146 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.263 10.425 6.852 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.116 10.658 5.548 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.708 8.271 4.791 1.00 0.00 H new ATOM 0 HG3 GLN A 49 9.538 8.097 6.325 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.535 6.362 5.814 1.00 0.00 H new ATOM 0 HE22 GLN A 49 6.107 6.741 6.783 1.00 0.00 H new ATOM 831 N ASN A 50 11.409 8.513 4.373 1.00 0.00 N ATOM 832 CA ASN A 50 12.500 7.548 4.525 1.00 0.00 C ATOM 833 C ASN A 50 13.597 7.696 3.475 1.00 0.00 C ATOM 834 O ASN A 50 14.761 7.921 3.804 1.00 0.00 O ATOM 835 CB ASN A 50 11.951 6.121 4.490 1.00 0.00 C ATOM 836 CG ASN A 50 11.499 5.642 5.857 1.00 0.00 C ATOM 837 OD1 ASN A 50 10.935 6.406 6.640 1.00 0.00 O ATOM 838 ND2 ASN A 50 11.749 4.372 6.151 1.00 0.00 N ATOM 0 H ASN A 50 10.711 8.261 3.673 1.00 0.00 H new ATOM 0 HA ASN A 50 12.957 7.758 5.492 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.112 6.074 3.796 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.719 5.448 4.108 1.00 0.00 H new ATOM 0 HD21 ASN A 50 11.471 3.994 7.057 1.00 0.00 H new ATOM 0 HD22 ASN A 50 12.219 3.774 5.471 1.00 0.00 H new ATOM 845 N LYS A 51 13.224 7.525 2.216 1.00 0.00 N ATOM 846 CA LYS A 51 14.179 7.592 1.113 1.00 0.00 C ATOM 847 C LYS A 51 14.854 8.957 1.018 1.00 0.00 C ATOM 848 O LYS A 51 16.080 9.043 0.933 1.00 0.00 O ATOM 849 CB LYS A 51 13.493 7.237 -0.207 1.00 0.00 C ATOM 850 CG LYS A 51 13.400 5.736 -0.460 1.00 0.00 C ATOM 851 CD LYS A 51 12.392 5.065 0.469 1.00 0.00 C ATOM 852 CE LYS A 51 12.970 3.848 1.184 1.00 0.00 C ATOM 853 NZ LYS A 51 14.416 4.004 1.501 1.00 0.00 N ATOM 0 H LYS A 51 12.263 7.338 1.929 1.00 0.00 H new ATOM 0 HA LYS A 51 14.962 6.861 1.315 1.00 0.00 H new ATOM 0 HB2 LYS A 51 12.489 7.661 -0.211 1.00 0.00 H new ATOM 0 HB3 LYS A 51 14.039 7.703 -1.028 1.00 0.00 H new ATOM 0 HG2 LYS A 51 13.112 5.559 -1.496 1.00 0.00 H new ATOM 0 HG3 LYS A 51 14.381 5.282 -0.320 1.00 0.00 H new ATOM 0 HD2 LYS A 51 12.050 5.788 1.210 1.00 0.00 H new ATOM 0 HD3 LYS A 51 11.518 4.761 -0.108 1.00 0.00 H new ATOM 0 HE2 LYS A 51 12.416 3.676 2.107 1.00 0.00 H new ATOM 0 HE3 LYS A 51 12.832 2.965 0.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 14.691 3.306 2.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 14.979 3.853 0.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 14.590 4.963 1.865 1.00 0.00 H new ATOM 867 N GLU A 52 14.060 10.022 1.036 1.00 0.00 N ATOM 868 CA GLU A 52 14.601 11.376 0.955 1.00 0.00 C ATOM 869 C GLU A 52 15.745 11.563 1.948 1.00 0.00 C ATOM 870 O GLU A 52 16.652 12.366 1.727 1.00 0.00 O ATOM 871 CB GLU A 52 13.500 12.403 1.227 1.00 0.00 C ATOM 872 CG GLU A 52 13.817 13.792 0.696 1.00 0.00 C ATOM 873 CD GLU A 52 13.011 14.142 -0.539 1.00 0.00 C ATOM 874 OE1 GLU A 52 12.975 13.320 -1.478 1.00 0.00 O ATOM 875 OE2 GLU A 52 12.414 15.239 -0.567 1.00 0.00 O ATOM 0 H GLU A 52 13.043 9.976 1.106 1.00 0.00 H new ATOM 0 HA GLU A 52 14.989 11.528 -0.052 1.00 0.00 H new ATOM 0 HB2 GLU A 52 12.571 12.055 0.776 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.330 12.464 2.302 1.00 0.00 H new ATOM 0 HG2 GLU A 52 13.620 14.528 1.475 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.880 13.853 0.461 1.00 0.00 H new ATOM 882 N LYS A 53 15.692 10.814 3.045 1.00 0.00 N ATOM 883 CA LYS A 53 16.714 10.885 4.079 1.00 0.00 C ATOM 884 C LYS A 53 17.299 9.505 4.368 1.00 0.00 C ATOM 885 O LYS A 53 17.727 9.232 5.488 1.00 0.00 O ATOM 886 CB LYS A 53 16.133 11.483 5.362 1.00 0.00 C ATOM 887 CG LYS A 53 15.001 10.660 5.958 1.00 0.00 C ATOM 888 CD LYS A 53 15.169 10.479 7.460 1.00 0.00 C ATOM 889 CE LYS A 53 15.543 9.047 7.811 1.00 0.00 C ATOM 890 NZ LYS A 53 14.430 8.098 7.535 1.00 0.00 N ATOM 0 H LYS A 53 14.946 10.147 3.240 1.00 0.00 H new ATOM 0 HA LYS A 53 17.515 11.529 3.715 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.929 11.580 6.101 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.769 12.489 5.152 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.049 11.149 5.754 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.967 9.683 5.475 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.940 11.157 7.825 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.242 10.748 7.966 1.00 0.00 H new ATOM 0 HE2 LYS A 53 16.422 8.751 7.239 1.00 0.00 H new ATOM 0 HE3 LYS A 53 15.815 8.991 8.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 14.278 7.490 8.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 13.561 8.632 7.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.673 7.508 6.714 1.00 0.00 H new ATOM 904 N LEU A 54 17.306 8.635 3.357 1.00 0.00 N ATOM 905 CA LEU A 54 17.826 7.276 3.511 1.00 0.00 C ATOM 906 C LEU A 54 19.247 7.289 4.074 1.00 0.00 C ATOM 907 O LEU A 54 20.210 7.535 3.347 1.00 0.00 O ATOM 908 CB LEU A 54 17.819 6.548 2.165 1.00 0.00 C ATOM 909 CG LEU A 54 18.309 5.097 2.212 1.00 0.00 C ATOM 910 CD1 LEU A 54 17.132 4.142 2.330 1.00 0.00 C ATOM 911 CD2 LEU A 54 19.138 4.773 0.978 1.00 0.00 C ATOM 0 H LEU A 54 16.957 8.848 2.422 1.00 0.00 H new ATOM 0 HA LEU A 54 17.178 6.751 4.212 1.00 0.00 H new ATOM 0 HB2 LEU A 54 16.804 6.560 1.767 1.00 0.00 H new ATOM 0 HB3 LEU A 54 18.443 7.104 1.465 1.00 0.00 H new ATOM 0 HG LEU A 54 18.941 4.975 3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.498 3.116 2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.578 4.358 3.243 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.475 4.266 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 54 19.477 3.738 1.029 1.00 0.00 H new ATOM 0 HD22 LEU A 54 18.530 4.912 0.084 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.002 5.436 0.935 1.00 0.00 H new ATOM 923 N PRO A 55 19.394 7.021 5.386 1.00 0.00 N ATOM 924 CA PRO A 55 20.695 7.002 6.055 1.00 0.00 C ATOM 925 C PRO A 55 21.459 5.707 5.802 1.00 0.00 C ATOM 926 O PRO A 55 20.873 4.689 5.435 1.00 0.00 O ATOM 927 CB PRO A 55 20.347 7.121 7.548 1.00 0.00 C ATOM 928 CG PRO A 55 18.856 7.236 7.627 1.00 0.00 C ATOM 929 CD PRO A 55 18.312 6.718 6.326 1.00 0.00 C ATOM 0 HA PRO A 55 21.341 7.800 5.689 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.699 6.249 8.099 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.828 7.993 7.990 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.468 6.659 8.466 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.556 8.272 7.787 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.101 5.650 6.371 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.382 7.215 6.048 1.00 0.00 H new ATOM 937 N ASN A 56 22.770 5.752 6.017 1.00 0.00 N ATOM 938 CA ASN A 56 23.614 4.579 5.828 1.00 0.00 C ATOM 939 C ASN A 56 23.429 3.598 6.981 1.00 0.00 C ATOM 940 O ASN A 56 23.574 2.387 6.811 1.00 0.00 O ATOM 941 CB ASN A 56 25.084 4.992 5.720 1.00 0.00 C ATOM 942 CG ASN A 56 25.904 4.004 4.914 1.00 0.00 C ATOM 943 OD1 ASN A 56 25.776 2.791 5.080 1.00 0.00 O ATOM 944 ND2 ASN A 56 26.752 4.521 4.032 1.00 0.00 N ATOM 0 H ASN A 56 23.270 6.587 6.322 1.00 0.00 H new ATOM 0 HA ASN A 56 23.318 4.088 4.901 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.149 5.977 5.257 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.508 5.081 6.720 1.00 0.00 H new ATOM 0 HD21 ASN A 56 27.330 3.906 3.459 1.00 0.00 H new ATOM 0 HD22 ASN A 56 26.825 5.533 3.928 1.00 0.00 H new ATOM 951 N GLU A 57 23.104 4.131 8.156 1.00 0.00 N ATOM 952 CA GLU A 57 22.894 3.307 9.342 1.00 0.00 C ATOM 953 C GLU A 57 21.532 2.619 9.297 1.00 0.00 C ATOM 954 O GLU A 57 21.313 1.614 9.974 1.00 0.00 O ATOM 955 CB GLU A 57 23.006 4.160 10.607 1.00 0.00 C ATOM 956 CG GLU A 57 22.173 5.432 10.560 1.00 0.00 C ATOM 957 CD GLU A 57 21.597 5.801 11.913 1.00 0.00 C ATOM 958 OE1 GLU A 57 20.358 5.914 12.020 1.00 0.00 O ATOM 959 OE2 GLU A 57 22.386 5.978 12.865 1.00 0.00 O ATOM 0 H GLU A 57 22.980 5.131 8.312 1.00 0.00 H new ATOM 0 HA GLU A 57 23.667 2.538 9.359 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.696 3.564 11.465 1.00 0.00 H new ATOM 0 HB3 GLU A 57 24.051 4.426 10.764 1.00 0.00 H new ATOM 0 HG2 GLU A 57 22.790 6.253 10.196 1.00 0.00 H new ATOM 0 HG3 GLU A 57 21.360 5.303 9.846 1.00 0.00 H new ATOM 966 N LEU A 58 20.619 3.164 8.497 1.00 0.00 N ATOM 967 CA LEU A 58 19.281 2.597 8.363 1.00 0.00 C ATOM 968 C LEU A 58 19.304 1.365 7.467 1.00 0.00 C ATOM 969 O LEU A 58 18.426 0.510 7.556 1.00 0.00 O ATOM 970 CB LEU A 58 18.318 3.634 7.787 1.00 0.00 C ATOM 971 CG LEU A 58 17.216 4.105 8.740 1.00 0.00 C ATOM 972 CD1 LEU A 58 16.297 5.098 8.046 1.00 0.00 C ATOM 973 CD2 LEU A 58 16.420 2.919 9.264 1.00 0.00 C ATOM 0 H LEU A 58 20.782 3.997 7.932 1.00 0.00 H new ATOM 0 HA LEU A 58 18.938 2.303 9.355 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.894 4.502 7.467 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.850 3.216 6.896 1.00 0.00 H new ATOM 0 HG LEU A 58 17.686 4.605 9.587 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.520 5.421 8.739 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.875 5.963 7.720 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.836 4.623 7.180 1.00 0.00 H new ATOM 0 HD21 LEU A 58 15.641 3.273 9.940 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.962 2.390 8.428 1.00 0.00 H new ATOM 0 HD23 LEU A 58 17.085 2.243 9.800 1.00 0.00 H new ATOM 985 N LYS A 59 20.316 1.286 6.598 1.00 0.00 N ATOM 986 CA LYS A 59 20.466 0.164 5.673 1.00 0.00 C ATOM 987 C LYS A 59 20.056 -1.163 6.317 1.00 0.00 C ATOM 988 O LYS A 59 19.221 -1.885 5.779 1.00 0.00 O ATOM 989 CB LYS A 59 21.911 0.076 5.179 1.00 0.00 C ATOM 990 CG LYS A 59 22.047 -0.558 3.804 1.00 0.00 C ATOM 991 CD LYS A 59 22.242 -2.063 3.901 1.00 0.00 C ATOM 992 CE LYS A 59 23.595 -2.410 4.500 1.00 0.00 C ATOM 993 NZ LYS A 59 24.162 -3.653 3.907 1.00 0.00 N ATOM 0 H LYS A 59 21.047 1.992 6.518 1.00 0.00 H new ATOM 0 HA LYS A 59 19.802 0.345 4.828 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.338 1.078 5.151 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.496 -0.501 5.895 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.157 -0.343 3.213 1.00 0.00 H new ATOM 0 HG3 LYS A 59 22.893 -0.114 3.279 1.00 0.00 H new ATOM 0 HD2 LYS A 59 21.450 -2.495 4.513 1.00 0.00 H new ATOM 0 HD3 LYS A 59 22.157 -2.507 2.909 1.00 0.00 H new ATOM 0 HE2 LYS A 59 24.286 -1.583 4.339 1.00 0.00 H new ATOM 0 HE3 LYS A 59 23.493 -2.535 5.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 25.085 -3.855 4.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 23.515 -4.448 4.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 24.283 -3.525 2.882 1.00 0.00 H new ATOM 1007 N PRO A 60 20.634 -1.505 7.483 1.00 0.00 N ATOM 1008 CA PRO A 60 20.307 -2.753 8.179 1.00 0.00 C ATOM 1009 C PRO A 60 18.823 -2.853 8.512 1.00 0.00 C ATOM 1010 O PRO A 60 18.266 -3.949 8.573 1.00 0.00 O ATOM 1011 CB PRO A 60 21.148 -2.697 9.460 1.00 0.00 C ATOM 1012 CG PRO A 60 21.545 -1.267 9.608 1.00 0.00 C ATOM 1013 CD PRO A 60 21.644 -0.720 8.213 1.00 0.00 C ATOM 0 HA PRO A 60 20.522 -3.627 7.564 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.574 -3.037 10.322 1.00 0.00 H new ATOM 0 HB3 PRO A 60 22.023 -3.342 9.385 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.808 -0.716 10.192 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.497 -1.178 10.131 1.00 0.00 H new ATOM 0 HD2 PRO A 60 21.427 0.348 8.181 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.642 -0.856 7.795 1.00 0.00 H new ATOM 1021 N LYS A 61 18.184 -1.707 8.718 1.00 0.00 N ATOM 1022 CA LYS A 61 16.762 -1.683 9.033 1.00 0.00 C ATOM 1023 C LYS A 61 15.933 -1.998 7.795 1.00 0.00 C ATOM 1024 O LYS A 61 14.814 -2.499 7.901 1.00 0.00 O ATOM 1025 CB LYS A 61 16.347 -0.331 9.610 1.00 0.00 C ATOM 1026 CG LYS A 61 14.953 -0.344 10.223 1.00 0.00 C ATOM 1027 CD LYS A 61 13.894 0.059 9.209 1.00 0.00 C ATOM 1028 CE LYS A 61 13.249 1.388 9.572 1.00 0.00 C ATOM 1029 NZ LYS A 61 12.175 1.225 10.592 1.00 0.00 N ATOM 0 H LYS A 61 18.625 -0.788 8.673 1.00 0.00 H new ATOM 0 HA LYS A 61 16.577 -2.449 9.787 1.00 0.00 H new ATOM 0 HB2 LYS A 61 17.068 -0.030 10.370 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.383 0.420 8.821 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.732 -1.341 10.605 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.922 0.337 11.073 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.345 0.131 8.220 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.128 -0.715 9.154 1.00 0.00 H new ATOM 0 HE2 LYS A 61 14.010 2.069 9.952 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.831 1.846 8.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.761 2.153 10.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.435 0.596 10.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.578 0.812 11.457 1.00 0.00 H new ATOM 1043 N ILE A 62 16.485 -1.723 6.614 1.00 0.00 N ATOM 1044 CA ILE A 62 15.778 -2.012 5.373 1.00 0.00 C ATOM 1045 C ILE A 62 15.346 -3.476 5.367 1.00 0.00 C ATOM 1046 O ILE A 62 14.314 -3.832 4.795 1.00 0.00 O ATOM 1047 CB ILE A 62 16.645 -1.692 4.131 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.570 -0.198 3.806 1.00 0.00 C ATOM 1049 CG2 ILE A 62 16.211 -2.516 2.923 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.792 0.692 5.009 1.00 0.00 C ATOM 0 H ILE A 62 17.408 -1.306 6.493 1.00 0.00 H new ATOM 0 HA ILE A 62 14.897 -1.372 5.321 1.00 0.00 H new ATOM 0 HB ILE A 62 17.676 -1.956 4.364 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.315 0.039 3.046 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.594 0.024 3.375 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.840 -2.267 2.068 1.00 0.00 H new ATOM 0 HG22 ILE A 62 16.312 -3.577 3.151 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.171 -2.293 2.685 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.725 1.737 4.706 1.00 0.00 H new ATOM 0 HD12 ILE A 62 16.032 0.483 5.761 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.780 0.498 5.428 1.00 0.00 H new ATOM 1062 N ASP A 63 16.124 -4.309 6.055 1.00 0.00 N ATOM 1063 CA ASP A 63 15.802 -5.715 6.177 1.00 0.00 C ATOM 1064 C ASP A 63 14.549 -5.833 7.025 1.00 0.00 C ATOM 1065 O ASP A 63 13.634 -6.591 6.708 1.00 0.00 O ATOM 1066 CB ASP A 63 16.964 -6.478 6.820 1.00 0.00 C ATOM 1067 CG ASP A 63 17.367 -7.700 6.019 1.00 0.00 C ATOM 1068 OD1 ASP A 63 16.509 -8.241 5.290 1.00 0.00 O ATOM 1069 OD2 ASP A 63 18.540 -8.115 6.119 1.00 0.00 O ATOM 0 H ASP A 63 16.980 -4.028 6.534 1.00 0.00 H new ATOM 0 HA ASP A 63 15.631 -6.150 5.192 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.822 -5.813 6.918 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.681 -6.784 7.827 1.00 0.00 H new ATOM 1074 N GLU A 64 14.508 -5.029 8.089 1.00 0.00 N ATOM 1075 CA GLU A 64 13.359 -4.988 8.978 1.00 0.00 C ATOM 1076 C GLU A 64 12.116 -4.631 8.178 1.00 0.00 C ATOM 1077 O GLU A 64 11.051 -5.212 8.369 1.00 0.00 O ATOM 1078 CB GLU A 64 13.583 -3.969 10.100 1.00 0.00 C ATOM 1079 CG GLU A 64 13.876 -4.604 11.449 1.00 0.00 C ATOM 1080 CD GLU A 64 15.362 -4.754 11.712 1.00 0.00 C ATOM 1081 OE1 GLU A 64 16.071 -5.280 10.828 1.00 0.00 O ATOM 1082 OE2 GLU A 64 15.817 -4.345 12.801 1.00 0.00 O ATOM 0 H GLU A 64 15.264 -4.397 8.352 1.00 0.00 H new ATOM 0 HA GLU A 64 13.225 -5.969 9.434 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.413 -3.317 9.827 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.698 -3.339 10.189 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.431 -3.996 12.237 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.402 -5.584 11.496 1.00 0.00 H new ATOM 1089 N ILE A 65 12.277 -3.684 7.260 1.00 0.00 N ATOM 1090 CA ILE A 65 11.185 -3.251 6.398 1.00 0.00 C ATOM 1091 C ILE A 65 10.642 -4.430 5.599 1.00 0.00 C ATOM 1092 O ILE A 65 9.437 -4.543 5.381 1.00 0.00 O ATOM 1093 CB ILE A 65 11.652 -2.151 5.421 1.00 0.00 C ATOM 1094 CG1 ILE A 65 12.260 -0.979 6.193 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.495 -1.676 4.550 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.289 -0.327 7.153 1.00 0.00 C ATOM 0 H ILE A 65 13.159 -3.200 7.094 1.00 0.00 H new ATOM 0 HA ILE A 65 10.399 -2.847 7.036 1.00 0.00 H new ATOM 0 HB ILE A 65 12.417 -2.572 4.769 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.129 -1.331 6.749 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.616 -0.232 5.484 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.847 -0.901 3.869 1.00 0.00 H new ATOM 0 HG22 ILE A 65 10.105 -2.515 3.974 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.705 -1.272 5.183 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.784 0.496 7.668 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.431 0.055 6.600 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.952 -1.062 7.884 1.00 0.00 H new ATOM 1108 N SER A 66 11.546 -5.304 5.167 1.00 0.00 N ATOM 1109 CA SER A 66 11.167 -6.476 4.389 1.00 0.00 C ATOM 1110 C SER A 66 10.611 -7.580 5.286 1.00 0.00 C ATOM 1111 O SER A 66 9.505 -8.070 5.063 1.00 0.00 O ATOM 1112 CB SER A 66 12.369 -7.000 3.603 1.00 0.00 C ATOM 1113 OG SER A 66 12.066 -8.231 2.969 1.00 0.00 O ATOM 0 H SER A 66 12.547 -5.221 5.343 1.00 0.00 H new ATOM 0 HA SER A 66 10.384 -6.176 3.692 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.667 -6.265 2.855 1.00 0.00 H new ATOM 0 HB3 SER A 66 13.217 -7.132 4.275 1.00 0.00 H new ATOM 0 HG SER A 66 12.882 -8.769 2.893 1.00 0.00 H new ATOM 1119 N LYS A 67 11.383 -7.973 6.296 1.00 0.00 N ATOM 1120 CA LYS A 67 10.953 -9.026 7.211 1.00 0.00 C ATOM 1121 C LYS A 67 9.692 -8.612 7.968 1.00 0.00 C ATOM 1122 O LYS A 67 8.774 -9.413 8.139 1.00 0.00 O ATOM 1123 CB LYS A 67 12.070 -9.391 8.195 1.00 0.00 C ATOM 1124 CG LYS A 67 12.860 -8.197 8.707 1.00 0.00 C ATOM 1125 CD LYS A 67 13.088 -8.280 10.210 1.00 0.00 C ATOM 1126 CE LYS A 67 14.547 -8.038 10.567 1.00 0.00 C ATOM 1127 NZ LYS A 67 15.020 -8.965 11.632 1.00 0.00 N ATOM 0 H LYS A 67 12.302 -7.582 6.500 1.00 0.00 H new ATOM 0 HA LYS A 67 10.721 -9.908 6.614 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.634 -9.916 9.045 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.755 -10.085 7.709 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.821 -8.149 8.195 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.326 -7.277 8.470 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.462 -7.544 10.715 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.782 -9.262 10.572 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.164 -8.163 9.677 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.673 -7.008 10.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 16.018 -8.767 11.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.448 -8.829 12.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.924 -9.948 11.305 1.00 0.00 H new ATOM 1141 N ARG A 68 9.644 -7.356 8.408 1.00 0.00 N ATOM 1142 CA ARG A 68 8.479 -6.855 9.132 1.00 0.00 C ATOM 1143 C ARG A 68 7.307 -6.665 8.181 1.00 0.00 C ATOM 1144 O ARG A 68 6.150 -6.820 8.569 1.00 0.00 O ATOM 1145 CB ARG A 68 8.793 -5.535 9.839 1.00 0.00 C ATOM 1146 CG ARG A 68 9.877 -5.659 10.896 1.00 0.00 C ATOM 1147 CD ARG A 68 10.518 -4.313 11.202 1.00 0.00 C ATOM 1148 NE ARG A 68 9.636 -3.452 11.988 1.00 0.00 N ATOM 1149 CZ ARG A 68 9.479 -3.559 13.306 1.00 0.00 C ATOM 1150 NH1 ARG A 68 10.141 -4.485 13.988 1.00 0.00 N ATOM 1151 NH2 ARG A 68 8.658 -2.736 13.943 1.00 0.00 N ATOM 0 H ARG A 68 10.390 -6.673 8.277 1.00 0.00 H new ATOM 0 HA ARG A 68 8.212 -7.594 9.887 1.00 0.00 H new ATOM 0 HB2 ARG A 68 9.102 -4.799 9.097 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.883 -5.156 10.305 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.450 -6.075 11.809 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.641 -6.357 10.554 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.450 -4.470 11.746 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.775 -3.813 10.268 1.00 0.00 H new ATOM 0 HE ARG A 68 9.111 -2.728 11.499 1.00 0.00 H new ATOM 0 HH11 ARG A 68 10.775 -5.120 13.503 1.00 0.00 H new ATOM 0 HH12 ARG A 68 10.016 -4.562 14.997 1.00 0.00 H new ATOM 0 HH21 ARG A 68 8.147 -2.022 13.424 1.00 0.00 H new ATOM 0 HH22 ARG A 68 8.537 -2.817 14.953 1.00 0.00 H new ATOM 1165 N PHE A 69 7.613 -6.340 6.926 1.00 0.00 N ATOM 1166 CA PHE A 69 6.582 -6.144 5.914 1.00 0.00 C ATOM 1167 C PHE A 69 5.642 -7.349 5.886 1.00 0.00 C ATOM 1168 O PHE A 69 4.448 -7.218 5.618 1.00 0.00 O ATOM 1169 CB PHE A 69 7.236 -5.913 4.542 1.00 0.00 C ATOM 1170 CG PHE A 69 6.588 -6.657 3.404 1.00 0.00 C ATOM 1171 CD1 PHE A 69 5.405 -6.202 2.844 1.00 0.00 C ATOM 1172 CD2 PHE A 69 7.163 -7.812 2.899 1.00 0.00 C ATOM 1173 CE1 PHE A 69 4.809 -6.885 1.801 1.00 0.00 C ATOM 1174 CE2 PHE A 69 6.572 -8.500 1.857 1.00 0.00 C ATOM 1175 CZ PHE A 69 5.393 -8.035 1.308 1.00 0.00 C ATOM 0 H PHE A 69 8.566 -6.207 6.588 1.00 0.00 H new ATOM 0 HA PHE A 69 5.991 -5.262 6.161 1.00 0.00 H new ATOM 0 HB2 PHE A 69 7.215 -4.846 4.320 1.00 0.00 H new ATOM 0 HB3 PHE A 69 8.284 -6.206 4.600 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.944 -5.304 3.227 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.085 -8.179 3.325 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.888 -6.520 1.372 1.00 0.00 H new ATOM 0 HE2 PHE A 69 7.031 -9.399 1.473 1.00 0.00 H new ATOM 0 HZ PHE A 69 4.928 -8.571 0.494 1.00 0.00 H new ATOM 1185 N PHE A 70 6.194 -8.519 6.188 1.00 0.00 N ATOM 1186 CA PHE A 70 5.419 -9.750 6.225 1.00 0.00 C ATOM 1187 C PHE A 70 5.268 -10.222 7.669 1.00 0.00 C ATOM 1188 O PHE A 70 5.924 -11.175 8.093 1.00 0.00 O ATOM 1189 CB PHE A 70 6.095 -10.833 5.380 1.00 0.00 C ATOM 1190 CG PHE A 70 5.127 -11.698 4.624 1.00 0.00 C ATOM 1191 CD1 PHE A 70 5.033 -11.612 3.244 1.00 0.00 C ATOM 1192 CD2 PHE A 70 4.313 -12.598 5.292 1.00 0.00 C ATOM 1193 CE1 PHE A 70 4.143 -12.407 2.545 1.00 0.00 C ATOM 1194 CE2 PHE A 70 3.422 -13.395 4.600 1.00 0.00 C ATOM 1195 CZ PHE A 70 3.337 -13.300 3.225 1.00 0.00 C ATOM 0 H PHE A 70 7.182 -8.639 6.412 1.00 0.00 H new ATOM 0 HA PHE A 70 4.430 -9.557 5.809 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.774 -10.358 4.672 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.701 -11.464 6.030 1.00 0.00 H new ATOM 0 HD1 PHE A 70 5.662 -10.916 2.708 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.376 -12.678 6.367 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.078 -12.330 1.470 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.793 -14.092 5.134 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.642 -13.923 2.682 1.00 0.00 H new ATOM 1205 N PRO A 71 4.406 -9.549 8.450 1.00 0.00 N ATOM 1206 CA PRO A 71 4.179 -9.892 9.858 1.00 0.00 C ATOM 1207 C PRO A 71 3.433 -11.212 10.020 1.00 0.00 C ATOM 1208 O PRO A 71 2.218 -11.229 10.218 1.00 0.00 O ATOM 1209 CB PRO A 71 3.329 -8.729 10.374 1.00 0.00 C ATOM 1210 CG PRO A 71 2.630 -8.210 9.167 1.00 0.00 C ATOM 1211 CD PRO A 71 3.589 -8.395 8.025 1.00 0.00 C ATOM 0 HA PRO A 71 5.115 -10.027 10.401 1.00 0.00 H new ATOM 0 HB2 PRO A 71 2.619 -9.062 11.131 1.00 0.00 H new ATOM 0 HB3 PRO A 71 3.948 -7.959 10.835 1.00 0.00 H new ATOM 0 HG2 PRO A 71 1.702 -8.753 8.989 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.366 -7.159 9.290 1.00 0.00 H new ATOM 0 HD2 PRO A 71 3.067 -8.595 7.090 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.200 -7.507 7.865 1.00 0.00 H new ATOM 1219 N ALA A 72 4.166 -12.316 9.935 1.00 0.00 N ATOM 1220 CA ALA A 72 3.572 -13.640 10.071 1.00 0.00 C ATOM 1221 C ALA A 72 4.540 -14.608 10.744 1.00 0.00 C ATOM 1222 O ALA A 72 4.218 -15.212 11.766 1.00 0.00 O ATOM 1223 CB ALA A 72 3.148 -14.170 8.709 1.00 0.00 C ATOM 0 H ALA A 72 5.173 -12.320 9.772 1.00 0.00 H new ATOM 0 HA ALA A 72 2.689 -13.554 10.704 1.00 0.00 H new ATOM 0 HB1 ALA A 72 2.706 -15.160 8.825 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.415 -13.495 8.268 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.019 -14.236 8.057 1.00 0.00 H new ATOM 1229 N LYS A 73 5.726 -14.752 10.161 1.00 0.00 N ATOM 1230 CA LYS A 73 6.740 -15.648 10.704 1.00 0.00 C ATOM 1231 C LYS A 73 8.098 -14.958 10.768 1.00 0.00 C ATOM 1232 O LYS A 73 8.819 -15.165 11.766 1.00 0.00 O ATOM 1233 CB LYS A 73 6.840 -16.915 9.853 1.00 0.00 C ATOM 1234 CG LYS A 73 5.863 -18.003 10.266 1.00 0.00 C ATOM 1235 CD LYS A 73 6.095 -19.287 9.484 1.00 0.00 C ATOM 1236 CE LYS A 73 5.922 -20.513 10.363 1.00 0.00 C ATOM 1237 NZ LYS A 73 7.224 -21.011 10.885 1.00 0.00 N ATOM 1238 OXT LYS A 73 8.430 -14.216 9.819 1.00 0.00 O ATOM 0 H LYS A 73 6.008 -14.260 9.313 1.00 0.00 H new ATOM 0 HA LYS A 73 6.442 -15.921 11.717 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.663 -16.656 8.809 1.00 0.00 H new ATOM 0 HB3 LYS A 73 7.855 -17.306 9.917 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.968 -18.202 11.333 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.842 -17.657 10.105 1.00 0.00 H new ATOM 0 HD2 LYS A 73 5.397 -19.336 8.648 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.100 -19.280 9.061 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.265 -20.271 11.198 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.434 -21.303 9.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.062 -21.848 11.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.842 -21.266 10.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.679 -20.267 11.451 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -6.485 -21.199 5.879 1.00 0.00 N ATOM 1254 CA MET B 1 -5.500 -20.713 4.876 1.00 0.00 C ATOM 1255 C MET B 1 -4.611 -21.849 4.382 1.00 0.00 C ATOM 1256 O MET B 1 -3.949 -22.522 5.172 1.00 0.00 O ATOM 1257 CB MET B 1 -4.648 -19.618 5.522 1.00 0.00 C ATOM 1258 CG MET B 1 -3.598 -19.035 4.590 1.00 0.00 C ATOM 1259 SD MET B 1 -2.372 -18.040 5.461 1.00 0.00 S ATOM 1260 CE MET B 1 -1.368 -19.320 6.209 1.00 0.00 C ATOM 0 H1 MET B 1 -7.076 -20.405 6.198 1.00 0.00 H new ATOM 0 H2 MET B 1 -7.088 -21.929 5.448 1.00 0.00 H new ATOM 0 H3 MET B 1 -5.980 -21.603 6.693 1.00 0.00 H new ATOM 0 HA MET B 1 -6.034 -20.315 4.013 1.00 0.00 H new ATOM 0 HB2 MET B 1 -5.301 -18.816 5.866 1.00 0.00 H new ATOM 0 HB3 MET B 1 -4.153 -20.027 6.403 1.00 0.00 H new ATOM 0 HG2 MET B 1 -3.095 -19.846 4.064 1.00 0.00 H new ATOM 0 HG3 MET B 1 -4.089 -18.421 3.835 1.00 0.00 H new ATOM 0 HE1 MET B 1 -1.239 -19.108 7.270 1.00 0.00 H new ATOM 0 HE2 MET B 1 -1.860 -20.285 6.089 1.00 0.00 H new ATOM 0 HE3 MET B 1 -0.392 -19.347 5.724 1.00 0.00 H new ATOM 1272 N VAL B 2 -4.600 -22.056 3.068 1.00 0.00 N ATOM 1273 CA VAL B 2 -3.793 -23.109 2.467 1.00 0.00 C ATOM 1274 C VAL B 2 -2.903 -22.554 1.357 1.00 0.00 C ATOM 1275 O VAL B 2 -2.567 -23.256 0.404 1.00 0.00 O ATOM 1276 CB VAL B 2 -4.678 -24.239 1.898 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -5.549 -23.722 0.760 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -3.823 -25.413 1.440 1.00 0.00 C ATOM 0 H VAL B 2 -5.142 -21.507 2.400 1.00 0.00 H new ATOM 0 HA VAL B 2 -3.163 -23.519 3.257 1.00 0.00 H new ATOM 0 HB VAL B 2 -5.336 -24.590 2.692 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -6.164 -24.535 0.374 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -6.193 -22.923 1.128 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -4.914 -23.337 -0.038 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -4.466 -26.198 1.043 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -3.134 -25.080 0.664 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -3.256 -25.802 2.286 1.00 0.00 H new ATOM 1288 N GLU B 3 -2.525 -21.286 1.489 1.00 0.00 N ATOM 1289 CA GLU B 3 -1.674 -20.632 0.501 1.00 0.00 C ATOM 1290 C GLU B 3 -2.364 -20.571 -0.858 1.00 0.00 C ATOM 1291 O GLU B 3 -2.704 -21.600 -1.441 1.00 0.00 O ATOM 1292 CB GLU B 3 -0.339 -21.370 0.376 1.00 0.00 C ATOM 1293 CG GLU B 3 0.853 -20.442 0.206 1.00 0.00 C ATOM 1294 CD GLU B 3 2.050 -21.138 -0.411 1.00 0.00 C ATOM 1295 OE1 GLU B 3 2.099 -22.385 -0.368 1.00 0.00 O ATOM 1296 OE2 GLU B 3 2.939 -20.436 -0.938 1.00 0.00 O ATOM 0 H GLU B 3 -2.795 -20.690 2.272 1.00 0.00 H new ATOM 0 HA GLU B 3 -1.487 -19.613 0.839 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -0.188 -21.984 1.264 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -0.386 -22.048 -0.476 1.00 0.00 H new ATOM 0 HG2 GLU B 3 0.565 -19.598 -0.421 1.00 0.00 H new ATOM 0 HG3 GLU B 3 1.134 -20.036 1.178 1.00 0.00 H new ATOM 1303 N SER B 4 -2.567 -19.356 -1.358 1.00 0.00 N ATOM 1304 CA SER B 4 -3.215 -19.156 -2.649 1.00 0.00 C ATOM 1305 C SER B 4 -4.658 -19.651 -2.620 1.00 0.00 C ATOM 1306 O SER B 4 -5.121 -20.189 -1.614 1.00 0.00 O ATOM 1307 CB SER B 4 -2.438 -19.878 -3.752 1.00 0.00 C ATOM 1308 OG SER B 4 -2.652 -19.267 -5.012 1.00 0.00 O ATOM 0 H SER B 4 -2.291 -18.494 -0.888 1.00 0.00 H new ATOM 0 HA SER B 4 -3.222 -18.086 -2.859 1.00 0.00 H new ATOM 0 HB2 SER B 4 -1.374 -19.869 -3.516 1.00 0.00 H new ATOM 0 HB3 SER B 4 -2.747 -20.923 -3.794 1.00 0.00 H new ATOM 0 HG SER B 4 -2.143 -19.746 -5.699 1.00 0.00 H new ATOM 1314 N LYS B 5 -5.364 -19.460 -3.732 1.00 0.00 N ATOM 1315 CA LYS B 5 -6.758 -19.882 -3.844 1.00 0.00 C ATOM 1316 C LYS B 5 -7.663 -19.077 -2.910 1.00 0.00 C ATOM 1317 O LYS B 5 -8.827 -19.424 -2.713 1.00 0.00 O ATOM 1318 CB LYS B 5 -6.890 -21.378 -3.540 1.00 0.00 C ATOM 1319 CG LYS B 5 -6.977 -22.245 -4.785 1.00 0.00 C ATOM 1320 CD LYS B 5 -6.908 -23.724 -4.439 1.00 0.00 C ATOM 1321 CE LYS B 5 -6.790 -24.582 -5.687 1.00 0.00 C ATOM 1322 NZ LYS B 5 -5.373 -24.916 -6.001 1.00 0.00 N ATOM 0 H LYS B 5 -4.992 -19.014 -4.571 1.00 0.00 H new ATOM 0 HA LYS B 5 -7.078 -19.696 -4.869 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -6.034 -21.696 -2.944 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -7.780 -21.540 -2.932 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -7.909 -22.036 -5.311 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -6.164 -21.991 -5.465 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -6.053 -23.907 -3.788 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -7.800 -24.011 -3.882 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -7.358 -25.502 -5.550 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -7.235 -24.056 -6.532 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -5.336 -25.502 -6.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -4.836 -24.039 -6.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -4.955 -25.440 -5.206 1.00 0.00 H new ATOM 1336 N LYS B 6 -7.123 -18.001 -2.335 1.00 0.00 N ATOM 1337 CA LYS B 6 -7.882 -17.147 -1.424 1.00 0.00 C ATOM 1338 C LYS B 6 -6.956 -16.164 -0.714 1.00 0.00 C ATOM 1339 O LYS B 6 -7.239 -14.968 -0.645 1.00 0.00 O ATOM 1340 CB LYS B 6 -8.629 -17.997 -0.394 1.00 0.00 C ATOM 1341 CG LYS B 6 -10.141 -17.942 -0.543 1.00 0.00 C ATOM 1342 CD LYS B 6 -10.842 -18.620 0.623 1.00 0.00 C ATOM 1343 CE LYS B 6 -10.984 -17.682 1.811 1.00 0.00 C ATOM 1344 NZ LYS B 6 -12.163 -18.026 2.652 1.00 0.00 N ATOM 0 H LYS B 6 -6.160 -17.701 -2.486 1.00 0.00 H new ATOM 0 HA LYS B 6 -8.608 -16.583 -2.010 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -8.301 -19.033 -0.483 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -8.358 -17.661 0.607 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -10.463 -16.903 -0.608 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -10.433 -18.425 -1.475 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -11.828 -18.961 0.307 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -10.280 -19.505 0.922 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -10.080 -17.726 2.418 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -11.079 -16.656 1.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -12.225 -17.363 3.451 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -13.029 -17.960 2.080 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -12.060 -18.996 3.014 1.00 0.00 H new ATOM 1358 N ILE B 7 -5.850 -16.681 -0.188 1.00 0.00 N ATOM 1359 CA ILE B 7 -4.879 -15.853 0.517 1.00 0.00 C ATOM 1360 C ILE B 7 -3.561 -15.781 -0.246 1.00 0.00 C ATOM 1361 O ILE B 7 -2.609 -16.495 0.071 1.00 0.00 O ATOM 1362 CB ILE B 7 -4.610 -16.390 1.936 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -5.929 -16.667 2.660 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -3.762 -15.404 2.725 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -6.452 -18.071 2.444 1.00 0.00 C ATOM 0 H ILE B 7 -5.604 -17.670 -0.237 1.00 0.00 H new ATOM 0 HA ILE B 7 -5.308 -14.854 0.590 1.00 0.00 H new ATOM 0 HB ILE B 7 -4.059 -17.327 1.854 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -5.790 -16.500 3.728 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -6.678 -15.952 2.320 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -3.581 -15.798 3.725 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -2.810 -15.255 2.216 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -4.287 -14.452 2.800 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -7.389 -18.197 2.986 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -6.623 -18.236 1.380 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -5.721 -18.792 2.810 1.00 0.00 H new ATOM 1377 N ALA B 8 -3.512 -14.916 -1.252 1.00 0.00 N ATOM 1378 CA ALA B 8 -2.311 -14.749 -2.061 1.00 0.00 C ATOM 1379 C ALA B 8 -2.249 -13.352 -2.669 1.00 0.00 C ATOM 1380 O ALA B 8 -3.187 -12.567 -2.539 1.00 0.00 O ATOM 1381 CB ALA B 8 -2.261 -15.805 -3.154 1.00 0.00 C ATOM 0 H ALA B 8 -4.291 -14.318 -1.527 1.00 0.00 H new ATOM 0 HA ALA B 8 -1.444 -14.873 -1.411 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -1.359 -15.669 -3.751 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -2.250 -16.797 -2.702 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -3.138 -15.708 -3.794 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.138 -13.049 -3.332 1.00 0.00 N ATOM 1388 CA LYS B 9 -0.956 -11.745 -3.958 1.00 0.00 C ATOM 1389 C LYS B 9 -1.790 -11.637 -5.230 1.00 0.00 C ATOM 1390 O LYS B 9 -1.939 -12.608 -5.972 1.00 0.00 O ATOM 1391 CB LYS B 9 0.523 -11.510 -4.268 1.00 0.00 C ATOM 1392 CG LYS B 9 1.183 -10.515 -3.328 1.00 0.00 C ATOM 1393 CD LYS B 9 2.276 -11.165 -2.493 1.00 0.00 C ATOM 1394 CE LYS B 9 1.694 -12.074 -1.421 1.00 0.00 C ATOM 1395 NZ LYS B 9 2.284 -11.801 -0.081 1.00 0.00 N ATOM 0 H LYS B 9 -0.351 -13.688 -3.449 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.294 -10.977 -3.262 1.00 0.00 H new ATOM 0 HB2 LYS B 9 1.054 -12.460 -4.212 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.620 -11.151 -5.293 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.607 -9.695 -3.907 1.00 0.00 H new ATOM 0 HG3 LYS B 9 0.430 -10.084 -2.668 1.00 0.00 H new ATOM 0 HD2 LYS B 9 2.936 -11.742 -3.141 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.885 -10.392 -2.024 1.00 0.00 H new ATOM 0 HE2 LYS B 9 0.614 -11.937 -1.377 1.00 0.00 H new ATOM 0 HE3 LYS B 9 1.873 -13.115 -1.691 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 2.196 -12.648 0.516 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 3.289 -11.555 -0.188 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 1.779 -11.009 0.366 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.352 -10.456 -5.460 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.200 -10.222 -6.626 1.00 0.00 C ATOM 1411 C LYS B 10 -2.640 -9.129 -7.534 1.00 0.00 C ATOM 1412 O LYS B 10 -2.227 -8.074 -7.065 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.582 -9.802 -6.150 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.433 -10.940 -5.609 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.276 -10.487 -4.423 1.00 0.00 C ATOM 1416 CE LYS B 10 -7.669 -11.095 -4.465 1.00 0.00 C ATOM 1417 NZ LYS B 10 -8.114 -11.558 -3.122 1.00 0.00 N ATOM 0 H LYS B 10 -2.236 -9.644 -4.854 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.243 -11.147 -7.201 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.471 -9.046 -5.372 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.111 -9.331 -6.979 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.084 -11.316 -6.398 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -4.789 -11.766 -5.306 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -5.782 -10.771 -3.494 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.352 -9.400 -4.424 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.375 -10.358 -4.847 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -7.678 -11.935 -5.160 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.068 -11.966 -3.194 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -7.455 -12.280 -2.768 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.131 -10.752 -2.465 1.00 0.00 H new ATOM 1431 N LYS B 11 -2.660 -9.361 -8.841 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.176 -8.357 -9.782 1.00 0.00 C ATOM 1433 C LYS B 11 -3.079 -7.130 -9.744 1.00 0.00 C ATOM 1434 O LYS B 11 -4.211 -7.168 -10.226 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.124 -8.921 -11.201 1.00 0.00 C ATOM 1436 CG LYS B 11 -1.235 -10.147 -11.337 1.00 0.00 C ATOM 1437 CD LYS B 11 -2.012 -11.434 -11.094 1.00 0.00 C ATOM 1438 CE LYS B 11 -1.512 -12.164 -9.859 1.00 0.00 C ATOM 1439 NZ LYS B 11 -2.574 -13.007 -9.245 1.00 0.00 N ATOM 0 H LYS B 11 -3.001 -10.222 -9.269 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.166 -8.071 -9.489 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.135 -9.179 -11.518 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.766 -8.146 -11.878 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -0.796 -10.170 -12.334 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -0.411 -10.080 -10.627 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.071 -11.204 -10.978 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -1.921 -12.085 -11.964 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -0.661 -12.790 -10.127 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -1.156 -11.438 -9.128 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.378 -13.128 -8.231 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -3.498 -12.545 -9.367 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -2.589 -13.938 -9.708 1.00 0.00 H new ATOM 1453 N THR B 12 -2.577 -6.047 -9.162 1.00 0.00 N ATOM 1454 CA THR B 12 -3.347 -4.813 -9.056 1.00 0.00 C ATOM 1455 C THR B 12 -2.639 -3.666 -9.768 1.00 0.00 C ATOM 1456 O THR B 12 -1.411 -3.620 -9.821 1.00 0.00 O ATOM 1457 CB THR B 12 -3.582 -4.455 -7.588 1.00 0.00 C ATOM 1458 OG1 THR B 12 -3.806 -5.623 -6.816 1.00 0.00 O ATOM 1459 CG2 THR B 12 -4.763 -3.533 -7.380 1.00 0.00 C ATOM 0 H THR B 12 -1.642 -5.998 -8.757 1.00 0.00 H new ATOM 0 HA THR B 12 -4.311 -4.974 -9.539 1.00 0.00 H new ATOM 0 HB THR B 12 -2.677 -3.938 -7.268 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.054 -5.369 -5.903 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.874 -3.318 -6.317 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.598 -2.602 -7.923 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.669 -4.013 -7.750 1.00 0.00 H new ATOM 1467 N THR B 13 -3.421 -2.743 -10.321 1.00 0.00 N ATOM 1468 CA THR B 13 -2.855 -1.605 -11.037 1.00 0.00 C ATOM 1469 C THR B 13 -2.959 -0.318 -10.234 1.00 0.00 C ATOM 1470 O THR B 13 -4.011 0.008 -9.686 1.00 0.00 O ATOM 1471 CB THR B 13 -3.556 -1.402 -12.376 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.039 -2.630 -12.891 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.659 -0.780 -13.423 1.00 0.00 C ATOM 0 H THR B 13 -4.440 -2.760 -10.288 1.00 0.00 H new ATOM 0 HA THR B 13 -1.802 -1.834 -11.199 1.00 0.00 H new ATOM 0 HB THR B 13 -4.381 -0.720 -12.170 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.486 -2.472 -13.749 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.214 -0.661 -14.353 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.318 0.195 -13.077 1.00 0.00 H new ATOM 0 HG23 THR B 13 -1.798 -1.426 -13.595 1.00 0.00 H new ATOM 1481 N LEU B 14 -1.863 0.425 -10.211 1.00 0.00 N ATOM 1482 CA LEU B 14 -1.811 1.705 -9.524 1.00 0.00 C ATOM 1483 C LEU B 14 -1.275 2.758 -10.484 1.00 0.00 C ATOM 1484 O LEU B 14 -0.288 2.523 -11.182 1.00 0.00 O ATOM 1485 CB LEU B 14 -0.934 1.617 -8.273 1.00 0.00 C ATOM 1486 CG LEU B 14 -1.311 0.502 -7.293 1.00 0.00 C ATOM 1487 CD1 LEU B 14 -0.369 0.501 -6.098 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -2.757 0.652 -6.838 1.00 0.00 C ATOM 0 H LEU B 14 -0.989 0.159 -10.666 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.814 1.983 -9.202 1.00 0.00 H new ATOM 0 HB2 LEU B 14 0.101 1.473 -8.583 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -0.979 2.571 -7.748 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.214 -0.454 -7.807 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -0.652 -0.298 -5.412 1.00 0.00 H new ATOM 0 HD12 LEU B 14 0.653 0.340 -6.441 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -0.432 1.460 -5.584 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -3.005 -0.150 -6.142 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -2.885 1.614 -6.342 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.418 0.599 -7.703 1.00 0.00 H new ATOM 1500 N ALA B 15 -1.940 3.903 -10.549 1.00 0.00 N ATOM 1501 CA ALA B 15 -1.528 4.956 -11.467 1.00 0.00 C ATOM 1502 C ALA B 15 -0.481 5.882 -10.858 1.00 0.00 C ATOM 1503 O ALA B 15 -0.795 6.782 -10.080 1.00 0.00 O ATOM 1504 CB ALA B 15 -2.737 5.755 -11.927 1.00 0.00 C ATOM 0 H ALA B 15 -2.759 4.126 -9.983 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.065 4.471 -12.327 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -2.416 6.539 -12.613 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -3.438 5.093 -12.435 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.225 6.206 -11.063 1.00 0.00 H new ATOM 1510 N PHE B 16 0.764 5.654 -11.253 1.00 0.00 N ATOM 1511 CA PHE B 16 1.894 6.456 -10.799 1.00 0.00 C ATOM 1512 C PHE B 16 3.168 5.955 -11.436 1.00 0.00 C ATOM 1513 O PHE B 16 3.169 4.948 -12.133 1.00 0.00 O ATOM 1514 CB PHE B 16 2.040 6.459 -9.273 1.00 0.00 C ATOM 1515 CG PHE B 16 2.128 5.092 -8.637 1.00 0.00 C ATOM 1516 CD1 PHE B 16 2.198 4.972 -7.257 1.00 0.00 C ATOM 1517 CD2 PHE B 16 2.142 3.933 -9.404 1.00 0.00 C ATOM 1518 CE1 PHE B 16 2.281 3.731 -6.655 1.00 0.00 C ATOM 1519 CE2 PHE B 16 2.225 2.690 -8.806 1.00 0.00 C ATOM 1520 CZ PHE B 16 2.294 2.589 -7.431 1.00 0.00 C ATOM 0 H PHE B 16 1.020 4.907 -11.898 1.00 0.00 H new ATOM 0 HA PHE B 16 1.702 7.484 -11.105 1.00 0.00 H new ATOM 0 HB2 PHE B 16 2.934 7.024 -9.010 1.00 0.00 H new ATOM 0 HB3 PHE B 16 1.190 6.989 -8.843 1.00 0.00 H new ATOM 0 HD1 PHE B 16 2.187 5.861 -6.644 1.00 0.00 H new ATOM 0 HD2 PHE B 16 2.087 4.005 -10.480 1.00 0.00 H new ATOM 0 HE1 PHE B 16 2.336 3.654 -5.579 1.00 0.00 H new ATOM 0 HE2 PHE B 16 2.236 1.798 -9.414 1.00 0.00 H new ATOM 0 HZ PHE B 16 2.358 1.618 -6.963 1.00 0.00 H new ATOM 1530 N ASP B 17 4.246 6.670 -11.205 1.00 0.00 N ATOM 1531 CA ASP B 17 5.541 6.311 -11.757 1.00 0.00 C ATOM 1532 C ASP B 17 6.431 7.521 -11.768 1.00 0.00 C ATOM 1533 O ASP B 17 7.631 7.429 -11.540 1.00 0.00 O ATOM 1534 CB ASP B 17 5.423 5.763 -13.176 1.00 0.00 C ATOM 1535 CG ASP B 17 5.553 4.254 -13.228 1.00 0.00 C ATOM 1536 OD1 ASP B 17 5.948 3.729 -14.291 1.00 0.00 O ATOM 1537 OD2 ASP B 17 5.257 3.597 -12.208 1.00 0.00 O ATOM 0 H ASP B 17 4.254 7.514 -10.632 1.00 0.00 H new ATOM 0 HA ASP B 17 5.966 5.529 -11.128 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.461 6.056 -13.596 1.00 0.00 H new ATOM 0 HB3 ASP B 17 6.195 6.213 -13.801 1.00 0.00 H new ATOM 1542 N GLU B 18 5.842 8.668 -12.027 1.00 0.00 N ATOM 1543 CA GLU B 18 6.620 9.879 -12.057 1.00 0.00 C ATOM 1544 C GLU B 18 7.503 9.946 -10.812 1.00 0.00 C ATOM 1545 O GLU B 18 8.735 9.898 -10.899 1.00 0.00 O ATOM 1546 CB GLU B 18 5.714 11.113 -12.144 1.00 0.00 C ATOM 1547 CG GLU B 18 6.420 12.423 -11.827 1.00 0.00 C ATOM 1548 CD GLU B 18 5.991 13.010 -10.496 1.00 0.00 C ATOM 1549 OE1 GLU B 18 6.600 12.655 -9.466 1.00 0.00 O ATOM 1550 OE2 GLU B 18 5.045 13.827 -10.484 1.00 0.00 O ATOM 0 H GLU B 18 4.846 8.784 -12.216 1.00 0.00 H new ATOM 0 HA GLU B 18 7.251 9.870 -12.946 1.00 0.00 H new ATOM 0 HB2 GLU B 18 5.294 11.172 -13.148 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.878 10.987 -11.456 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.497 12.257 -11.816 1.00 0.00 H new ATOM 0 HG3 GLU B 18 6.216 13.143 -12.620 1.00 0.00 H new ATOM 1557 N ASP B 19 6.861 10.019 -9.653 1.00 0.00 N ATOM 1558 CA ASP B 19 7.587 10.077 -8.393 1.00 0.00 C ATOM 1559 C ASP B 19 7.943 8.687 -7.891 1.00 0.00 C ATOM 1560 O ASP B 19 9.083 8.439 -7.498 1.00 0.00 O ATOM 1561 CB ASP B 19 6.767 10.826 -7.338 1.00 0.00 C ATOM 1562 CG ASP B 19 7.575 11.899 -6.635 1.00 0.00 C ATOM 1563 OD1 ASP B 19 7.727 11.813 -5.398 1.00 0.00 O ATOM 1564 OD2 ASP B 19 8.057 12.825 -7.321 1.00 0.00 O ATOM 0 H ASP B 19 5.845 10.039 -9.560 1.00 0.00 H new ATOM 0 HA ASP B 19 8.517 10.618 -8.571 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.898 11.282 -7.813 1.00 0.00 H new ATOM 0 HB3 ASP B 19 6.392 10.116 -6.601 1.00 0.00 H new ATOM 1569 N VAL B 20 6.976 7.780 -7.900 1.00 0.00 N ATOM 1570 CA VAL B 20 7.230 6.428 -7.437 1.00 0.00 C ATOM 1571 C VAL B 20 8.299 5.756 -8.298 1.00 0.00 C ATOM 1572 O VAL B 20 9.233 5.166 -7.769 1.00 0.00 O ATOM 1573 CB VAL B 20 5.948 5.567 -7.406 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.844 6.281 -6.642 1.00 0.00 C ATOM 1575 CG2 VAL B 20 5.481 5.226 -8.807 1.00 0.00 C ATOM 0 H VAL B 20 6.023 7.954 -8.218 1.00 0.00 H new ATOM 0 HA VAL B 20 7.593 6.506 -6.412 1.00 0.00 H new ATOM 0 HB VAL B 20 6.185 4.635 -6.892 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.949 5.659 -6.631 1.00 0.00 H new ATOM 0 HG12 VAL B 20 5.171 6.466 -5.619 1.00 0.00 H new ATOM 0 HG13 VAL B 20 4.620 7.230 -7.128 1.00 0.00 H new ATOM 0 HG21 VAL B 20 4.577 4.619 -8.752 1.00 0.00 H new ATOM 0 HG22 VAL B 20 5.269 6.145 -9.353 1.00 0.00 H new ATOM 0 HG23 VAL B 20 6.261 4.668 -9.325 1.00 0.00 H new ATOM 1585 N TYR B 21 8.178 5.859 -9.622 1.00 0.00 N ATOM 1586 CA TYR B 21 9.172 5.250 -10.506 1.00 0.00 C ATOM 1587 C TYR B 21 10.542 5.884 -10.295 1.00 0.00 C ATOM 1588 O TYR B 21 11.541 5.173 -10.195 1.00 0.00 O ATOM 1589 CB TYR B 21 8.770 5.334 -11.986 1.00 0.00 C ATOM 1590 CG TYR B 21 9.327 4.205 -12.825 1.00 0.00 C ATOM 1591 CD1 TYR B 21 8.598 3.040 -13.029 1.00 0.00 C ATOM 1592 CD2 TYR B 21 10.582 4.306 -13.413 1.00 0.00 C ATOM 1593 CE1 TYR B 21 9.104 2.007 -13.795 1.00 0.00 C ATOM 1594 CE2 TYR B 21 11.094 3.276 -14.181 1.00 0.00 C ATOM 1595 CZ TYR B 21 10.351 2.130 -14.369 1.00 0.00 C ATOM 1596 OH TYR B 21 10.858 1.103 -15.133 1.00 0.00 O ATOM 0 H TYR B 21 7.419 6.347 -10.098 1.00 0.00 H new ATOM 0 HA TYR B 21 9.222 4.193 -10.243 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.683 5.330 -12.060 1.00 0.00 H new ATOM 0 HB3 TYR B 21 9.114 6.284 -12.395 1.00 0.00 H new ATOM 0 HD1 TYR B 21 7.620 2.940 -12.582 1.00 0.00 H new ATOM 0 HD2 TYR B 21 11.167 5.203 -13.268 1.00 0.00 H new ATOM 0 HE1 TYR B 21 8.525 1.107 -13.943 1.00 0.00 H new ATOM 0 HE2 TYR B 21 12.071 3.369 -14.631 1.00 0.00 H new ATOM 0 HH TYR B 21 11.746 1.350 -15.465 1.00 0.00 H new ATOM 1606 N HIS B 22 10.607 7.220 -10.213 1.00 0.00 N ATOM 1607 CA HIS B 22 11.895 7.870 -9.997 1.00 0.00 C ATOM 1608 C HIS B 22 12.428 7.537 -8.611 1.00 0.00 C ATOM 1609 O HIS B 22 13.587 7.154 -8.462 1.00 0.00 O ATOM 1610 CB HIS B 22 11.786 9.386 -10.179 1.00 0.00 C ATOM 1611 CG HIS B 22 12.550 9.903 -11.358 1.00 0.00 C ATOM 1612 ND1 HIS B 22 12.272 9.532 -12.656 1.00 0.00 N ATOM 1613 CD2 HIS B 22 13.589 10.770 -11.430 1.00 0.00 C ATOM 1614 CE1 HIS B 22 13.107 10.146 -13.476 1.00 0.00 C ATOM 1615 NE2 HIS B 22 13.915 10.903 -12.757 1.00 0.00 N ATOM 0 H HIS B 22 9.808 7.850 -10.291 1.00 0.00 H new ATOM 0 HA HIS B 22 12.595 7.492 -10.743 1.00 0.00 H new ATOM 0 HB2 HIS B 22 10.736 9.656 -10.290 1.00 0.00 H new ATOM 0 HB3 HIS B 22 12.148 9.879 -9.277 1.00 0.00 H new ATOM 0 HD2 HIS B 22 14.071 11.264 -10.599 1.00 0.00 H new ATOM 0 HE1 HIS B 22 13.125 10.046 -14.551 1.00 0.00 H new ATOM 0 HE2 HIS B 22 14.661 11.492 -13.128 1.00 0.00 H new ATOM 1624 N THR B 23 11.579 7.661 -7.596 1.00 0.00 N ATOM 1625 CA THR B 23 11.995 7.343 -6.238 1.00 0.00 C ATOM 1626 C THR B 23 12.373 5.872 -6.145 1.00 0.00 C ATOM 1627 O THR B 23 13.361 5.513 -5.512 1.00 0.00 O ATOM 1628 CB THR B 23 10.897 7.661 -5.232 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.717 6.932 -5.522 1.00 0.00 O ATOM 1630 CG2 THR B 23 10.534 9.130 -5.181 1.00 0.00 C ATOM 0 H THR B 23 10.613 7.975 -7.687 1.00 0.00 H new ATOM 0 HA THR B 23 12.861 7.959 -5.997 1.00 0.00 H new ATOM 0 HB THR B 23 11.306 7.373 -4.264 1.00 0.00 H new ATOM 0 HG1 THR B 23 9.214 7.391 -6.226 1.00 0.00 H new ATOM 0 HG21 THR B 23 9.746 9.285 -4.444 1.00 0.00 H new ATOM 0 HG22 THR B 23 11.412 9.712 -4.901 1.00 0.00 H new ATOM 0 HG23 THR B 23 10.182 9.452 -6.161 1.00 0.00 H new ATOM 1638 N LEU B 24 11.593 5.023 -6.807 1.00 0.00 N ATOM 1639 CA LEU B 24 11.876 3.594 -6.818 1.00 0.00 C ATOM 1640 C LEU B 24 13.280 3.347 -7.354 1.00 0.00 C ATOM 1641 O LEU B 24 13.856 2.280 -7.146 1.00 0.00 O ATOM 1642 CB LEU B 24 10.849 2.839 -7.665 1.00 0.00 C ATOM 1643 CG LEU B 24 9.775 2.106 -6.860 1.00 0.00 C ATOM 1644 CD1 LEU B 24 10.414 1.222 -5.806 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.821 3.093 -6.209 1.00 0.00 C ATOM 0 H LEU B 24 10.767 5.298 -7.338 1.00 0.00 H new ATOM 0 HA LEU B 24 11.812 3.223 -5.795 1.00 0.00 H new ATOM 0 HB2 LEU B 24 10.362 3.546 -8.337 1.00 0.00 H new ATOM 0 HB3 LEU B 24 11.374 2.116 -8.289 1.00 0.00 H new ATOM 0 HG LEU B 24 9.206 1.479 -7.546 1.00 0.00 H new ATOM 0 HD11 LEU B 24 9.636 0.708 -5.242 1.00 0.00 H new ATOM 0 HD12 LEU B 24 11.058 0.487 -6.289 1.00 0.00 H new ATOM 0 HD13 LEU B 24 11.008 1.835 -5.128 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.066 2.549 -5.642 1.00 0.00 H new ATOM 0 HD22 LEU B 24 9.377 3.748 -5.538 1.00 0.00 H new ATOM 0 HD23 LEU B 24 8.335 3.691 -6.980 1.00 0.00 H new ATOM 1657 N LYS B 25 13.825 4.342 -8.052 1.00 0.00 N ATOM 1658 CA LYS B 25 15.154 4.231 -8.622 1.00 0.00 C ATOM 1659 C LYS B 25 16.229 4.161 -7.544 1.00 0.00 C ATOM 1660 O LYS B 25 17.102 3.293 -7.593 1.00 0.00 O ATOM 1661 CB LYS B 25 15.439 5.400 -9.564 1.00 0.00 C ATOM 1662 CG LYS B 25 16.713 5.224 -10.372 1.00 0.00 C ATOM 1663 CD LYS B 25 17.904 5.865 -9.679 1.00 0.00 C ATOM 1664 CE LYS B 25 19.200 5.140 -10.011 1.00 0.00 C ATOM 1665 NZ LYS B 25 20.290 6.089 -10.370 1.00 0.00 N ATOM 0 H LYS B 25 13.361 5.232 -8.233 1.00 0.00 H new ATOM 0 HA LYS B 25 15.183 3.300 -9.188 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.598 5.521 -10.247 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.511 6.318 -8.981 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.906 4.162 -10.522 1.00 0.00 H new ATOM 0 HG3 LYS B 25 16.583 5.667 -11.359 1.00 0.00 H new ATOM 0 HD2 LYS B 25 17.983 6.909 -9.981 1.00 0.00 H new ATOM 0 HD3 LYS B 25 17.747 5.856 -8.600 1.00 0.00 H new ATOM 0 HE2 LYS B 25 19.509 4.539 -9.156 1.00 0.00 H new ATOM 0 HE3 LYS B 25 19.030 4.452 -10.839 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 21.156 5.556 -10.589 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 20.006 6.646 -11.201 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 20.471 6.729 -9.570 1.00 0.00 H new ATOM 1679 N LEU B 26 16.177 5.068 -6.571 1.00 0.00 N ATOM 1680 CA LEU B 26 17.174 5.064 -5.507 1.00 0.00 C ATOM 1681 C LEU B 26 16.974 3.855 -4.609 1.00 0.00 C ATOM 1682 O LEU B 26 17.928 3.169 -4.253 1.00 0.00 O ATOM 1683 CB LEU B 26 17.124 6.358 -4.695 1.00 0.00 C ATOM 1684 CG LEU B 26 15.780 6.647 -4.053 1.00 0.00 C ATOM 1685 CD1 LEU B 26 15.678 5.962 -2.702 1.00 0.00 C ATOM 1686 CD2 LEU B 26 15.557 8.147 -3.920 1.00 0.00 C ATOM 0 H LEU B 26 15.470 5.800 -6.498 1.00 0.00 H new ATOM 0 HA LEU B 26 18.162 5.002 -5.964 1.00 0.00 H new ATOM 0 HB2 LEU B 26 17.883 6.311 -3.914 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.388 7.191 -5.346 1.00 0.00 H new ATOM 0 HG LEU B 26 14.998 6.247 -4.698 1.00 0.00 H new ATOM 0 HD11 LEU B 26 14.708 6.180 -2.256 1.00 0.00 H new ATOM 0 HD12 LEU B 26 15.784 4.885 -2.831 1.00 0.00 H new ATOM 0 HD13 LEU B 26 16.469 6.329 -2.048 1.00 0.00 H new ATOM 0 HD21 LEU B 26 14.587 8.331 -3.457 1.00 0.00 H new ATOM 0 HD22 LEU B 26 16.343 8.578 -3.300 1.00 0.00 H new ATOM 0 HD23 LEU B 26 15.581 8.607 -4.908 1.00 0.00 H new ATOM 1698 N VAL B 27 15.723 3.588 -4.266 1.00 0.00 N ATOM 1699 CA VAL B 27 15.385 2.441 -3.429 1.00 0.00 C ATOM 1700 C VAL B 27 15.717 1.145 -4.131 1.00 0.00 C ATOM 1701 O VAL B 27 16.236 0.216 -3.519 1.00 0.00 O ATOM 1702 CB VAL B 27 13.896 2.409 -3.049 1.00 0.00 C ATOM 1703 CG1 VAL B 27 13.697 2.871 -1.624 1.00 0.00 C ATOM 1704 CG2 VAL B 27 13.084 3.244 -3.990 1.00 0.00 C ATOM 0 H VAL B 27 14.922 4.150 -4.554 1.00 0.00 H new ATOM 0 HA VAL B 27 15.979 2.548 -2.521 1.00 0.00 H new ATOM 0 HB VAL B 27 13.552 1.378 -3.128 1.00 0.00 H new ATOM 0 HG11 VAL B 27 12.636 2.840 -1.376 1.00 0.00 H new ATOM 0 HG12 VAL B 27 14.246 2.215 -0.949 1.00 0.00 H new ATOM 0 HG13 VAL B 27 14.065 3.891 -1.518 1.00 0.00 H new ATOM 0 HG21 VAL B 27 12.034 3.204 -3.699 1.00 0.00 H new ATOM 0 HG22 VAL B 27 13.432 4.276 -3.953 1.00 0.00 H new ATOM 0 HG23 VAL B 27 13.194 2.860 -5.004 1.00 0.00 H new ATOM 1714 N SER B 28 15.402 1.064 -5.411 1.00 0.00 N ATOM 1715 CA SER B 28 15.669 -0.155 -6.141 1.00 0.00 C ATOM 1716 C SER B 28 17.165 -0.425 -6.228 1.00 0.00 C ATOM 1717 O SER B 28 17.601 -1.575 -6.140 1.00 0.00 O ATOM 1718 CB SER B 28 15.052 -0.107 -7.539 1.00 0.00 C ATOM 1719 OG SER B 28 15.618 0.938 -8.311 1.00 0.00 O ATOM 0 H SER B 28 14.970 1.812 -5.954 1.00 0.00 H new ATOM 0 HA SER B 28 15.205 -0.975 -5.592 1.00 0.00 H new ATOM 0 HB2 SER B 28 15.209 -1.061 -8.042 1.00 0.00 H new ATOM 0 HB3 SER B 28 13.975 0.038 -7.460 1.00 0.00 H new ATOM 0 HG SER B 28 15.369 1.803 -7.923 1.00 0.00 H new ATOM 1725 N VAL B 29 17.944 0.639 -6.387 1.00 0.00 N ATOM 1726 CA VAL B 29 19.388 0.523 -6.476 1.00 0.00 C ATOM 1727 C VAL B 29 19.995 0.387 -5.087 1.00 0.00 C ATOM 1728 O VAL B 29 20.864 -0.452 -4.848 1.00 0.00 O ATOM 1729 CB VAL B 29 19.977 1.759 -7.199 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.889 2.571 -6.292 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.704 1.345 -8.469 1.00 0.00 C ATOM 0 H VAL B 29 17.594 1.595 -6.457 1.00 0.00 H new ATOM 0 HA VAL B 29 19.632 -0.371 -7.050 1.00 0.00 H new ATOM 0 HB VAL B 29 19.141 2.403 -7.473 1.00 0.00 H new ATOM 0 HG11 VAL B 29 21.279 3.428 -6.841 1.00 0.00 H new ATOM 0 HG12 VAL B 29 20.325 2.920 -5.427 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.718 1.947 -5.957 1.00 0.00 H new ATOM 0 HG21 VAL B 29 21.110 2.229 -8.961 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.517 0.664 -8.217 1.00 0.00 H new ATOM 0 HG23 VAL B 29 20.007 0.844 -9.141 1.00 0.00 H new ATOM 1741 N TYR B 30 19.531 1.235 -4.182 1.00 0.00 N ATOM 1742 CA TYR B 30 20.020 1.239 -2.811 1.00 0.00 C ATOM 1743 C TYR B 30 19.492 0.048 -2.019 1.00 0.00 C ATOM 1744 O TYR B 30 20.110 -0.366 -1.037 1.00 0.00 O ATOM 1745 CB TYR B 30 19.628 2.540 -2.107 1.00 0.00 C ATOM 1746 CG TYR B 30 20.342 3.762 -2.641 1.00 0.00 C ATOM 1747 CD1 TYR B 30 19.663 4.958 -2.831 1.00 0.00 C ATOM 1748 CD2 TYR B 30 21.696 3.720 -2.953 1.00 0.00 C ATOM 1749 CE1 TYR B 30 20.310 6.077 -3.318 1.00 0.00 C ATOM 1750 CE2 TYR B 30 22.350 4.835 -3.440 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.654 6.011 -3.620 1.00 0.00 C ATOM 1752 OH TYR B 30 22.303 7.124 -4.103 1.00 0.00 O ATOM 0 H TYR B 30 18.812 1.933 -4.374 1.00 0.00 H new ATOM 0 HA TYR B 30 21.106 1.162 -2.855 1.00 0.00 H new ATOM 0 HB2 TYR B 30 18.553 2.686 -2.207 1.00 0.00 H new ATOM 0 HB3 TYR B 30 19.839 2.444 -1.042 1.00 0.00 H new ATOM 0 HD1 TYR B 30 18.611 5.014 -2.594 1.00 0.00 H new ATOM 0 HD2 TYR B 30 22.245 2.801 -2.812 1.00 0.00 H new ATOM 0 HE1 TYR B 30 19.766 6.999 -3.462 1.00 0.00 H new ATOM 0 HE2 TYR B 30 23.402 4.786 -3.679 1.00 0.00 H new ATOM 0 HH TYR B 30 23.246 6.909 -4.264 1.00 0.00 H new ATOM 1762 N LEU B 31 18.354 -0.512 -2.434 1.00 0.00 N ATOM 1763 CA LEU B 31 17.791 -1.653 -1.726 1.00 0.00 C ATOM 1764 C LEU B 31 17.920 -2.925 -2.559 1.00 0.00 C ATOM 1765 O LEU B 31 17.579 -4.013 -2.096 1.00 0.00 O ATOM 1766 CB LEU B 31 16.313 -1.412 -1.369 1.00 0.00 C ATOM 1767 CG LEU B 31 15.948 -0.030 -0.786 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.929 -0.182 0.331 1.00 0.00 C ATOM 1769 CD2 LEU B 31 17.171 0.723 -0.276 1.00 0.00 C ATOM 0 H LEU B 31 17.816 -0.198 -3.242 1.00 0.00 H new ATOM 0 HA LEU B 31 18.356 -1.776 -0.802 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.718 -1.568 -2.269 1.00 0.00 H new ATOM 0 HB3 LEU B 31 16.010 -2.173 -0.650 1.00 0.00 H new ATOM 0 HG LEU B 31 15.517 0.557 -1.597 1.00 0.00 H new ATOM 0 HD11 LEU B 31 14.681 0.800 0.733 1.00 0.00 H new ATOM 0 HD12 LEU B 31 14.027 -0.652 -0.061 1.00 0.00 H new ATOM 0 HD13 LEU B 31 15.347 -0.803 1.123 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.863 1.689 0.124 1.00 0.00 H new ATOM 0 HD22 LEU B 31 17.654 0.142 0.510 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.872 0.877 -1.097 1.00 0.00 H new ATOM 1781 N ASN B 32 18.405 -2.788 -3.794 1.00 0.00 N ATOM 1782 CA ASN B 32 18.558 -3.934 -4.682 1.00 0.00 C ATOM 1783 C ASN B 32 17.230 -4.668 -4.804 1.00 0.00 C ATOM 1784 O ASN B 32 17.182 -5.897 -4.873 1.00 0.00 O ATOM 1785 CB ASN B 32 19.644 -4.878 -4.154 1.00 0.00 C ATOM 1786 CG ASN B 32 20.829 -4.978 -5.095 1.00 0.00 C ATOM 1787 OD1 ASN B 32 21.396 -3.965 -5.507 1.00 0.00 O ATOM 1788 ND2 ASN B 32 21.210 -6.202 -5.441 1.00 0.00 N ATOM 0 H ASN B 32 18.697 -1.898 -4.198 1.00 0.00 H new ATOM 0 HA ASN B 32 18.861 -3.582 -5.668 1.00 0.00 H new ATOM 0 HB2 ASN B 32 19.985 -4.527 -3.180 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.218 -5.870 -4.004 1.00 0.00 H new ATOM 0 HD21 ASN B 32 22.001 -6.331 -6.072 1.00 0.00 H new ATOM 0 HD22 ASN B 32 20.712 -7.014 -5.076 1.00 0.00 H new ATOM 1795 N ARG B 33 16.152 -3.893 -4.810 1.00 0.00 N ATOM 1796 CA ARG B 33 14.808 -4.452 -4.902 1.00 0.00 C ATOM 1797 C ARG B 33 14.029 -3.840 -6.056 1.00 0.00 C ATOM 1798 O ARG B 33 14.086 -2.633 -6.284 1.00 0.00 O ATOM 1799 CB ARG B 33 14.050 -4.209 -3.594 1.00 0.00 C ATOM 1800 CG ARG B 33 14.533 -5.075 -2.443 1.00 0.00 C ATOM 1801 CD ARG B 33 13.649 -4.917 -1.216 1.00 0.00 C ATOM 1802 NE ARG B 33 14.047 -5.814 -0.135 1.00 0.00 N ATOM 1803 CZ ARG B 33 13.818 -7.125 -0.137 1.00 0.00 C ATOM 1804 NH1 ARG B 33 13.195 -7.695 -1.162 1.00 0.00 N ATOM 1805 NH2 ARG B 33 14.213 -7.869 0.886 1.00 0.00 N ATOM 0 H ARG B 33 16.182 -2.875 -4.752 1.00 0.00 H new ATOM 0 HA ARG B 33 14.905 -5.523 -5.082 1.00 0.00 H new ATOM 0 HB2 ARG B 33 14.149 -3.160 -3.315 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.989 -4.396 -3.758 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.544 -6.120 -2.753 1.00 0.00 H new ATOM 0 HG3 ARG B 33 15.559 -4.807 -2.190 1.00 0.00 H new ATOM 0 HD2 ARG B 33 13.695 -3.886 -0.867 1.00 0.00 H new ATOM 0 HD3 ARG B 33 12.612 -5.115 -1.488 1.00 0.00 H new ATOM 0 HE ARG B 33 14.529 -5.412 0.669 1.00 0.00 H new ATOM 0 HH11 ARG B 33 12.890 -7.128 -1.953 1.00 0.00 H new ATOM 0 HH12 ARG B 33 13.022 -8.700 -1.159 1.00 0.00 H new ATOM 0 HH21 ARG B 33 14.693 -7.437 1.676 1.00 0.00 H new ATOM 0 HH22 ARG B 33 14.037 -8.874 0.884 1.00 0.00 H new ATOM 1819 N ASP B 34 13.281 -4.672 -6.771 1.00 0.00 N ATOM 1820 CA ASP B 34 12.473 -4.191 -7.881 1.00 0.00 C ATOM 1821 C ASP B 34 11.520 -3.114 -7.384 1.00 0.00 C ATOM 1822 O ASP B 34 11.297 -2.989 -6.180 1.00 0.00 O ATOM 1823 CB ASP B 34 11.690 -5.342 -8.517 1.00 0.00 C ATOM 1824 CG ASP B 34 11.683 -5.269 -10.030 1.00 0.00 C ATOM 1825 OD1 ASP B 34 11.631 -4.144 -10.571 1.00 0.00 O ATOM 1826 OD2 ASP B 34 11.730 -6.337 -10.676 1.00 0.00 O ATOM 0 H ASP B 34 13.218 -5.676 -6.602 1.00 0.00 H new ATOM 0 HA ASP B 34 13.130 -3.768 -8.641 1.00 0.00 H new ATOM 0 HB2 ASP B 34 12.125 -6.291 -8.204 1.00 0.00 H new ATOM 0 HB3 ASP B 34 10.664 -5.326 -8.150 1.00 0.00 H new ATOM 1831 N MET B 35 10.963 -2.334 -8.298 1.00 0.00 N ATOM 1832 CA MET B 35 10.051 -1.279 -7.913 1.00 0.00 C ATOM 1833 C MET B 35 8.806 -1.866 -7.250 1.00 0.00 C ATOM 1834 O MET B 35 8.299 -1.323 -6.270 1.00 0.00 O ATOM 1835 CB MET B 35 9.678 -0.434 -9.134 1.00 0.00 C ATOM 1836 CG MET B 35 8.209 -0.066 -9.192 1.00 0.00 C ATOM 1837 SD MET B 35 7.860 1.245 -10.378 1.00 0.00 S ATOM 1838 CE MET B 35 6.502 2.083 -9.565 1.00 0.00 C ATOM 0 H MET B 35 11.127 -2.414 -9.302 1.00 0.00 H new ATOM 0 HA MET B 35 10.544 -0.632 -7.188 1.00 0.00 H new ATOM 0 HB2 MET B 35 10.273 0.479 -9.129 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.943 -0.981 -10.039 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.628 -0.950 -9.454 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.879 0.249 -8.202 1.00 0.00 H new ATOM 0 HE1 MET B 35 6.035 2.780 -10.261 1.00 0.00 H new ATOM 0 HE2 MET B 35 5.765 1.349 -9.237 1.00 0.00 H new ATOM 0 HE3 MET B 35 6.878 2.631 -8.701 1.00 0.00 H new ATOM 1848 N THR B 36 8.324 -2.977 -7.793 1.00 0.00 N ATOM 1849 CA THR B 36 7.141 -3.635 -7.253 1.00 0.00 C ATOM 1850 C THR B 36 7.439 -4.255 -5.893 1.00 0.00 C ATOM 1851 O THR B 36 6.555 -4.366 -5.043 1.00 0.00 O ATOM 1852 CB THR B 36 6.639 -4.705 -8.230 1.00 0.00 C ATOM 1853 OG1 THR B 36 6.882 -4.311 -9.569 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.160 -5.003 -8.103 1.00 0.00 C ATOM 0 H THR B 36 8.733 -3.440 -8.605 1.00 0.00 H new ATOM 0 HA THR B 36 6.361 -2.885 -7.121 1.00 0.00 H new ATOM 0 HB THR B 36 7.193 -5.607 -7.970 1.00 0.00 H new ATOM 0 HG1 THR B 36 6.557 -5.006 -10.179 1.00 0.00 H new ATOM 0 HG21 THR B 36 4.880 -5.769 -8.826 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.946 -5.359 -7.095 1.00 0.00 H new ATOM 0 HG23 THR B 36 4.588 -4.095 -8.296 1.00 0.00 H new ATOM 1862 N GLU B 37 8.693 -4.647 -5.685 1.00 0.00 N ATOM 1863 CA GLU B 37 9.105 -5.242 -4.421 1.00 0.00 C ATOM 1864 C GLU B 37 9.269 -4.160 -3.358 1.00 0.00 C ATOM 1865 O GLU B 37 8.942 -4.366 -2.189 1.00 0.00 O ATOM 1866 CB GLU B 37 10.415 -6.014 -4.596 1.00 0.00 C ATOM 1867 CG GLU B 37 10.382 -7.410 -3.998 1.00 0.00 C ATOM 1868 CD GLU B 37 10.158 -8.486 -5.042 1.00 0.00 C ATOM 1869 OE1 GLU B 37 9.582 -9.539 -4.698 1.00 0.00 O ATOM 1870 OE2 GLU B 37 10.560 -8.276 -6.206 1.00 0.00 O ATOM 0 H GLU B 37 9.439 -4.563 -6.375 1.00 0.00 H new ATOM 0 HA GLU B 37 8.332 -5.939 -4.097 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.644 -6.088 -5.659 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.225 -5.449 -4.134 1.00 0.00 H new ATOM 0 HG2 GLU B 37 11.322 -7.602 -3.480 1.00 0.00 H new ATOM 0 HG3 GLU B 37 9.590 -7.463 -3.251 1.00 0.00 H new ATOM 1877 N ILE B 38 9.772 -3.004 -3.780 1.00 0.00 N ATOM 1878 CA ILE B 38 9.976 -1.877 -2.878 1.00 0.00 C ATOM 1879 C ILE B 38 8.656 -1.164 -2.597 1.00 0.00 C ATOM 1880 O ILE B 38 8.342 -0.866 -1.449 1.00 0.00 O ATOM 1881 CB ILE B 38 10.976 -0.860 -3.471 1.00 0.00 C ATOM 1882 CG1 ILE B 38 12.431 -1.316 -3.290 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.796 0.514 -2.846 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.755 -1.771 -1.883 1.00 0.00 C ATOM 0 H ILE B 38 10.047 -2.823 -4.746 1.00 0.00 H new ATOM 0 HA ILE B 38 10.382 -2.277 -1.949 1.00 0.00 H new ATOM 0 HB ILE B 38 10.763 -0.800 -4.538 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.636 -2.132 -3.983 1.00 0.00 H new ATOM 0 HG13 ILE B 38 13.096 -0.495 -3.559 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.513 1.209 -3.283 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.784 0.870 -3.036 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.962 0.449 -1.771 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.800 -2.078 -1.831 1.00 0.00 H new ATOM 0 HD12 ILE B 38 12.583 -0.950 -1.187 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.116 -2.613 -1.617 1.00 0.00 H new ATOM 1896 N ILE B 39 7.884 -0.888 -3.650 1.00 0.00 N ATOM 1897 CA ILE B 39 6.605 -0.207 -3.483 1.00 0.00 C ATOM 1898 C ILE B 39 5.690 -1.029 -2.596 1.00 0.00 C ATOM 1899 O ILE B 39 4.959 -0.493 -1.762 1.00 0.00 O ATOM 1900 CB ILE B 39 5.896 0.024 -4.830 1.00 0.00 C ATOM 1901 CG1 ILE B 39 5.557 -1.314 -5.479 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.761 0.860 -5.758 1.00 0.00 C ATOM 1903 CD1 ILE B 39 4.200 -1.851 -5.082 1.00 0.00 C ATOM 0 H ILE B 39 8.120 -1.123 -4.614 1.00 0.00 H new ATOM 0 HA ILE B 39 6.816 0.761 -3.027 1.00 0.00 H new ATOM 0 HB ILE B 39 4.971 0.570 -4.645 1.00 0.00 H new ATOM 0 HG12 ILE B 39 5.592 -1.202 -6.563 1.00 0.00 H new ATOM 0 HG13 ILE B 39 6.321 -2.043 -5.209 1.00 0.00 H new ATOM 0 HG21 ILE B 39 6.240 1.011 -6.704 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.961 1.827 -5.296 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.703 0.343 -5.941 1.00 0.00 H new ATOM 0 HD11 ILE B 39 4.026 -2.804 -5.581 1.00 0.00 H new ATOM 0 HD12 ILE B 39 4.167 -1.995 -4.002 1.00 0.00 H new ATOM 0 HD13 ILE B 39 3.427 -1.141 -5.377 1.00 0.00 H new ATOM 1915 N GLU B 40 5.741 -2.339 -2.788 1.00 0.00 N ATOM 1916 CA GLU B 40 4.925 -3.252 -2.017 1.00 0.00 C ATOM 1917 C GLU B 40 5.501 -3.421 -0.621 1.00 0.00 C ATOM 1918 O GLU B 40 4.770 -3.712 0.327 1.00 0.00 O ATOM 1919 CB GLU B 40 4.826 -4.606 -2.727 1.00 0.00 C ATOM 1920 CG GLU B 40 4.192 -5.702 -1.886 1.00 0.00 C ATOM 1921 CD GLU B 40 5.211 -6.689 -1.352 1.00 0.00 C ATOM 1922 OE1 GLU B 40 5.080 -7.895 -1.646 1.00 0.00 O ATOM 1923 OE2 GLU B 40 6.142 -6.254 -0.640 1.00 0.00 O ATOM 0 H GLU B 40 6.344 -2.791 -3.476 1.00 0.00 H new ATOM 0 HA GLU B 40 3.921 -2.836 -1.928 1.00 0.00 H new ATOM 0 HB2 GLU B 40 4.246 -4.483 -3.642 1.00 0.00 H new ATOM 0 HB3 GLU B 40 5.826 -4.923 -3.024 1.00 0.00 H new ATOM 0 HG2 GLU B 40 3.657 -5.250 -1.051 1.00 0.00 H new ATOM 0 HG3 GLU B 40 3.455 -6.235 -2.486 1.00 0.00 H new ATOM 1930 N GLU B 41 6.808 -3.220 -0.486 1.00 0.00 N ATOM 1931 CA GLU B 41 7.440 -3.336 0.818 1.00 0.00 C ATOM 1932 C GLU B 41 7.309 -2.021 1.576 1.00 0.00 C ATOM 1933 O GLU B 41 7.185 -2.004 2.801 1.00 0.00 O ATOM 1934 CB GLU B 41 8.912 -3.726 0.674 1.00 0.00 C ATOM 1935 CG GLU B 41 9.141 -5.228 0.645 1.00 0.00 C ATOM 1936 CD GLU B 41 10.441 -5.606 -0.038 1.00 0.00 C ATOM 1937 OE1 GLU B 41 10.386 -6.280 -1.088 1.00 0.00 O ATOM 1938 OE2 GLU B 41 11.514 -5.230 0.478 1.00 0.00 O ATOM 0 H GLU B 41 7.439 -2.980 -1.251 1.00 0.00 H new ATOM 0 HA GLU B 41 6.936 -4.121 1.381 1.00 0.00 H new ATOM 0 HB2 GLU B 41 9.308 -3.288 -0.243 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.476 -3.296 1.502 1.00 0.00 H new ATOM 0 HG2 GLU B 41 9.146 -5.611 1.666 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.310 -5.709 0.128 1.00 0.00 H new ATOM 1945 N ALA B 42 7.325 -0.920 0.830 1.00 0.00 N ATOM 1946 CA ALA B 42 7.204 0.406 1.423 1.00 0.00 C ATOM 1947 C ALA B 42 5.762 0.693 1.817 1.00 0.00 C ATOM 1948 O ALA B 42 5.501 1.300 2.855 1.00 0.00 O ATOM 1949 CB ALA B 42 7.709 1.464 0.455 1.00 0.00 C ATOM 0 H ALA B 42 7.421 -0.921 -0.186 1.00 0.00 H new ATOM 0 HA ALA B 42 7.816 0.435 2.325 1.00 0.00 H new ATOM 0 HB1 ALA B 42 7.613 2.450 0.911 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.756 1.273 0.221 1.00 0.00 H new ATOM 0 HB3 ALA B 42 7.120 1.429 -0.462 1.00 0.00 H new ATOM 1955 N VAL B 43 4.827 0.252 0.980 1.00 0.00 N ATOM 1956 CA VAL B 43 3.408 0.463 1.244 1.00 0.00 C ATOM 1957 C VAL B 43 3.012 -0.097 2.594 1.00 0.00 C ATOM 1958 O VAL B 43 2.573 0.627 3.486 1.00 0.00 O ATOM 1959 CB VAL B 43 2.520 -0.206 0.163 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.955 -1.627 -0.114 1.00 0.00 C ATOM 1961 CG2 VAL B 43 1.064 -0.198 0.579 1.00 0.00 C ATOM 0 H VAL B 43 5.026 -0.252 0.116 1.00 0.00 H new ATOM 0 HA VAL B 43 3.250 1.541 1.229 1.00 0.00 H new ATOM 0 HB VAL B 43 2.637 0.377 -0.750 1.00 0.00 H new ATOM 0 HG11 VAL B 43 2.310 -2.063 -0.877 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.986 -1.630 -0.467 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.883 -2.214 0.801 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.462 -0.673 -0.196 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.950 -0.746 1.514 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.731 0.831 0.718 1.00 0.00 H new ATOM 1971 N VAL B 44 3.166 -1.396 2.719 1.00 0.00 N ATOM 1972 CA VAL B 44 2.827 -2.096 3.938 1.00 0.00 C ATOM 1973 C VAL B 44 3.568 -1.496 5.121 1.00 0.00 C ATOM 1974 O VAL B 44 2.960 -1.113 6.118 1.00 0.00 O ATOM 1975 CB VAL B 44 3.157 -3.594 3.788 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.740 -4.187 5.067 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.932 -4.375 3.344 1.00 0.00 C ATOM 0 H VAL B 44 3.529 -1.997 1.979 1.00 0.00 H new ATOM 0 HA VAL B 44 1.758 -1.990 4.123 1.00 0.00 H new ATOM 0 HB VAL B 44 3.922 -3.677 3.016 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.956 -5.244 4.912 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.660 -3.662 5.325 1.00 0.00 H new ATOM 0 HG13 VAL B 44 3.021 -4.079 5.879 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.189 -5.430 3.245 1.00 0.00 H new ATOM 0 HG22 VAL B 44 1.141 -4.263 4.085 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.586 -3.994 2.383 1.00 0.00 H new ATOM 1987 N MET B 45 4.881 -1.408 5.004 1.00 0.00 N ATOM 1988 CA MET B 45 5.686 -0.845 6.075 1.00 0.00 C ATOM 1989 C MET B 45 5.211 0.560 6.425 1.00 0.00 C ATOM 1990 O MET B 45 5.361 1.002 7.563 1.00 0.00 O ATOM 1991 CB MET B 45 7.164 -0.829 5.692 1.00 0.00 C ATOM 1992 CG MET B 45 8.090 -1.155 6.851 1.00 0.00 C ATOM 1993 SD MET B 45 7.779 -2.787 7.552 1.00 0.00 S ATOM 1994 CE MET B 45 8.044 -2.462 9.293 1.00 0.00 C ATOM 0 H MET B 45 5.409 -1.715 4.187 1.00 0.00 H new ATOM 0 HA MET B 45 5.567 -1.478 6.955 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.332 -1.547 4.889 1.00 0.00 H new ATOM 0 HB3 MET B 45 7.419 0.155 5.298 1.00 0.00 H new ATOM 0 HG2 MET B 45 9.124 -1.101 6.511 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.971 -0.401 7.629 1.00 0.00 H new ATOM 0 HE1 MET B 45 7.393 -3.104 9.886 1.00 0.00 H new ATOM 0 HE2 MET B 45 9.084 -2.666 9.547 1.00 0.00 H new ATOM 0 HE3 MET B 45 7.816 -1.418 9.507 1.00 0.00 H new ATOM 2004 N TRP B 46 4.618 1.258 5.455 1.00 0.00 N ATOM 2005 CA TRP B 46 4.115 2.599 5.712 1.00 0.00 C ATOM 2006 C TRP B 46 2.890 2.526 6.610 1.00 0.00 C ATOM 2007 O TRP B 46 2.860 3.118 7.689 1.00 0.00 O ATOM 2008 CB TRP B 46 3.768 3.314 4.407 1.00 0.00 C ATOM 2009 CG TRP B 46 3.349 4.736 4.616 1.00 0.00 C ATOM 2010 CD1 TRP B 46 4.138 5.845 4.519 1.00 0.00 C ATOM 2011 CD2 TRP B 46 2.040 5.204 4.966 1.00 0.00 C ATOM 2012 NE1 TRP B 46 3.401 6.972 4.785 1.00 0.00 N ATOM 2013 CE2 TRP B 46 2.110 6.605 5.061 1.00 0.00 C ATOM 2014 CE3 TRP B 46 0.816 4.573 5.206 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 1.004 7.386 5.387 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 -0.281 5.349 5.529 1.00 0.00 C ATOM 2017 CH2 TRP B 46 -0.180 6.743 5.617 1.00 0.00 C ATOM 0 H TRP B 46 4.478 0.921 4.503 1.00 0.00 H new ATOM 0 HA TRP B 46 4.897 3.170 6.213 1.00 0.00 H new ATOM 0 HB2 TRP B 46 4.633 3.289 3.744 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.965 2.774 3.905 1.00 0.00 H new ATOM 0 HD1 TRP B 46 5.189 5.837 4.269 1.00 0.00 H new ATOM 0 HE1 TRP B 46 3.757 7.928 4.778 1.00 0.00 H new ATOM 0 HE3 TRP B 46 0.729 3.499 5.140 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 1.079 8.461 5.456 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -1.232 4.873 5.717 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -1.055 7.322 5.872 1.00 0.00 H new ATOM 2028 N LEU B 47 1.885 1.780 6.164 1.00 0.00 N ATOM 2029 CA LEU B 47 0.662 1.610 6.941 1.00 0.00 C ATOM 2030 C LEU B 47 0.980 1.016 8.295 1.00 0.00 C ATOM 2031 O LEU B 47 0.430 1.413 9.319 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.327 0.672 6.242 1.00 0.00 C ATOM 2033 CG LEU B 47 0.280 -0.433 5.374 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.334 -1.736 6.154 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.524 -0.611 4.094 1.00 0.00 C ATOM 0 H LEU B 47 1.892 1.285 5.272 1.00 0.00 H new ATOM 0 HA LEU B 47 0.214 2.598 7.045 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -0.951 0.204 7.004 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -0.986 1.275 5.617 1.00 0.00 H new ATOM 0 HG LEU B 47 1.295 -0.145 5.101 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.767 -2.517 5.529 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.948 -1.602 7.045 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.675 -2.025 6.449 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.077 -1.401 3.490 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.550 -0.882 4.343 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.522 0.322 3.530 1.00 0.00 H new ATOM 2047 N ILE B 48 1.853 0.029 8.274 1.00 0.00 N ATOM 2048 CA ILE B 48 2.240 -0.674 9.469 1.00 0.00 C ATOM 2049 C ILE B 48 2.951 0.231 10.462 1.00 0.00 C ATOM 2050 O ILE B 48 2.727 0.134 11.667 1.00 0.00 O ATOM 2051 CB ILE B 48 3.123 -1.880 9.100 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.390 -3.164 9.438 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.474 -1.823 9.795 1.00 0.00 C ATOM 2054 CD1 ILE B 48 1.051 -3.303 8.739 1.00 0.00 C ATOM 0 H ILE B 48 2.311 -0.304 7.426 1.00 0.00 H new ATOM 0 HA ILE B 48 1.332 -1.027 9.959 1.00 0.00 H new ATOM 0 HB ILE B 48 3.319 -1.850 8.028 1.00 0.00 H new ATOM 0 HG12 ILE B 48 3.020 -4.013 9.170 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.234 -3.210 10.516 1.00 0.00 H new ATOM 0 HG21 ILE B 48 5.067 -2.691 9.509 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.997 -0.913 9.500 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.328 -1.824 10.875 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.585 -4.245 9.029 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.403 -2.475 9.026 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.201 -3.290 7.659 1.00 0.00 H new ATOM 2066 N GLN B 49 3.811 1.104 9.963 1.00 0.00 N ATOM 2067 CA GLN B 49 4.536 2.001 10.842 1.00 0.00 C ATOM 2068 C GLN B 49 3.649 3.158 11.295 1.00 0.00 C ATOM 2069 O GLN B 49 3.929 3.804 12.305 1.00 0.00 O ATOM 2070 CB GLN B 49 5.802 2.530 10.156 1.00 0.00 C ATOM 2071 CG GLN B 49 5.545 3.612 9.112 1.00 0.00 C ATOM 2072 CD GLN B 49 6.721 4.555 8.950 1.00 0.00 C ATOM 2073 OE1 GLN B 49 6.544 5.765 8.803 1.00 0.00 O ATOM 2074 NE2 GLN B 49 7.930 4.007 8.975 1.00 0.00 N ATOM 0 H GLN B 49 4.021 1.209 8.970 1.00 0.00 H new ATOM 0 HA GLN B 49 4.834 1.436 11.725 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.474 2.928 10.917 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.318 1.697 9.679 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.326 3.142 8.153 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.662 4.184 9.396 1.00 0.00 H new ATOM 0 HE21 GLN B 49 8.031 3.000 9.099 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.758 4.593 8.870 1.00 0.00 H new ATOM 2083 N ASN B 50 2.587 3.425 10.538 1.00 0.00 N ATOM 2084 CA ASN B 50 1.673 4.515 10.868 1.00 0.00 C ATOM 2085 C ASN B 50 0.442 4.016 11.617 1.00 0.00 C ATOM 2086 O ASN B 50 0.177 4.429 12.746 1.00 0.00 O ATOM 2087 CB ASN B 50 1.244 5.245 9.592 1.00 0.00 C ATOM 2088 CG ASN B 50 1.931 6.588 9.436 1.00 0.00 C ATOM 2089 OD1 ASN B 50 1.356 7.632 9.745 1.00 0.00 O ATOM 2090 ND2 ASN B 50 3.167 6.568 8.953 1.00 0.00 N ATOM 0 H ASN B 50 2.339 2.904 9.696 1.00 0.00 H new ATOM 0 HA ASN B 50 2.206 5.204 11.524 1.00 0.00 H new ATOM 0 HB2 ASN B 50 1.470 4.622 8.727 1.00 0.00 H new ATOM 0 HB3 ASN B 50 0.164 5.392 9.606 1.00 0.00 H new ATOM 0 HD21 ASN B 50 3.679 7.441 8.825 1.00 0.00 H new ATOM 0 HD22 ASN B 50 3.605 5.680 8.710 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.312 3.142 10.968 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.535 2.586 11.540 1.00 0.00 C ATOM 2099 C LYS B 51 -1.291 1.927 12.894 1.00 0.00 C ATOM 2100 O LYS B 51 -1.895 2.311 13.896 1.00 0.00 O ATOM 2101 CB LYS B 51 -2.147 1.574 10.574 1.00 0.00 C ATOM 2102 CG LYS B 51 -2.393 2.136 9.183 1.00 0.00 C ATOM 2103 CD LYS B 51 -3.259 3.386 9.226 1.00 0.00 C ATOM 2104 CE LYS B 51 -4.728 3.039 9.394 1.00 0.00 C ATOM 2105 NZ LYS B 51 -5.019 2.482 10.743 1.00 0.00 N ATOM 0 H LYS B 51 -0.097 2.797 10.033 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.227 3.413 11.698 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -1.485 0.711 10.497 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -3.091 1.216 10.985 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -1.439 2.371 8.711 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.877 1.379 8.565 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -2.938 4.024 10.049 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -3.122 3.957 8.308 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -5.332 3.932 9.232 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -5.019 2.315 8.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -5.975 2.766 11.037 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -4.961 1.444 10.710 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -4.324 2.846 11.426 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.416 0.924 12.921 1.00 0.00 N ATOM 2120 CA GLU B 52 -0.111 0.205 14.157 1.00 0.00 C ATOM 2121 C GLU B 52 0.111 1.170 15.320 1.00 0.00 C ATOM 2122 O GLU B 52 -0.149 0.836 16.475 1.00 0.00 O ATOM 2123 CB GLU B 52 1.124 -0.676 13.967 1.00 0.00 C ATOM 2124 CG GLU B 52 1.070 -1.974 14.755 1.00 0.00 C ATOM 2125 CD GLU B 52 0.884 -1.746 16.242 1.00 0.00 C ATOM 2126 OE1 GLU B 52 1.882 -1.435 16.925 1.00 0.00 O ATOM 2127 OE2 GLU B 52 -0.261 -1.878 16.724 1.00 0.00 O ATOM 0 H GLU B 52 0.094 0.591 12.103 1.00 0.00 H new ATOM 0 HA GLU B 52 -0.968 -0.425 14.397 1.00 0.00 H new ATOM 0 HB2 GLU B 52 1.236 -0.908 12.908 1.00 0.00 H new ATOM 0 HB3 GLU B 52 2.010 -0.115 14.266 1.00 0.00 H new ATOM 0 HG2 GLU B 52 0.251 -2.588 14.380 1.00 0.00 H new ATOM 0 HG3 GLU B 52 1.990 -2.534 14.589 1.00 0.00 H new ATOM 2134 N LYS B 53 0.588 2.368 15.004 1.00 0.00 N ATOM 2135 CA LYS B 53 0.842 3.384 16.017 1.00 0.00 C ATOM 2136 C LYS B 53 0.112 4.681 15.674 1.00 0.00 C ATOM 2137 O LYS B 53 0.570 5.768 16.024 1.00 0.00 O ATOM 2138 CB LYS B 53 2.343 3.645 16.152 1.00 0.00 C ATOM 2139 CG LYS B 53 3.009 4.066 14.852 1.00 0.00 C ATOM 2140 CD LYS B 53 4.034 5.165 15.080 1.00 0.00 C ATOM 2141 CE LYS B 53 3.461 6.536 14.760 1.00 0.00 C ATOM 2142 NZ LYS B 53 3.161 6.688 13.309 1.00 0.00 N ATOM 0 H LYS B 53 0.807 2.660 14.051 1.00 0.00 H new ATOM 0 HA LYS B 53 0.465 3.014 16.970 1.00 0.00 H new ATOM 0 HB2 LYS B 53 2.502 4.422 16.900 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.828 2.742 16.523 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.495 3.204 14.395 1.00 0.00 H new ATOM 0 HG3 LYS B 53 2.251 4.414 14.150 1.00 0.00 H new ATOM 0 HD2 LYS B 53 4.369 5.142 16.117 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.910 4.981 14.458 1.00 0.00 H new ATOM 0 HE2 LYS B 53 2.550 6.692 15.337 1.00 0.00 H new ATOM 0 HE3 LYS B 53 4.169 7.306 15.067 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 3.536 7.597 12.970 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 3.605 5.911 12.779 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 2.132 6.662 13.163 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.020 4.555 14.980 1.00 0.00 N ATOM 2157 CA LEU B 54 -1.813 5.715 14.573 1.00 0.00 C ATOM 2158 C LEU B 54 -2.149 6.599 15.774 1.00 0.00 C ATOM 2159 O LEU B 54 -3.058 6.293 16.544 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.107 5.253 13.900 1.00 0.00 C ATOM 2161 CG LEU B 54 -3.855 6.336 13.122 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -3.097 6.705 11.858 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.263 5.871 12.786 1.00 0.00 C ATOM 0 H LEU B 54 -1.409 3.659 14.688 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.221 6.299 13.868 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -2.872 4.435 13.219 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.772 4.851 14.664 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.926 7.225 13.749 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -3.645 7.477 11.318 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -2.108 7.080 12.123 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -2.993 5.823 11.225 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -5.782 6.653 12.232 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -5.212 4.968 12.177 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.805 5.658 13.707 1.00 0.00 H new ATOM 2175 N PRO B 55 -1.412 7.714 15.950 1.00 0.00 N ATOM 2176 CA PRO B 55 -1.625 8.644 17.057 1.00 0.00 C ATOM 2177 C PRO B 55 -2.798 9.586 16.810 1.00 0.00 C ATOM 2178 O PRO B 55 -3.204 9.802 15.668 1.00 0.00 O ATOM 2179 CB PRO B 55 -0.310 9.441 17.130 1.00 0.00 C ATOM 2180 CG PRO B 55 0.578 8.886 16.058 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.315 8.164 15.089 1.00 0.00 C ATOM 0 HA PRO B 55 -1.869 8.116 17.979 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -0.491 10.504 16.973 1.00 0.00 H new ATOM 0 HB3 PRO B 55 0.153 9.338 18.111 1.00 0.00 H new ATOM 0 HG2 PRO B 55 1.126 9.684 15.558 1.00 0.00 H new ATOM 0 HG3 PRO B 55 1.318 8.207 16.482 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -0.666 8.821 14.293 1.00 0.00 H new ATOM 0 HD3 PRO B 55 0.196 7.328 14.611 1.00 0.00 H new ATOM 2189 N ASN B 56 -3.332 10.154 17.887 1.00 0.00 N ATOM 2190 CA ASN B 56 -4.450 11.084 17.787 1.00 0.00 C ATOM 2191 C ASN B 56 -3.972 12.439 17.274 1.00 0.00 C ATOM 2192 O ASN B 56 -4.715 13.159 16.606 1.00 0.00 O ATOM 2193 CB ASN B 56 -5.131 11.249 19.147 1.00 0.00 C ATOM 2194 CG ASN B 56 -6.638 11.356 19.030 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -7.197 11.249 17.939 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -7.307 11.570 20.158 1.00 0.00 N ATOM 0 H ASN B 56 -3.008 9.986 18.839 1.00 0.00 H new ATOM 0 HA ASN B 56 -5.173 10.677 17.080 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -4.878 10.400 19.782 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -4.743 12.141 19.638 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -8.324 11.652 20.140 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -6.804 11.652 21.041 1.00 0.00 H new ATOM 2203 N GLU B 57 -2.726 12.778 17.589 1.00 0.00 N ATOM 2204 CA GLU B 57 -2.143 14.045 17.160 1.00 0.00 C ATOM 2205 C GLU B 57 -1.693 13.976 15.701 1.00 0.00 C ATOM 2206 O GLU B 57 -1.522 15.006 15.049 1.00 0.00 O ATOM 2207 CB GLU B 57 -0.956 14.413 18.054 1.00 0.00 C ATOM 2208 CG GLU B 57 0.069 13.298 18.195 1.00 0.00 C ATOM 2209 CD GLU B 57 0.098 12.705 19.590 1.00 0.00 C ATOM 2210 OE1 GLU B 57 1.207 12.432 20.096 1.00 0.00 O ATOM 2211 OE2 GLU B 57 -0.988 12.513 20.177 1.00 0.00 O ATOM 0 H GLU B 57 -2.099 12.192 18.141 1.00 0.00 H new ATOM 0 HA GLU B 57 -2.910 14.815 17.248 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -0.465 15.297 17.646 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -1.327 14.682 19.043 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -0.154 12.511 17.474 1.00 0.00 H new ATOM 0 HG3 GLU B 57 1.058 13.685 17.948 1.00 0.00 H new ATOM 2218 N LEU B 58 -1.502 12.760 15.197 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.074 12.563 13.816 1.00 0.00 C ATOM 2220 C LEU B 58 -2.273 12.555 12.872 1.00 0.00 C ATOM 2221 O LEU B 58 -2.144 12.887 11.694 1.00 0.00 O ATOM 2222 CB LEU B 58 -0.301 11.248 13.680 1.00 0.00 C ATOM 2223 CG LEU B 58 1.178 11.396 13.316 1.00 0.00 C ATOM 2224 CD1 LEU B 58 1.821 10.029 13.129 1.00 0.00 C ATOM 2225 CD2 LEU B 58 1.335 12.237 12.059 1.00 0.00 C ATOM 0 H LEU B 58 -1.637 11.897 15.724 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.421 13.392 13.544 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.374 10.703 14.621 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.786 10.637 12.919 1.00 0.00 H new ATOM 0 HG LEU B 58 1.686 11.905 14.136 1.00 0.00 H new ATOM 0 HD11 LEU B 58 2.873 10.154 12.871 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.740 9.459 14.055 1.00 0.00 H new ATOM 0 HD13 LEU B 58 1.312 9.494 12.328 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.393 12.332 11.815 1.00 0.00 H new ATOM 0 HD22 LEU B 58 0.813 11.756 11.232 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.911 13.227 12.228 1.00 0.00 H new ATOM 2237 N LYS B 59 -3.434 12.165 13.399 1.00 0.00 N ATOM 2238 CA LYS B 59 -4.666 12.098 12.612 1.00 0.00 C ATOM 2239 C LYS B 59 -4.777 13.269 11.633 1.00 0.00 C ATOM 2240 O LYS B 59 -5.022 13.069 10.444 1.00 0.00 O ATOM 2241 CB LYS B 59 -5.884 12.076 13.539 1.00 0.00 C ATOM 2242 CG LYS B 59 -6.907 11.014 13.172 1.00 0.00 C ATOM 2243 CD LYS B 59 -7.571 11.319 11.840 1.00 0.00 C ATOM 2244 CE LYS B 59 -8.576 12.451 11.965 1.00 0.00 C ATOM 2245 NZ LYS B 59 -9.689 12.318 10.984 1.00 0.00 N ATOM 0 H LYS B 59 -3.547 11.889 14.374 1.00 0.00 H new ATOM 0 HA LYS B 59 -4.636 11.177 12.030 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -5.549 11.908 14.562 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -6.364 13.054 13.518 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -6.420 10.040 13.123 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -7.665 10.952 13.952 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -6.811 11.586 11.106 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.073 10.425 11.469 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -8.983 12.465 12.976 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -8.070 13.404 11.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -10.353 13.110 11.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -9.304 12.331 10.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -10.189 11.420 11.146 1.00 0.00 H new ATOM 2259 N PRO B 60 -4.598 14.509 12.116 1.00 0.00 N ATOM 2260 CA PRO B 60 -4.680 15.701 11.269 1.00 0.00 C ATOM 2261 C PRO B 60 -3.573 15.737 10.223 1.00 0.00 C ATOM 2262 O PRO B 60 -3.757 16.278 9.132 1.00 0.00 O ATOM 2263 CB PRO B 60 -4.526 16.870 12.252 1.00 0.00 C ATOM 2264 CG PRO B 60 -4.749 16.283 13.606 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.306 14.851 13.515 1.00 0.00 C ATOM 0 HA PRO B 60 -5.613 15.731 10.707 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -3.535 17.318 12.177 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -5.249 17.658 12.042 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -4.178 16.821 14.363 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -5.799 16.349 13.892 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -3.247 14.740 13.746 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -4.853 14.213 14.210 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.427 15.156 10.557 1.00 0.00 N ATOM 2274 CA LYS B 61 -1.300 15.126 9.635 1.00 0.00 C ATOM 2275 C LYS B 61 -1.580 14.181 8.472 1.00 0.00 C ATOM 2276 O LYS B 61 -1.049 14.361 7.377 1.00 0.00 O ATOM 2277 CB LYS B 61 -0.015 14.711 10.349 1.00 0.00 C ATOM 2278 CG LYS B 61 1.243 15.188 9.640 1.00 0.00 C ATOM 2279 CD LYS B 61 1.825 14.104 8.750 1.00 0.00 C ATOM 2280 CE LYS B 61 2.997 13.402 9.415 1.00 0.00 C ATOM 2281 NZ LYS B 61 4.305 13.886 8.891 1.00 0.00 N ATOM 0 H LYS B 61 -2.255 14.702 11.454 1.00 0.00 H new ATOM 0 HA LYS B 61 -1.165 16.135 9.244 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -0.026 15.109 11.364 1.00 0.00 H new ATOM 0 HB3 LYS B 61 0.012 13.625 10.433 1.00 0.00 H new ATOM 0 HG2 LYS B 61 1.012 16.068 9.040 1.00 0.00 H new ATOM 0 HG3 LYS B 61 1.985 15.491 10.378 1.00 0.00 H new ATOM 0 HD2 LYS B 61 1.051 13.374 8.511 1.00 0.00 H new ATOM 0 HD3 LYS B 61 2.151 14.543 7.807 1.00 0.00 H new ATOM 0 HE2 LYS B 61 2.954 13.566 10.492 1.00 0.00 H new ATOM 0 HE3 LYS B 61 2.916 12.327 9.252 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 5.026 13.147 9.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 4.213 14.106 7.879 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 4.590 14.742 9.407 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.431 13.181 8.703 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.783 12.237 7.647 1.00 0.00 C ATOM 2297 C ILE B 62 -3.234 13.011 6.414 1.00 0.00 C ATOM 2298 O ILE B 62 -2.960 12.618 5.278 1.00 0.00 O ATOM 2299 CB ILE B 62 -3.885 11.250 8.106 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.263 10.090 8.886 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.684 10.720 6.921 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.310 10.535 9.973 1.00 0.00 C ATOM 0 H ILE B 62 -2.883 13.006 9.600 1.00 0.00 H new ATOM 0 HA ILE B 62 -1.902 11.642 7.405 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.571 11.791 8.757 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.059 9.495 9.333 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -2.731 9.440 8.192 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.449 10.030 7.277 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.159 11.552 6.401 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -4.016 10.198 6.236 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -1.907 9.661 10.484 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.493 11.105 9.530 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -2.842 11.161 10.689 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.890 14.144 6.655 1.00 0.00 N ATOM 2315 CA ASP B 63 -4.334 15.005 5.577 1.00 0.00 C ATOM 2316 C ASP B 63 -3.106 15.547 4.868 1.00 0.00 C ATOM 2317 O ASP B 63 -3.032 15.558 3.641 1.00 0.00 O ATOM 2318 CB ASP B 63 -5.191 16.149 6.127 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.575 16.182 5.508 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -7.394 15.297 5.837 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -6.840 17.089 4.693 1.00 0.00 O ATOM 0 H ASP B 63 -4.123 14.481 7.589 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.948 14.442 4.874 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.282 16.044 7.208 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.689 17.098 5.940 1.00 0.00 H new ATOM 2326 N GLU B 64 -2.122 15.959 5.670 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.864 16.466 5.146 1.00 0.00 C ATOM 2328 C GLU B 64 -0.218 15.405 4.265 1.00 0.00 C ATOM 2329 O GLU B 64 0.211 15.684 3.150 1.00 0.00 O ATOM 2330 CB GLU B 64 0.075 16.854 6.293 1.00 0.00 C ATOM 2331 CG GLU B 64 0.171 18.355 6.519 1.00 0.00 C ATOM 2332 CD GLU B 64 1.312 18.733 7.443 1.00 0.00 C ATOM 2333 OE1 GLU B 64 2.355 19.198 6.938 1.00 0.00 O ATOM 2334 OE2 GLU B 64 1.163 18.565 8.671 1.00 0.00 O ATOM 0 H GLU B 64 -2.178 15.949 6.688 1.00 0.00 H new ATOM 0 HA GLU B 64 -1.057 17.357 4.549 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.270 16.378 7.211 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.071 16.462 6.085 1.00 0.00 H new ATOM 0 HG2 GLU B 64 0.304 18.855 5.560 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.767 18.716 6.940 1.00 0.00 H new ATOM 2341 N ILE B 65 -0.187 14.176 4.772 1.00 0.00 N ATOM 2342 CA ILE B 65 0.372 13.047 4.035 1.00 0.00 C ATOM 2343 C ILE B 65 -0.220 12.981 2.631 1.00 0.00 C ATOM 2344 O ILE B 65 0.475 12.669 1.667 1.00 0.00 O ATOM 2345 CB ILE B 65 0.081 11.719 4.769 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.670 11.758 6.180 1.00 0.00 C ATOM 2347 CG2 ILE B 65 0.639 10.532 3.992 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.153 12.048 6.192 1.00 0.00 C ATOM 0 H ILE B 65 -0.545 13.936 5.696 1.00 0.00 H new ATOM 0 HA ILE B 65 1.450 13.192 3.968 1.00 0.00 H new ATOM 0 HB ILE B 65 -1.000 11.597 4.841 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.152 12.519 6.763 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.488 10.802 6.670 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.421 9.610 4.530 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.178 10.494 3.005 1.00 0.00 H new ATOM 0 HG23 ILE B 65 1.718 10.642 3.884 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.513 12.063 7.221 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.680 11.273 5.635 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.338 13.017 5.729 1.00 0.00 H new ATOM 2360 N SER B 66 -1.515 13.274 2.531 1.00 0.00 N ATOM 2361 CA SER B 66 -2.213 13.246 1.250 1.00 0.00 C ATOM 2362 C SER B 66 -2.003 14.539 0.463 1.00 0.00 C ATOM 2363 O SER B 66 -1.527 14.511 -0.673 1.00 0.00 O ATOM 2364 CB SER B 66 -3.708 13.009 1.470 1.00 0.00 C ATOM 2365 OG SER B 66 -4.123 13.503 2.732 1.00 0.00 O ATOM 0 H SER B 66 -2.102 13.534 3.324 1.00 0.00 H new ATOM 0 HA SER B 66 -1.796 12.426 0.665 1.00 0.00 H new ATOM 0 HB2 SER B 66 -4.277 13.498 0.680 1.00 0.00 H new ATOM 0 HB3 SER B 66 -3.924 11.943 1.405 1.00 0.00 H new ATOM 0 HG SER B 66 -4.024 14.478 2.750 1.00 0.00 H new ATOM 2371 N LYS B 67 -2.369 15.669 1.061 1.00 0.00 N ATOM 2372 CA LYS B 67 -2.225 16.961 0.393 1.00 0.00 C ATOM 2373 C LYS B 67 -0.761 17.273 0.084 1.00 0.00 C ATOM 2374 O LYS B 67 -0.469 18.101 -0.778 1.00 0.00 O ATOM 2375 CB LYS B 67 -2.835 18.079 1.244 1.00 0.00 C ATOM 2376 CG LYS B 67 -2.486 17.983 2.720 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.921 19.292 3.249 1.00 0.00 C ATOM 2378 CE LYS B 67 -2.479 19.625 4.624 1.00 0.00 C ATOM 2379 NZ LYS B 67 -2.371 21.078 4.930 1.00 0.00 N ATOM 0 H LYS B 67 -2.765 15.718 2.000 1.00 0.00 H new ATOM 0 HA LYS B 67 -2.763 16.903 -0.553 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -2.495 19.041 0.861 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -3.919 18.057 1.134 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -3.377 17.715 3.288 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -1.759 17.185 2.871 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.834 19.225 3.303 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -2.157 20.098 2.554 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -3.524 19.320 4.675 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -1.943 19.054 5.382 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -2.762 21.264 5.876 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -1.371 21.364 4.906 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -2.904 21.622 4.222 1.00 0.00 H new ATOM 2393 N ARG B 68 0.157 16.608 0.782 1.00 0.00 N ATOM 2394 CA ARG B 68 1.582 16.827 0.560 1.00 0.00 C ATOM 2395 C ARG B 68 2.134 15.833 -0.453 1.00 0.00 C ATOM 2396 O ARG B 68 3.028 16.163 -1.231 1.00 0.00 O ATOM 2397 CB ARG B 68 2.365 16.716 1.869 1.00 0.00 C ATOM 2398 CG ARG B 68 2.012 17.792 2.881 1.00 0.00 C ATOM 2399 CD ARG B 68 2.527 17.443 4.269 1.00 0.00 C ATOM 2400 NE ARG B 68 3.984 17.531 4.351 1.00 0.00 N ATOM 2401 CZ ARG B 68 4.677 17.323 5.468 1.00 0.00 C ATOM 2402 NH1 ARG B 68 4.052 17.017 6.598 1.00 0.00 N ATOM 2403 NH2 ARG B 68 5.999 17.423 5.456 1.00 0.00 N ATOM 0 H ARG B 68 -0.059 15.918 1.501 1.00 0.00 H new ATOM 0 HA ARG B 68 1.700 17.836 0.165 1.00 0.00 H new ATOM 0 HB2 ARG B 68 2.180 15.737 2.312 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.432 16.770 1.651 1.00 0.00 H new ATOM 0 HG2 ARG B 68 2.436 18.745 2.563 1.00 0.00 H new ATOM 0 HG3 ARG B 68 0.930 17.920 2.915 1.00 0.00 H new ATOM 0 HD2 ARG B 68 2.081 18.117 5.001 1.00 0.00 H new ATOM 0 HD3 ARG B 68 2.210 16.433 4.530 1.00 0.00 H new ATOM 0 HE ARG B 68 4.499 17.765 3.503 1.00 0.00 H new ATOM 0 HH11 ARG B 68 3.035 16.940 6.614 1.00 0.00 H new ATOM 0 HH12 ARG B 68 4.589 16.859 7.451 1.00 0.00 H new ATOM 0 HH21 ARG B 68 6.485 17.659 4.591 1.00 0.00 H new ATOM 0 HH22 ARG B 68 6.530 17.264 6.312 1.00 0.00 H new ATOM 2417 N PHE B 69 1.599 14.614 -0.443 1.00 0.00 N ATOM 2418 CA PHE B 69 2.048 13.583 -1.371 1.00 0.00 C ATOM 2419 C PHE B 69 2.018 14.112 -2.804 1.00 0.00 C ATOM 2420 O PHE B 69 2.853 13.748 -3.633 1.00 0.00 O ATOM 2421 CB PHE B 69 1.189 12.314 -1.219 1.00 0.00 C ATOM 2422 CG PHE B 69 0.396 11.936 -2.444 1.00 0.00 C ATOM 2423 CD1 PHE B 69 1.028 11.425 -3.567 1.00 0.00 C ATOM 2424 CD2 PHE B 69 -0.981 12.089 -2.466 1.00 0.00 C ATOM 2425 CE1 PHE B 69 0.301 11.076 -4.690 1.00 0.00 C ATOM 2426 CE2 PHE B 69 -1.713 11.742 -3.585 1.00 0.00 C ATOM 2427 CZ PHE B 69 -1.071 11.235 -4.698 1.00 0.00 C ATOM 0 H PHE B 69 0.859 14.319 0.194 1.00 0.00 H new ATOM 0 HA PHE B 69 3.078 13.316 -1.135 1.00 0.00 H new ATOM 0 HB2 PHE B 69 1.840 11.481 -0.954 1.00 0.00 H new ATOM 0 HB3 PHE B 69 0.499 12.457 -0.387 1.00 0.00 H new ATOM 0 HD1 PHE B 69 2.101 11.298 -3.565 1.00 0.00 H new ATOM 0 HD2 PHE B 69 -1.488 12.484 -1.598 1.00 0.00 H new ATOM 0 HE1 PHE B 69 0.805 10.680 -5.559 1.00 0.00 H new ATOM 0 HE2 PHE B 69 -2.786 11.867 -3.590 1.00 0.00 H new ATOM 0 HZ PHE B 69 -1.641 10.963 -5.574 1.00 0.00 H new ATOM 2437 N PHE B 70 1.059 14.990 -3.076 1.00 0.00 N ATOM 2438 CA PHE B 70 0.921 15.595 -4.393 1.00 0.00 C ATOM 2439 C PHE B 70 1.287 17.075 -4.319 1.00 0.00 C ATOM 2440 O PHE B 70 0.413 17.943 -4.327 1.00 0.00 O ATOM 2441 CB PHE B 70 -0.508 15.425 -4.914 1.00 0.00 C ATOM 2442 CG PHE B 70 -0.576 15.029 -6.361 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.096 13.908 -6.819 1.00 0.00 C ATOM 2444 CD2 PHE B 70 -1.312 15.780 -7.265 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.035 13.541 -8.150 1.00 0.00 C ATOM 2446 CE2 PHE B 70 -1.377 15.418 -8.597 1.00 0.00 C ATOM 2447 CZ PHE B 70 -0.703 14.297 -9.040 1.00 0.00 C ATOM 0 H PHE B 70 0.363 15.299 -2.397 1.00 0.00 H new ATOM 0 HA PHE B 70 1.598 15.094 -5.085 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -1.017 14.670 -4.315 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -1.050 16.360 -4.776 1.00 0.00 H new ATOM 0 HD1 PHE B 70 0.675 13.313 -6.128 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -1.841 16.658 -6.924 1.00 0.00 H new ATOM 0 HE1 PHE B 70 0.564 12.664 -8.494 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -1.954 16.011 -9.291 1.00 0.00 H new ATOM 0 HZ PHE B 70 -0.753 14.012 -10.080 1.00 0.00 H new ATOM 2457 N PRO B 71 2.593 17.380 -4.234 1.00 0.00 N ATOM 2458 CA PRO B 71 3.078 18.761 -4.143 1.00 0.00 C ATOM 2459 C PRO B 71 2.910 19.523 -5.453 1.00 0.00 C ATOM 2460 O PRO B 71 2.250 19.049 -6.378 1.00 0.00 O ATOM 2461 CB PRO B 71 4.561 18.592 -3.804 1.00 0.00 C ATOM 2462 CG PRO B 71 4.925 17.261 -4.361 1.00 0.00 C ATOM 2463 CD PRO B 71 3.699 16.403 -4.212 1.00 0.00 C ATOM 0 HA PRO B 71 2.523 19.342 -3.407 1.00 0.00 H new ATOM 0 HB2 PRO B 71 5.162 19.385 -4.248 1.00 0.00 H new ATOM 0 HB3 PRO B 71 4.728 18.630 -2.728 1.00 0.00 H new ATOM 0 HG2 PRO B 71 5.220 17.343 -5.407 1.00 0.00 H new ATOM 0 HG3 PRO B 71 5.771 16.831 -3.824 1.00 0.00 H new ATOM 0 HD2 PRO B 71 3.613 15.681 -5.024 1.00 0.00 H new ATOM 0 HD3 PRO B 71 3.716 15.836 -3.281 1.00 0.00 H new ATOM 2471 N ALA B 72 3.513 20.705 -5.525 1.00 0.00 N ATOM 2472 CA ALA B 72 3.431 21.531 -6.724 1.00 0.00 C ATOM 2473 C ALA B 72 4.291 22.783 -6.589 1.00 0.00 C ATOM 2474 O ALA B 72 5.070 23.113 -7.484 1.00 0.00 O ATOM 2475 CB ALA B 72 1.984 21.912 -7.006 1.00 0.00 C ATOM 0 H ALA B 72 4.063 21.112 -4.768 1.00 0.00 H new ATOM 0 HA ALA B 72 3.812 20.948 -7.562 1.00 0.00 H new ATOM 0 HB1 ALA B 72 1.938 22.528 -7.904 1.00 0.00 H new ATOM 0 HB2 ALA B 72 1.392 21.009 -7.156 1.00 0.00 H new ATOM 0 HB3 ALA B 72 1.584 22.472 -6.161 1.00 0.00 H new ATOM 2481 N LYS B 73 4.145 23.477 -5.464 1.00 0.00 N ATOM 2482 CA LYS B 73 4.911 24.692 -5.212 1.00 0.00 C ATOM 2483 C LYS B 73 5.977 24.453 -4.149 1.00 0.00 C ATOM 2484 O LYS B 73 5.637 24.493 -2.948 1.00 0.00 O ATOM 2485 CB LYS B 73 3.980 25.823 -4.769 1.00 0.00 C ATOM 2486 CG LYS B 73 2.842 26.091 -5.742 1.00 0.00 C ATOM 2487 CD LYS B 73 2.333 27.518 -5.623 1.00 0.00 C ATOM 2488 CE LYS B 73 1.029 27.709 -6.381 1.00 0.00 C ATOM 2489 NZ LYS B 73 0.216 28.821 -5.815 1.00 0.00 N ATOM 2490 OXT LYS B 73 7.147 24.223 -4.526 1.00 0.00 O ATOM 0 H LYS B 73 3.504 23.219 -4.714 1.00 0.00 H new ATOM 0 HA LYS B 73 5.406 24.978 -6.140 1.00 0.00 H new ATOM 0 HB2 LYS B 73 3.562 25.577 -3.793 1.00 0.00 H new ATOM 0 HB3 LYS B 73 4.564 26.735 -4.645 1.00 0.00 H new ATOM 0 HG2 LYS B 73 3.183 25.909 -6.761 1.00 0.00 H new ATOM 0 HG3 LYS B 73 2.026 25.395 -5.550 1.00 0.00 H new ATOM 0 HD2 LYS B 73 2.184 27.766 -4.572 1.00 0.00 H new ATOM 0 HD3 LYS B 73 3.084 28.207 -6.010 1.00 0.00 H new ATOM 0 HE2 LYS B 73 1.245 27.914 -7.429 1.00 0.00 H new ATOM 0 HE3 LYS B 73 0.452 26.785 -6.350 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -0.665 28.919 -6.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -0.012 28.614 -4.822 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 0.756 29.708 -5.868 1.00 0.00 H new TER 2504 LYS B 73