USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1078 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 74 SER OG : rot -114:sc= 0.138 USER MOD Set 1.2: A 87 HIS :FLIP no HE2:sc= -1.56 F(o=-4.5!,f=-1.4) USER MOD Set 2.1: A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 76 GLN : amide:sc= -0.155 K(o=-0.16,f=-2.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= -0.212 USER MOD Single : A 6 MET CE :methyl -160:sc= -0.149 (180deg=-0.805) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 GLN : amide:sc= 0.962 K(o=0.96,f=-3.9!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 43 LYS NZ :NH3+ -175:sc= -1.6! (180deg=-1.84!) USER MOD Single : A 49 SER OG : rot 180:sc=-0.00241 USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 52 GLN : amide:sc= -0.0741 K(o=-0.074,f=-3.9!) USER MOD Single : A 67 THR OG1 : rot 134:sc= 1.22 USER MOD Single : A 71 TYR OH : rot -30:sc= 0.433 USER MOD Single : A 75 HIS : no HD1:sc= -0.484 K(o=-0.48,f=-1.4) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc=-0.00413 X(o=-0.0041,f=-0.092) USER MOD Single : A 90 HIS : no HD1:sc= -2.96! C(o=-3!,f=-16!) USER MOD Single : A 95 HIS : no HD1:sc= -0.0723 K(o=-0.072,f=-0.59) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.24 K(o=-0.24,f=-1.1) USER MOD Single : A 101 HIS : no HE2:sc= 1.15 K(o=1.2,f=-5.2!) USER MOD Single : A 103 HIS : no HD1:sc= -1.45! C(o=-1.5!,f=-7.8!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 CYS SG : rot -177:sc= -1.63! USER MOD Single : A 110 SER OG : rot 180:sc= 0.00453 USER MOD Single : A 116 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -114:sc= -0.173 (180deg=-2.85!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.610 -22.582 0.123 1.00 0.00 N ATOM 2 CA GLY A 1 -20.819 -21.799 -0.225 1.00 0.00 C ATOM 3 C GLY A 1 -21.370 -22.180 -1.584 1.00 0.00 C ATOM 4 O GLY A 1 -20.610 -22.327 -2.542 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.265 -22.290 1.060 1.00 0.00 H new ATOM 0 H2 GLY A 1 -19.846 -23.595 0.141 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.869 -22.411 -0.587 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.585 -21.958 0.534 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.577 -20.736 -0.217 1.00 0.00 H new ATOM 10 N PRO A 2 -22.694 -22.350 -1.699 1.00 0.00 N ATOM 11 CA PRO A 2 -23.329 -22.736 -2.958 1.00 0.00 C ATOM 12 C PRO A 2 -23.323 -21.601 -3.980 1.00 0.00 C ATOM 13 O PRO A 2 -23.166 -21.835 -5.178 1.00 0.00 O ATOM 14 CB PRO A 2 -24.759 -23.088 -2.547 1.00 0.00 C ATOM 15 CG PRO A 2 -25.003 -22.317 -1.294 1.00 0.00 C ATOM 16 CD PRO A 2 -23.671 -22.190 -0.606 1.00 0.00 C ATOM 0 HA PRO A 2 -22.804 -23.557 -3.445 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -25.472 -22.813 -3.324 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -24.869 -24.159 -2.379 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -25.420 -21.335 -1.517 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -25.722 -22.831 -0.656 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -23.566 -21.223 -0.114 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -23.542 -22.954 0.161 1.00 0.00 H new ATOM 24 N LEU A 3 -23.487 -20.374 -3.500 1.00 0.00 N ATOM 25 CA LEU A 3 -23.490 -19.210 -4.371 1.00 0.00 C ATOM 26 C LEU A 3 -22.066 -18.729 -4.617 1.00 0.00 C ATOM 27 O LEU A 3 -21.528 -18.869 -5.717 1.00 0.00 O ATOM 28 CB LEU A 3 -24.327 -18.062 -3.779 1.00 0.00 C ATOM 29 CG LEU A 3 -25.849 -18.273 -3.752 1.00 0.00 C ATOM 30 CD1 LEU A 3 -26.350 -18.743 -5.109 1.00 0.00 C ATOM 31 CD2 LEU A 3 -26.251 -19.248 -2.652 1.00 0.00 C ATOM 0 H LEU A 3 -23.620 -20.162 -2.511 1.00 0.00 H new ATOM 0 HA LEU A 3 -23.942 -19.510 -5.316 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -23.988 -17.883 -2.759 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -24.117 -17.157 -4.348 1.00 0.00 H new ATOM 0 HG LEU A 3 -26.318 -17.314 -3.530 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -27.430 -18.886 -5.068 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -26.112 -17.994 -5.864 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -25.868 -19.686 -5.368 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -27.333 -19.377 -2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -25.770 -20.211 -2.825 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -25.938 -18.855 -1.685 1.00 0.00 H new ATOM 43 N GLY A 4 -21.456 -18.174 -3.580 1.00 0.00 N ATOM 44 CA GLY A 4 -20.129 -17.625 -3.718 1.00 0.00 C ATOM 45 C GLY A 4 -20.179 -16.199 -4.212 1.00 0.00 C ATOM 46 O GLY A 4 -19.197 -15.680 -4.740 1.00 0.00 O ATOM 0 H GLY A 4 -21.859 -18.095 -2.646 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.615 -17.663 -2.758 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.551 -18.234 -4.413 1.00 0.00 H new ATOM 50 N SER A 5 -21.339 -15.574 -4.052 1.00 0.00 N ATOM 51 CA SER A 5 -21.544 -14.203 -4.480 1.00 0.00 C ATOM 52 C SER A 5 -20.739 -13.254 -3.599 1.00 0.00 C ATOM 53 O SER A 5 -21.167 -12.886 -2.507 1.00 0.00 O ATOM 54 CB SER A 5 -23.032 -13.860 -4.414 1.00 0.00 C ATOM 55 OG SER A 5 -23.811 -14.865 -5.048 1.00 0.00 O ATOM 0 H SER A 5 -22.159 -16.004 -3.623 1.00 0.00 H new ATOM 0 HA SER A 5 -21.202 -14.093 -5.509 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.340 -13.757 -3.374 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.210 -12.898 -4.895 1.00 0.00 H new ATOM 0 HG SER A 5 -24.760 -14.627 -4.993 1.00 0.00 H new ATOM 61 N MET A 6 -19.560 -12.889 -4.069 1.00 0.00 N ATOM 62 CA MET A 6 -18.662 -12.050 -3.301 1.00 0.00 C ATOM 63 C MET A 6 -18.256 -10.837 -4.118 1.00 0.00 C ATOM 64 O MET A 6 -17.732 -10.971 -5.224 1.00 0.00 O ATOM 65 CB MET A 6 -17.425 -12.849 -2.884 1.00 0.00 C ATOM 66 CG MET A 6 -17.750 -14.057 -2.020 1.00 0.00 C ATOM 67 SD MET A 6 -16.307 -15.076 -1.648 1.00 0.00 S ATOM 68 CE MET A 6 -15.820 -15.587 -3.295 1.00 0.00 C ATOM 0 H MET A 6 -19.202 -13.163 -4.984 1.00 0.00 H new ATOM 0 HA MET A 6 -19.177 -11.709 -2.403 1.00 0.00 H new ATOM 0 HB2 MET A 6 -16.898 -13.182 -3.778 1.00 0.00 H new ATOM 0 HB3 MET A 6 -16.745 -12.194 -2.339 1.00 0.00 H new ATOM 0 HG2 MET A 6 -18.197 -13.717 -1.086 1.00 0.00 H new ATOM 0 HG3 MET A 6 -18.497 -14.668 -2.527 1.00 0.00 H new ATOM 0 HE1 MET A 6 -15.192 -16.476 -3.230 1.00 0.00 H new ATOM 0 HE2 MET A 6 -16.709 -15.813 -3.884 1.00 0.00 H new ATOM 0 HE3 MET A 6 -15.262 -14.783 -3.775 1.00 0.00 H new ATOM 78 N LYS A 7 -18.511 -9.659 -3.579 1.00 0.00 N ATOM 79 CA LYS A 7 -18.178 -8.421 -4.262 1.00 0.00 C ATOM 80 C LYS A 7 -16.800 -7.946 -3.829 1.00 0.00 C ATOM 81 O LYS A 7 -16.293 -8.364 -2.786 1.00 0.00 O ATOM 82 CB LYS A 7 -19.246 -7.360 -3.982 1.00 0.00 C ATOM 83 CG LYS A 7 -20.590 -7.708 -4.602 1.00 0.00 C ATOM 84 CD LYS A 7 -21.672 -6.701 -4.248 1.00 0.00 C ATOM 85 CE LYS A 7 -22.009 -6.736 -2.768 1.00 0.00 C ATOM 86 NZ LYS A 7 -23.244 -5.968 -2.472 1.00 0.00 N ATOM 0 H LYS A 7 -18.949 -9.533 -2.667 1.00 0.00 H new ATOM 0 HA LYS A 7 -18.155 -8.596 -5.338 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.365 -7.245 -2.905 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.909 -6.399 -4.370 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -20.485 -7.758 -5.686 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -20.896 -8.699 -4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -21.341 -5.699 -4.522 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -22.569 -6.911 -4.831 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -22.137 -7.770 -2.447 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -21.178 -6.325 -2.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -23.445 -6.013 -1.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -23.112 -4.976 -2.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -24.042 -6.376 -3.000 1.00 0.00 H new ATOM 100 N MET A 8 -16.193 -7.079 -4.621 1.00 0.00 N ATOM 101 CA MET A 8 -14.816 -6.690 -4.382 1.00 0.00 C ATOM 102 C MET A 8 -14.700 -5.262 -3.880 1.00 0.00 C ATOM 103 O MET A 8 -15.402 -4.359 -4.331 1.00 0.00 O ATOM 104 CB MET A 8 -13.965 -6.869 -5.643 1.00 0.00 C ATOM 105 CG MET A 8 -13.626 -8.320 -5.947 1.00 0.00 C ATOM 106 SD MET A 8 -12.587 -8.502 -7.413 1.00 0.00 S ATOM 107 CE MET A 8 -12.393 -10.283 -7.461 1.00 0.00 C ATOM 0 H MET A 8 -16.629 -6.634 -5.429 1.00 0.00 H new ATOM 0 HA MET A 8 -14.439 -7.350 -3.601 1.00 0.00 H new ATOM 0 HB2 MET A 8 -14.497 -6.443 -6.494 1.00 0.00 H new ATOM 0 HB3 MET A 8 -13.040 -6.304 -5.530 1.00 0.00 H new ATOM 0 HG2 MET A 8 -13.116 -8.757 -5.089 1.00 0.00 H new ATOM 0 HG3 MET A 8 -14.549 -8.882 -6.089 1.00 0.00 H new ATOM 0 HE1 MET A 8 -11.773 -10.559 -8.314 1.00 0.00 H new ATOM 0 HE2 MET A 8 -11.916 -10.622 -6.541 1.00 0.00 H new ATOM 0 HE3 MET A 8 -13.372 -10.753 -7.557 1.00 0.00 H new ATOM 117 N ILE A 9 -13.806 -5.094 -2.927 1.00 0.00 N ATOM 118 CA ILE A 9 -13.446 -3.796 -2.400 1.00 0.00 C ATOM 119 C ILE A 9 -12.046 -3.470 -2.890 1.00 0.00 C ATOM 120 O ILE A 9 -11.095 -4.168 -2.563 1.00 0.00 O ATOM 121 CB ILE A 9 -13.468 -3.804 -0.856 1.00 0.00 C ATOM 122 CG1 ILE A 9 -14.868 -4.153 -0.345 1.00 0.00 C ATOM 123 CG2 ILE A 9 -12.996 -2.474 -0.277 1.00 0.00 C ATOM 124 CD1 ILE A 9 -15.022 -4.008 1.153 1.00 0.00 C ATOM 0 H ILE A 9 -13.303 -5.867 -2.492 1.00 0.00 H new ATOM 0 HA ILE A 9 -14.162 -3.048 -2.740 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.770 -4.570 -0.518 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.596 -3.511 -0.840 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.103 -5.179 -0.628 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -13.026 -2.520 0.812 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.975 -2.277 -0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -13.649 -1.674 -0.625 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.039 -4.272 1.441 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -14.318 -4.671 1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -14.819 -2.977 1.441 1.00 0.00 H new ATOM 136 N GLU A 10 -11.914 -2.429 -3.675 1.00 0.00 N ATOM 137 CA GLU A 10 -10.649 -2.150 -4.336 1.00 0.00 C ATOM 138 C GLU A 10 -9.845 -1.176 -3.497 1.00 0.00 C ATOM 139 O GLU A 10 -10.333 -0.096 -3.162 1.00 0.00 O ATOM 140 CB GLU A 10 -10.899 -1.573 -5.734 1.00 0.00 C ATOM 141 CG GLU A 10 -11.697 -2.497 -6.645 1.00 0.00 C ATOM 142 CD GLU A 10 -10.826 -3.313 -7.580 1.00 0.00 C ATOM 143 OE1 GLU A 10 -9.766 -3.806 -7.148 1.00 0.00 O ATOM 144 OE2 GLU A 10 -11.212 -3.473 -8.759 1.00 0.00 O ATOM 0 H GLU A 10 -12.658 -1.761 -3.875 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.086 -3.077 -4.443 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.430 -0.626 -5.637 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.940 -1.354 -6.204 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.294 -3.173 -6.033 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.394 -1.902 -7.235 1.00 0.00 H new ATOM 151 N VAL A 11 -8.631 -1.557 -3.134 1.00 0.00 N ATOM 152 CA VAL A 11 -7.785 -0.715 -2.307 1.00 0.00 C ATOM 153 C VAL A 11 -6.395 -0.631 -2.913 1.00 0.00 C ATOM 154 O VAL A 11 -5.740 -1.645 -3.148 1.00 0.00 O ATOM 155 CB VAL A 11 -7.678 -1.242 -0.856 1.00 0.00 C ATOM 156 CG1 VAL A 11 -6.722 -0.387 -0.038 1.00 0.00 C ATOM 157 CG2 VAL A 11 -9.049 -1.285 -0.194 1.00 0.00 C ATOM 0 H VAL A 11 -8.209 -2.447 -3.400 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.244 0.273 -2.272 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.282 -2.257 -0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.664 -0.777 0.978 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.732 -0.411 -0.493 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -7.085 0.641 -0.012 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -8.949 -1.659 0.825 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -9.474 -0.282 -0.173 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.706 -1.946 -0.760 1.00 0.00 H new ATOM 167 N VAL A 12 -5.954 0.574 -3.173 1.00 0.00 N ATOM 168 CA VAL A 12 -4.642 0.788 -3.739 1.00 0.00 C ATOM 169 C VAL A 12 -3.660 1.168 -2.643 1.00 0.00 C ATOM 170 O VAL A 12 -3.963 2.002 -1.787 1.00 0.00 O ATOM 171 CB VAL A 12 -4.678 1.870 -4.837 1.00 0.00 C ATOM 172 CG1 VAL A 12 -5.274 1.309 -6.121 1.00 0.00 C ATOM 173 CG2 VAL A 12 -5.475 3.086 -4.372 1.00 0.00 C ATOM 0 H VAL A 12 -6.486 1.427 -3.001 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.312 -0.142 -4.203 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.654 2.185 -5.037 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.291 2.087 -6.884 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -4.667 0.473 -6.469 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.291 0.965 -5.930 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -5.487 3.837 -5.162 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.497 2.785 -4.142 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.011 3.506 -3.480 1.00 0.00 H new ATOM 183 N ALA A 13 -2.491 0.545 -2.658 1.00 0.00 N ATOM 184 CA ALA A 13 -1.518 0.740 -1.600 1.00 0.00 C ATOM 185 C ALA A 13 -0.224 1.312 -2.155 1.00 0.00 C ATOM 186 O ALA A 13 0.324 0.811 -3.138 1.00 0.00 O ATOM 187 CB ALA A 13 -1.258 -0.572 -0.867 1.00 0.00 C ATOM 0 H ALA A 13 -2.196 -0.099 -3.392 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.925 1.457 -0.888 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.526 -0.408 -0.076 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -2.188 -0.935 -0.430 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.874 -1.311 -1.570 1.00 0.00 H new ATOM 193 N ALA A 14 0.261 2.354 -1.505 1.00 0.00 N ATOM 194 CA ALA A 14 1.440 3.065 -1.949 1.00 0.00 C ATOM 195 C ALA A 14 2.652 2.685 -1.122 1.00 0.00 C ATOM 196 O ALA A 14 2.667 2.855 0.099 1.00 0.00 O ATOM 197 CB ALA A 14 1.206 4.565 -1.859 1.00 0.00 C ATOM 0 H ALA A 14 -0.154 2.730 -0.653 1.00 0.00 H new ATOM 0 HA ALA A 14 1.632 2.788 -2.985 1.00 0.00 H new ATOM 0 HB1 ALA A 14 2.098 5.093 -2.195 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.362 4.840 -2.491 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.990 4.838 -0.826 1.00 0.00 H new ATOM 203 N ILE A 15 3.667 2.171 -1.790 1.00 0.00 N ATOM 204 CA ILE A 15 4.914 1.851 -1.137 1.00 0.00 C ATOM 205 C ILE A 15 5.904 2.980 -1.365 1.00 0.00 C ATOM 206 O ILE A 15 6.502 3.096 -2.440 1.00 0.00 O ATOM 207 CB ILE A 15 5.498 0.512 -1.643 1.00 0.00 C ATOM 208 CG1 ILE A 15 4.574 -0.643 -1.236 1.00 0.00 C ATOM 209 CG2 ILE A 15 6.907 0.296 -1.108 1.00 0.00 C ATOM 210 CD1 ILE A 15 5.238 -2.001 -1.267 1.00 0.00 C ATOM 0 H ILE A 15 3.648 1.967 -2.789 1.00 0.00 H new ATOM 0 HA ILE A 15 4.724 1.737 -0.070 1.00 0.00 H new ATOM 0 HB ILE A 15 5.561 0.545 -2.731 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.198 -0.457 -0.230 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.711 -0.656 -1.902 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.295 -0.653 -1.478 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.552 1.108 -1.444 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.884 0.278 -0.018 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.520 -2.764 -0.967 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.590 -2.211 -2.277 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.084 -2.008 -0.580 1.00 0.00 H new ATOM 222 N ILE A 16 6.056 3.833 -0.363 1.00 0.00 N ATOM 223 CA ILE A 16 6.939 4.977 -0.471 1.00 0.00 C ATOM 224 C ILE A 16 8.353 4.523 -0.153 1.00 0.00 C ATOM 225 O ILE A 16 8.693 4.326 1.009 1.00 0.00 O ATOM 226 CB ILE A 16 6.555 6.109 0.516 1.00 0.00 C ATOM 227 CG1 ILE A 16 5.042 6.152 0.779 1.00 0.00 C ATOM 228 CG2 ILE A 16 7.029 7.460 -0.010 1.00 0.00 C ATOM 229 CD1 ILE A 16 4.222 6.789 -0.321 1.00 0.00 C ATOM 0 H ILE A 16 5.577 3.752 0.534 1.00 0.00 H new ATOM 0 HA ILE A 16 6.858 5.371 -1.484 1.00 0.00 H new ATOM 0 HB ILE A 16 7.053 5.895 1.462 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.686 5.134 0.934 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.865 6.697 1.706 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.751 8.243 0.695 1.00 0.00 H new ATOM 0 HG22 ILE A 16 8.113 7.445 -0.127 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.563 7.659 -0.975 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.168 6.773 -0.045 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.544 7.820 -0.464 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.363 6.233 -1.248 1.00 0.00 H new ATOM 241 N GLU A 17 9.164 4.333 -1.175 1.00 0.00 N ATOM 242 CA GLU A 17 10.511 3.835 -0.977 1.00 0.00 C ATOM 243 C GLU A 17 11.509 4.912 -1.334 1.00 0.00 C ATOM 244 O GLU A 17 11.524 5.409 -2.460 1.00 0.00 O ATOM 245 CB GLU A 17 10.745 2.566 -1.812 1.00 0.00 C ATOM 246 CG GLU A 17 12.151 1.969 -1.707 1.00 0.00 C ATOM 247 CD GLU A 17 13.186 2.718 -2.533 1.00 0.00 C ATOM 248 OE1 GLU A 17 13.014 2.808 -3.768 1.00 0.00 O ATOM 249 OE2 GLU A 17 14.165 3.232 -1.951 1.00 0.00 O ATOM 0 H GLU A 17 8.915 4.515 -2.147 1.00 0.00 H new ATOM 0 HA GLU A 17 10.644 3.571 0.072 1.00 0.00 H new ATOM 0 HB2 GLU A 17 10.022 1.810 -1.505 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.542 2.796 -2.858 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.461 1.969 -0.662 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.122 0.929 -2.031 1.00 0.00 H new ATOM 256 N ARG A 18 12.329 5.277 -0.371 1.00 0.00 N ATOM 257 CA ARG A 18 13.391 6.230 -0.604 1.00 0.00 C ATOM 258 C ARG A 18 14.575 5.889 0.286 1.00 0.00 C ATOM 259 O ARG A 18 14.399 5.541 1.456 1.00 0.00 O ATOM 260 CB ARG A 18 12.909 7.661 -0.341 1.00 0.00 C ATOM 261 CG ARG A 18 13.612 8.709 -1.195 1.00 0.00 C ATOM 262 CD ARG A 18 13.024 8.791 -2.603 1.00 0.00 C ATOM 263 NE ARG A 18 13.028 7.500 -3.296 1.00 0.00 N ATOM 264 CZ ARG A 18 13.188 7.349 -4.611 1.00 0.00 C ATOM 265 NH1 ARG A 18 13.325 8.408 -5.397 1.00 0.00 N ATOM 266 NH2 ARG A 18 13.185 6.131 -5.144 1.00 0.00 N ATOM 0 H ARG A 18 12.279 4.925 0.585 1.00 0.00 H new ATOM 0 HA ARG A 18 13.698 6.173 -1.648 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.836 7.714 -0.526 1.00 0.00 H new ATOM 0 HB3 ARG A 18 13.063 7.899 0.711 1.00 0.00 H new ATOM 0 HG2 ARG A 18 13.532 9.683 -0.712 1.00 0.00 H new ATOM 0 HG3 ARG A 18 14.674 8.471 -1.259 1.00 0.00 H new ATOM 0 HD2 ARG A 18 12.001 9.163 -2.544 1.00 0.00 H new ATOM 0 HD3 ARG A 18 13.593 9.514 -3.188 1.00 0.00 H new ATOM 0 HE ARG A 18 12.900 6.659 -2.734 1.00 0.00 H new ATOM 0 HH11 ARG A 18 13.308 9.346 -4.996 1.00 0.00 H new ATOM 0 HH12 ARG A 18 13.447 8.285 -6.402 1.00 0.00 H new ATOM 0 HH21 ARG A 18 13.060 5.313 -4.547 1.00 0.00 H new ATOM 0 HH22 ARG A 18 13.307 6.014 -6.150 1.00 0.00 H new ATOM 280 N ASP A 19 15.772 5.961 -0.290 1.00 0.00 N ATOM 281 CA ASP A 19 17.018 5.636 0.412 1.00 0.00 C ATOM 282 C ASP A 19 17.071 4.163 0.797 1.00 0.00 C ATOM 283 O ASP A 19 17.838 3.777 1.680 1.00 0.00 O ATOM 284 CB ASP A 19 17.206 6.498 1.670 1.00 0.00 C ATOM 285 CG ASP A 19 17.297 7.981 1.360 1.00 0.00 C ATOM 286 OD1 ASP A 19 18.382 8.439 0.934 1.00 0.00 O ATOM 287 OD2 ASP A 19 16.290 8.701 1.543 1.00 0.00 O ATOM 0 H ASP A 19 15.909 6.247 -1.259 1.00 0.00 H new ATOM 0 HA ASP A 19 17.830 5.852 -0.283 1.00 0.00 H new ATOM 0 HB2 ASP A 19 16.373 6.325 2.351 1.00 0.00 H new ATOM 0 HB3 ASP A 19 18.112 6.184 2.188 1.00 0.00 H new ATOM 292 N GLY A 20 16.265 3.338 0.136 1.00 0.00 N ATOM 293 CA GLY A 20 16.247 1.924 0.441 1.00 0.00 C ATOM 294 C GLY A 20 15.314 1.607 1.590 1.00 0.00 C ATOM 295 O GLY A 20 15.304 0.487 2.102 1.00 0.00 O ATOM 0 H GLY A 20 15.625 3.626 -0.605 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.938 1.366 -0.443 1.00 0.00 H new ATOM 0 HA3 GLY A 20 17.255 1.593 0.690 1.00 0.00 H new ATOM 299 N LYS A 21 14.534 2.595 2.001 1.00 0.00 N ATOM 300 CA LYS A 21 13.616 2.434 3.114 1.00 0.00 C ATOM 301 C LYS A 21 12.183 2.707 2.670 1.00 0.00 C ATOM 302 O LYS A 21 11.936 3.565 1.822 1.00 0.00 O ATOM 303 CB LYS A 21 14.009 3.391 4.235 1.00 0.00 C ATOM 304 CG LYS A 21 15.496 3.375 4.543 1.00 0.00 C ATOM 305 CD LYS A 21 15.806 2.436 5.687 1.00 0.00 C ATOM 306 CE LYS A 21 17.301 2.221 5.871 1.00 0.00 C ATOM 307 NZ LYS A 21 17.981 3.446 6.360 1.00 0.00 N ATOM 0 H LYS A 21 14.520 3.522 1.576 1.00 0.00 H new ATOM 0 HA LYS A 21 13.672 1.407 3.476 1.00 0.00 H new ATOM 0 HB2 LYS A 21 13.713 4.403 3.960 1.00 0.00 H new ATOM 0 HB3 LYS A 21 13.455 3.131 5.137 1.00 0.00 H new ATOM 0 HG2 LYS A 21 16.051 3.068 3.656 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.829 4.382 4.795 1.00 0.00 H new ATOM 0 HD2 LYS A 21 15.383 2.837 6.608 1.00 0.00 H new ATOM 0 HD3 LYS A 21 15.323 1.476 5.507 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.466 1.408 6.577 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.743 1.915 4.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.998 3.257 6.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 17.845 4.216 5.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.577 3.725 7.277 1.00 0.00 H new ATOM 321 N ILE A 22 11.249 1.973 3.253 1.00 0.00 N ATOM 322 CA ILE A 22 9.841 2.084 2.909 1.00 0.00 C ATOM 323 C ILE A 22 9.086 2.831 4.006 1.00 0.00 C ATOM 324 O ILE A 22 9.468 2.775 5.176 1.00 0.00 O ATOM 325 CB ILE A 22 9.214 0.684 2.711 1.00 0.00 C ATOM 326 CG1 ILE A 22 10.096 -0.164 1.797 1.00 0.00 C ATOM 327 CG2 ILE A 22 7.806 0.794 2.137 1.00 0.00 C ATOM 328 CD1 ILE A 22 9.567 -1.560 1.578 1.00 0.00 C ATOM 0 H ILE A 22 11.446 1.283 3.978 1.00 0.00 H new ATOM 0 HA ILE A 22 9.763 2.640 1.975 1.00 0.00 H new ATOM 0 HB ILE A 22 9.146 0.199 3.685 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.192 0.335 0.833 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.096 -0.226 2.225 1.00 0.00 H new ATOM 0 HG21 ILE A 22 7.387 -0.204 2.007 1.00 0.00 H new ATOM 0 HG22 ILE A 22 7.178 1.365 2.821 1.00 0.00 H new ATOM 0 HG23 ILE A 22 7.845 1.300 1.172 1.00 0.00 H new ATOM 0 HD11 ILE A 22 10.243 -2.106 0.920 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.497 -2.077 2.535 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.579 -1.507 1.121 1.00 0.00 H new ATOM 340 N LEU A 23 8.031 3.539 3.620 1.00 0.00 N ATOM 341 CA LEU A 23 7.206 4.280 4.565 1.00 0.00 C ATOM 342 C LEU A 23 6.087 3.404 5.127 1.00 0.00 C ATOM 343 O LEU A 23 5.224 2.926 4.391 1.00 0.00 O ATOM 344 CB LEU A 23 6.608 5.513 3.881 1.00 0.00 C ATOM 345 CG LEU A 23 5.753 6.419 4.770 1.00 0.00 C ATOM 346 CD1 LEU A 23 6.597 7.030 5.878 1.00 0.00 C ATOM 347 CD2 LEU A 23 5.092 7.507 3.933 1.00 0.00 C ATOM 0 H LEU A 23 7.725 3.615 2.650 1.00 0.00 H new ATOM 0 HA LEU A 23 7.840 4.595 5.394 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.423 6.107 3.467 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.998 5.179 3.041 1.00 0.00 H new ATOM 0 HG LEU A 23 4.971 5.816 5.232 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.972 7.671 6.500 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.024 6.236 6.490 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.400 7.622 5.439 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.487 8.145 4.577 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.860 8.108 3.446 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.456 7.048 3.176 1.00 0.00 H new ATOM 359 N LEU A 24 6.118 3.206 6.435 1.00 0.00 N ATOM 360 CA LEU A 24 5.079 2.450 7.128 1.00 0.00 C ATOM 361 C LEU A 24 4.289 3.379 8.036 1.00 0.00 C ATOM 362 O LEU A 24 4.860 4.253 8.693 1.00 0.00 O ATOM 363 CB LEU A 24 5.659 1.290 7.952 1.00 0.00 C ATOM 364 CG LEU A 24 6.274 0.128 7.155 1.00 0.00 C ATOM 365 CD1 LEU A 24 7.548 0.551 6.444 1.00 0.00 C ATOM 366 CD2 LEU A 24 6.541 -1.055 8.073 1.00 0.00 C ATOM 0 H LEU A 24 6.855 3.560 7.044 1.00 0.00 H new ATOM 0 HA LEU A 24 4.424 2.020 6.370 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.424 1.692 8.616 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.866 0.890 8.584 1.00 0.00 H new ATOM 0 HG LEU A 24 5.556 -0.172 6.391 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.954 -0.296 5.891 1.00 0.00 H new ATOM 0 HD12 LEU A 24 7.326 1.363 5.752 1.00 0.00 H new ATOM 0 HD13 LEU A 24 8.279 0.890 7.178 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.976 -1.872 7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 24 7.234 -0.756 8.860 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.604 -1.386 8.521 1.00 0.00 H new ATOM 378 N ALA A 25 2.979 3.198 8.066 1.00 0.00 N ATOM 379 CA ALA A 25 2.118 4.047 8.873 1.00 0.00 C ATOM 380 C ALA A 25 1.353 3.229 9.908 1.00 0.00 C ATOM 381 O ALA A 25 0.594 2.323 9.564 1.00 0.00 O ATOM 382 CB ALA A 25 1.166 4.822 7.977 1.00 0.00 C ATOM 0 H ALA A 25 2.489 2.473 7.542 1.00 0.00 H new ATOM 0 HA ALA A 25 2.742 4.758 9.415 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.524 5.456 8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.739 5.443 7.289 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.551 4.124 7.409 1.00 0.00 H new ATOM 388 N GLN A 26 1.568 3.553 11.177 1.00 0.00 N ATOM 389 CA GLN A 26 0.958 2.816 12.280 1.00 0.00 C ATOM 390 C GLN A 26 -0.549 3.060 12.362 1.00 0.00 C ATOM 391 O GLN A 26 -0.998 4.171 12.662 1.00 0.00 O ATOM 392 CB GLN A 26 1.612 3.206 13.606 1.00 0.00 C ATOM 393 CG GLN A 26 1.204 2.310 14.763 1.00 0.00 C ATOM 394 CD GLN A 26 1.695 2.823 16.101 1.00 0.00 C ATOM 395 OE1 GLN A 26 2.796 2.500 16.540 1.00 0.00 O ATOM 396 NE2 GLN A 26 0.872 3.620 16.762 1.00 0.00 N ATOM 0 H GLN A 26 2.164 4.327 11.470 1.00 0.00 H new ATOM 0 HA GLN A 26 1.120 1.755 12.089 1.00 0.00 H new ATOM 0 HB2 GLN A 26 2.696 3.171 13.493 1.00 0.00 H new ATOM 0 HB3 GLN A 26 1.349 4.237 13.844 1.00 0.00 H new ATOM 0 HG2 GLN A 26 0.117 2.227 14.787 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.597 1.307 14.597 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -0.034 3.863 16.361 1.00 0.00 H new ATOM 0 HE22 GLN A 26 1.143 3.991 17.673 1.00 0.00 H new ATOM 405 N ARG A 27 -1.305 2.002 12.096 1.00 0.00 N ATOM 406 CA ARG A 27 -2.762 1.995 12.193 1.00 0.00 C ATOM 407 C ARG A 27 -3.262 0.633 11.735 1.00 0.00 C ATOM 408 O ARG A 27 -3.073 0.268 10.587 1.00 0.00 O ATOM 409 CB ARG A 27 -3.397 3.098 11.332 1.00 0.00 C ATOM 410 CG ARG A 27 -4.921 3.106 11.360 1.00 0.00 C ATOM 411 CD ARG A 27 -5.461 3.464 12.735 1.00 0.00 C ATOM 412 NE ARG A 27 -6.167 4.747 12.733 1.00 0.00 N ATOM 413 CZ ARG A 27 -6.201 5.587 13.768 1.00 0.00 C ATOM 414 NH1 ARG A 27 -5.565 5.288 14.894 1.00 0.00 N ATOM 415 NH2 ARG A 27 -6.868 6.731 13.674 1.00 0.00 N ATOM 0 H ARG A 27 -0.916 1.106 11.801 1.00 0.00 H new ATOM 0 HA ARG A 27 -3.047 2.187 13.227 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -3.032 4.067 11.674 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.063 2.978 10.301 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -5.294 3.821 10.626 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -5.295 2.125 11.067 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -6.137 2.679 13.074 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -4.638 3.505 13.448 1.00 0.00 H new ATOM 0 HE ARG A 27 -6.665 5.016 11.884 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -5.047 4.412 14.970 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -5.594 5.934 15.683 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -7.355 6.968 12.810 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -6.894 7.373 14.466 1.00 0.00 H new ATOM 429 N PRO A 28 -3.879 -0.148 12.631 1.00 0.00 N ATOM 430 CA PRO A 28 -4.371 -1.485 12.288 1.00 0.00 C ATOM 431 C PRO A 28 -5.649 -1.435 11.462 1.00 0.00 C ATOM 432 O PRO A 28 -5.935 -2.338 10.680 1.00 0.00 O ATOM 433 CB PRO A 28 -4.651 -2.104 13.650 1.00 0.00 C ATOM 434 CG PRO A 28 -4.962 -0.956 14.539 1.00 0.00 C ATOM 435 CD PRO A 28 -4.132 0.197 14.041 1.00 0.00 C ATOM 0 HA PRO A 28 -3.659 -2.043 11.680 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -5.486 -2.803 13.601 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.789 -2.663 14.014 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -6.024 -0.714 14.505 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -4.721 -1.190 15.576 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -4.663 1.144 14.134 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -3.203 0.296 14.603 1.00 0.00 H new ATOM 443 N ALA A 29 -6.429 -0.391 11.714 1.00 0.00 N ATOM 444 CA ALA A 29 -7.666 -0.102 10.983 1.00 0.00 C ATOM 445 C ALA A 29 -8.726 -1.177 11.213 1.00 0.00 C ATOM 446 O ALA A 29 -9.639 -0.996 12.013 1.00 0.00 O ATOM 447 CB ALA A 29 -7.395 0.075 9.492 1.00 0.00 C ATOM 0 H ALA A 29 -6.221 0.292 12.442 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.058 0.837 11.375 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.331 0.288 8.975 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.702 0.903 9.344 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -6.959 -0.840 9.090 1.00 0.00 H new ATOM 453 N GLN A 30 -8.565 -2.307 10.544 1.00 0.00 N ATOM 454 CA GLN A 30 -9.553 -3.380 10.579 1.00 0.00 C ATOM 455 C GLN A 30 -9.163 -4.428 11.611 1.00 0.00 C ATOM 456 O GLN A 30 -9.767 -5.499 11.690 1.00 0.00 O ATOM 457 CB GLN A 30 -9.680 -4.022 9.193 1.00 0.00 C ATOM 458 CG GLN A 30 -10.044 -3.024 8.105 1.00 0.00 C ATOM 459 CD GLN A 30 -10.178 -3.650 6.729 1.00 0.00 C ATOM 460 OE1 GLN A 30 -9.509 -4.634 6.399 1.00 0.00 O ATOM 461 NE2 GLN A 30 -11.040 -3.069 5.912 1.00 0.00 N ATOM 0 H GLN A 30 -7.751 -2.509 9.963 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.517 -2.958 10.862 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -8.737 -4.504 8.935 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -10.439 -4.804 9.229 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -10.984 -2.539 8.368 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -9.283 -2.245 8.068 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -11.573 -2.258 6.226 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -11.172 -3.432 4.968 1.00 0.00 H new ATOM 470 N SER A 31 -8.146 -4.108 12.394 1.00 0.00 N ATOM 471 CA SER A 31 -7.660 -5.006 13.431 1.00 0.00 C ATOM 472 C SER A 31 -7.863 -4.424 14.830 1.00 0.00 C ATOM 473 O SER A 31 -7.980 -5.168 15.802 1.00 0.00 O ATOM 474 CB SER A 31 -6.182 -5.310 13.196 1.00 0.00 C ATOM 475 OG SER A 31 -6.003 -6.118 12.046 1.00 0.00 O ATOM 0 H SER A 31 -7.637 -3.226 12.331 1.00 0.00 H new ATOM 0 HA SER A 31 -8.239 -5.928 13.375 1.00 0.00 H new ATOM 0 HB2 SER A 31 -5.630 -4.377 13.078 1.00 0.00 H new ATOM 0 HB3 SER A 31 -5.769 -5.817 14.068 1.00 0.00 H new ATOM 0 HG SER A 31 -5.048 -6.297 11.917 1.00 0.00 H new ATOM 481 N ASP A 32 -7.884 -3.091 14.923 1.00 0.00 N ATOM 482 CA ASP A 32 -8.082 -2.380 16.198 1.00 0.00 C ATOM 483 C ASP A 32 -6.977 -2.677 17.208 1.00 0.00 C ATOM 484 O ASP A 32 -7.088 -2.329 18.383 1.00 0.00 O ATOM 485 CB ASP A 32 -9.448 -2.705 16.808 1.00 0.00 C ATOM 486 CG ASP A 32 -10.588 -2.075 16.039 1.00 0.00 C ATOM 487 OD1 ASP A 32 -10.908 -0.900 16.302 1.00 0.00 O ATOM 488 OD2 ASP A 32 -11.165 -2.751 15.162 1.00 0.00 O ATOM 0 H ASP A 32 -7.765 -2.472 14.121 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.041 -1.316 15.965 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.584 -3.786 16.833 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -9.474 -2.357 17.841 1.00 0.00 H new ATOM 493 N GLN A 33 -5.903 -3.291 16.747 1.00 0.00 N ATOM 494 CA GLN A 33 -4.770 -3.579 17.606 1.00 0.00 C ATOM 495 C GLN A 33 -3.671 -2.553 17.365 1.00 0.00 C ATOM 496 O GLN A 33 -2.954 -2.621 16.367 1.00 0.00 O ATOM 497 CB GLN A 33 -4.253 -4.995 17.352 1.00 0.00 C ATOM 498 CG GLN A 33 -5.338 -6.053 17.465 1.00 0.00 C ATOM 499 CD GLN A 33 -4.790 -7.467 17.449 1.00 0.00 C ATOM 500 OE1 GLN A 33 -3.658 -7.715 17.867 1.00 0.00 O ATOM 501 NE2 GLN A 33 -5.594 -8.409 16.980 1.00 0.00 N ATOM 0 H GLN A 33 -5.792 -3.600 15.781 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.087 -3.518 18.647 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.811 -5.041 16.357 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -3.459 -5.219 18.064 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -5.896 -5.896 18.388 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -6.042 -5.933 16.642 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -6.525 -8.164 16.643 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -5.282 -9.380 16.956 1.00 0.00 H new ATOM 510 N ALA A 34 -3.576 -1.580 18.262 1.00 0.00 N ATOM 511 CA ALA A 34 -2.617 -0.494 18.120 1.00 0.00 C ATOM 512 C ALA A 34 -1.187 -1.019 18.097 1.00 0.00 C ATOM 513 O ALA A 34 -0.829 -1.921 18.857 1.00 0.00 O ATOM 514 CB ALA A 34 -2.794 0.519 19.238 1.00 0.00 C ATOM 0 H ALA A 34 -4.155 -1.522 19.100 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.807 -0.001 17.167 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.070 1.324 19.117 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.803 0.930 19.200 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.637 0.031 20.200 1.00 0.00 H new ATOM 520 N GLY A 35 -0.379 -0.445 17.222 1.00 0.00 N ATOM 521 CA GLY A 35 1.002 -0.854 17.110 1.00 0.00 C ATOM 522 C GLY A 35 1.308 -1.475 15.770 1.00 0.00 C ATOM 523 O GLY A 35 2.460 -1.522 15.353 1.00 0.00 O ATOM 0 H GLY A 35 -0.657 0.301 16.584 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.648 0.010 17.264 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.232 -1.569 17.900 1.00 0.00 H new ATOM 527 N LEU A 36 0.277 -1.959 15.094 1.00 0.00 N ATOM 528 CA LEU A 36 0.441 -2.560 13.778 1.00 0.00 C ATOM 529 C LEU A 36 0.634 -1.498 12.705 1.00 0.00 C ATOM 530 O LEU A 36 0.102 -0.389 12.806 1.00 0.00 O ATOM 531 CB LEU A 36 -0.781 -3.421 13.447 1.00 0.00 C ATOM 532 CG LEU A 36 -0.831 -4.817 14.091 1.00 0.00 C ATOM 533 CD1 LEU A 36 -0.457 -4.784 15.567 1.00 0.00 C ATOM 534 CD2 LEU A 36 -2.221 -5.396 13.935 1.00 0.00 C ATOM 0 H LEU A 36 -0.684 -1.947 15.435 1.00 0.00 H new ATOM 0 HA LEU A 36 1.334 -3.185 13.798 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.675 -2.874 13.747 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.830 -3.542 12.365 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.099 -5.442 13.579 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.507 -5.792 15.978 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.556 -4.397 15.677 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.152 -4.139 16.104 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.256 -6.385 14.391 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.944 -4.744 14.425 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.465 -5.476 12.876 1.00 0.00 H new ATOM 546 N TRP A 37 1.402 -1.849 11.684 1.00 0.00 N ATOM 547 CA TRP A 37 1.730 -0.931 10.605 1.00 0.00 C ATOM 548 C TRP A 37 1.139 -1.438 9.294 1.00 0.00 C ATOM 549 O TRP A 37 1.001 -2.644 9.097 1.00 0.00 O ATOM 550 CB TRP A 37 3.253 -0.799 10.464 1.00 0.00 C ATOM 551 CG TRP A 37 3.951 -0.426 11.738 1.00 0.00 C ATOM 552 CD1 TRP A 37 4.282 -1.264 12.764 1.00 0.00 C ATOM 553 CD2 TRP A 37 4.416 0.874 12.119 1.00 0.00 C ATOM 554 NE1 TRP A 37 4.913 -0.564 13.761 1.00 0.00 N ATOM 555 CE2 TRP A 37 5.007 0.749 13.390 1.00 0.00 C ATOM 556 CE3 TRP A 37 4.385 2.133 11.514 1.00 0.00 C ATOM 557 CZ2 TRP A 37 5.564 1.833 14.063 1.00 0.00 C ATOM 558 CZ3 TRP A 37 4.940 3.208 12.183 1.00 0.00 C ATOM 559 CH2 TRP A 37 5.520 3.051 13.446 1.00 0.00 C ATOM 0 H TRP A 37 1.814 -2.776 11.581 1.00 0.00 H new ATOM 0 HA TRP A 37 1.308 0.047 10.838 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.658 -1.744 10.103 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.474 -0.047 9.706 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.077 -2.324 12.787 1.00 0.00 H new ATOM 0 HE1 TRP A 37 5.256 -0.959 14.637 1.00 0.00 H new ATOM 0 HE3 TRP A 37 3.935 2.264 10.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 6.015 1.715 15.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 4.925 4.185 11.723 1.00 0.00 H new ATOM 0 HH2 TRP A 37 5.942 3.911 13.944 1.00 0.00 H new ATOM 570 N GLU A 38 0.795 -0.518 8.408 1.00 0.00 N ATOM 571 CA GLU A 38 0.287 -0.873 7.091 1.00 0.00 C ATOM 572 C GLU A 38 0.817 0.109 6.056 1.00 0.00 C ATOM 573 O GLU A 38 1.354 1.167 6.412 1.00 0.00 O ATOM 574 CB GLU A 38 -1.248 -0.890 7.076 1.00 0.00 C ATOM 575 CG GLU A 38 -1.886 0.400 7.569 1.00 0.00 C ATOM 576 CD GLU A 38 -3.394 0.425 7.380 1.00 0.00 C ATOM 577 OE1 GLU A 38 -4.063 -0.568 7.733 1.00 0.00 O ATOM 578 OE2 GLU A 38 -3.911 1.460 6.896 1.00 0.00 O ATOM 0 H GLU A 38 0.858 0.486 8.577 1.00 0.00 H new ATOM 0 HA GLU A 38 0.633 -1.877 6.845 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.589 -1.087 6.060 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.598 -1.716 7.695 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.655 0.532 8.626 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.445 1.244 7.038 1.00 0.00 H new ATOM 585 N PHE A 39 0.696 -0.248 4.788 1.00 0.00 N ATOM 586 CA PHE A 39 1.097 0.641 3.712 1.00 0.00 C ATOM 587 C PHE A 39 0.017 1.690 3.473 1.00 0.00 C ATOM 588 O PHE A 39 -1.171 1.428 3.659 1.00 0.00 O ATOM 589 CB PHE A 39 1.380 -0.145 2.424 1.00 0.00 C ATOM 590 CG PHE A 39 2.568 -1.044 2.510 1.00 0.00 C ATOM 591 CD1 PHE A 39 3.839 -0.551 2.292 1.00 0.00 C ATOM 592 CD2 PHE A 39 2.410 -2.382 2.800 1.00 0.00 C ATOM 593 CE1 PHE A 39 4.934 -1.382 2.364 1.00 0.00 C ATOM 594 CE2 PHE A 39 3.498 -3.218 2.873 1.00 0.00 C ATOM 595 CZ PHE A 39 4.766 -2.720 2.657 1.00 0.00 C ATOM 0 H PHE A 39 0.324 -1.146 4.480 1.00 0.00 H new ATOM 0 HA PHE A 39 2.019 1.143 4.006 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.503 -0.742 2.175 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.529 0.560 1.606 1.00 0.00 H new ATOM 0 HD1 PHE A 39 3.975 0.496 2.063 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.420 -2.778 2.972 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.924 -0.987 2.191 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.360 -4.265 3.099 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.623 -3.374 2.717 1.00 0.00 H new ATOM 605 N ALA A 40 0.433 2.881 3.075 1.00 0.00 N ATOM 606 CA ALA A 40 -0.500 3.972 2.850 1.00 0.00 C ATOM 607 C ALA A 40 -1.296 3.740 1.575 1.00 0.00 C ATOM 608 O ALA A 40 -0.912 2.932 0.738 1.00 0.00 O ATOM 609 CB ALA A 40 0.244 5.293 2.774 1.00 0.00 C ATOM 0 H ALA A 40 1.410 3.117 2.901 1.00 0.00 H new ATOM 0 HA ALA A 40 -1.196 4.010 3.688 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -0.467 6.102 2.605 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.775 5.466 3.710 1.00 0.00 H new ATOM 0 HB3 ALA A 40 0.959 5.261 1.952 1.00 0.00 H new ATOM 615 N GLY A 41 -2.403 4.446 1.429 1.00 0.00 N ATOM 616 CA GLY A 41 -3.204 4.322 0.235 1.00 0.00 C ATOM 617 C GLY A 41 -4.658 4.627 0.510 1.00 0.00 C ATOM 618 O GLY A 41 -4.968 5.538 1.280 1.00 0.00 O ATOM 0 H GLY A 41 -2.762 5.105 2.120 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.827 5.001 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.112 3.311 -0.163 1.00 0.00 H new ATOM 622 N GLY A 42 -5.542 3.853 -0.093 1.00 0.00 N ATOM 623 CA GLY A 42 -6.957 4.081 0.097 1.00 0.00 C ATOM 624 C GLY A 42 -7.826 3.239 -0.807 1.00 0.00 C ATOM 625 O GLY A 42 -7.329 2.529 -1.683 1.00 0.00 O ATOM 0 H GLY A 42 -5.308 3.074 -0.708 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.215 3.872 1.135 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.175 5.134 -0.080 1.00 0.00 H new ATOM 629 N LYS A 43 -9.125 3.320 -0.580 1.00 0.00 N ATOM 630 CA LYS A 43 -10.090 2.575 -1.369 1.00 0.00 C ATOM 631 C LYS A 43 -10.364 3.303 -2.682 1.00 0.00 C ATOM 632 O LYS A 43 -10.298 4.531 -2.744 1.00 0.00 O ATOM 633 CB LYS A 43 -11.388 2.396 -0.578 1.00 0.00 C ATOM 634 CG LYS A 43 -12.400 1.478 -1.244 1.00 0.00 C ATOM 635 CD LYS A 43 -13.726 1.470 -0.498 1.00 0.00 C ATOM 636 CE LYS A 43 -14.640 2.604 -0.943 1.00 0.00 C ATOM 637 NZ LYS A 43 -14.076 3.957 -0.668 1.00 0.00 N ATOM 0 H LYS A 43 -9.538 3.899 0.151 1.00 0.00 H new ATOM 0 HA LYS A 43 -9.681 1.590 -1.594 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.148 1.999 0.408 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.846 3.373 -0.426 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -12.563 1.800 -2.272 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -12.000 0.465 -1.287 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -14.227 0.516 -0.661 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -13.540 1.554 0.573 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -14.833 2.508 -2.012 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -15.600 2.508 -0.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -14.779 4.683 -0.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -13.838 4.035 0.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -13.218 4.098 -1.238 1.00 0.00 H new ATOM 651 N VAL A 44 -10.677 2.549 -3.720 1.00 0.00 N ATOM 652 CA VAL A 44 -10.915 3.120 -5.033 1.00 0.00 C ATOM 653 C VAL A 44 -12.409 3.236 -5.303 1.00 0.00 C ATOM 654 O VAL A 44 -13.129 2.236 -5.277 1.00 0.00 O ATOM 655 CB VAL A 44 -10.265 2.261 -6.141 1.00 0.00 C ATOM 656 CG1 VAL A 44 -10.440 2.905 -7.508 1.00 0.00 C ATOM 657 CG2 VAL A 44 -8.793 2.032 -5.844 1.00 0.00 C ATOM 0 H VAL A 44 -10.773 1.534 -3.678 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.464 4.112 -5.045 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.770 1.295 -6.157 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.973 2.279 -8.268 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.503 3.010 -7.727 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.970 3.889 -7.510 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.352 1.425 -6.635 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.278 2.992 -5.793 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.690 1.515 -4.890 1.00 0.00 H new ATOM 667 N GLU A 45 -12.876 4.454 -5.530 1.00 0.00 N ATOM 668 CA GLU A 45 -14.246 4.669 -5.960 1.00 0.00 C ATOM 669 C GLU A 45 -14.376 4.252 -7.421 1.00 0.00 C ATOM 670 O GLU A 45 -13.445 4.434 -8.202 1.00 0.00 O ATOM 671 CB GLU A 45 -14.649 6.139 -5.791 1.00 0.00 C ATOM 672 CG GLU A 45 -14.711 6.600 -4.342 1.00 0.00 C ATOM 673 CD GLU A 45 -15.791 5.895 -3.543 1.00 0.00 C ATOM 674 OE1 GLU A 45 -16.984 6.232 -3.714 1.00 0.00 O ATOM 675 OE2 GLU A 45 -15.458 5.009 -2.729 1.00 0.00 O ATOM 0 H GLU A 45 -12.326 5.307 -5.423 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.913 4.068 -5.342 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.938 6.765 -6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.624 6.293 -6.253 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.744 6.426 -3.869 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.890 7.675 -4.315 1.00 0.00 H new ATOM 682 N PRO A 46 -15.532 3.704 -7.818 1.00 0.00 N ATOM 683 CA PRO A 46 -15.737 3.169 -9.176 1.00 0.00 C ATOM 684 C PRO A 46 -15.700 4.243 -10.267 1.00 0.00 C ATOM 685 O PRO A 46 -15.868 3.943 -11.451 1.00 0.00 O ATOM 686 CB PRO A 46 -17.133 2.539 -9.103 1.00 0.00 C ATOM 687 CG PRO A 46 -17.811 3.252 -7.986 1.00 0.00 C ATOM 688 CD PRO A 46 -16.736 3.556 -6.983 1.00 0.00 C ATOM 0 HA PRO A 46 -14.943 2.474 -9.449 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -17.674 2.666 -10.040 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -17.074 1.468 -8.911 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -18.287 4.167 -8.338 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -18.594 2.634 -7.545 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -16.953 4.466 -6.423 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -16.625 2.753 -6.255 1.00 0.00 H new ATOM 696 N ASP A 47 -15.493 5.488 -9.865 1.00 0.00 N ATOM 697 CA ASP A 47 -15.457 6.596 -10.808 1.00 0.00 C ATOM 698 C ASP A 47 -14.049 7.182 -10.922 1.00 0.00 C ATOM 699 O ASP A 47 -13.801 8.103 -11.702 1.00 0.00 O ATOM 700 CB ASP A 47 -16.459 7.669 -10.380 1.00 0.00 C ATOM 701 CG ASP A 47 -16.635 8.756 -11.420 1.00 0.00 C ATOM 702 OD1 ASP A 47 -16.984 8.430 -12.574 1.00 0.00 O ATOM 703 OD2 ASP A 47 -16.434 9.943 -11.089 1.00 0.00 O ATOM 0 H ASP A 47 -15.347 5.757 -8.892 1.00 0.00 H new ATOM 0 HA ASP A 47 -15.735 6.222 -11.793 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -17.424 7.201 -10.183 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -16.126 8.118 -9.444 1.00 0.00 H new ATOM 708 N GLU A 48 -13.122 6.628 -10.159 1.00 0.00 N ATOM 709 CA GLU A 48 -11.744 7.100 -10.193 1.00 0.00 C ATOM 710 C GLU A 48 -10.803 5.981 -10.630 1.00 0.00 C ATOM 711 O GLU A 48 -11.171 4.804 -10.619 1.00 0.00 O ATOM 712 CB GLU A 48 -11.323 7.687 -8.836 1.00 0.00 C ATOM 713 CG GLU A 48 -11.207 6.675 -7.709 1.00 0.00 C ATOM 714 CD GLU A 48 -10.986 7.336 -6.359 1.00 0.00 C ATOM 715 OE1 GLU A 48 -10.355 8.415 -6.309 1.00 0.00 O ATOM 716 OE2 GLU A 48 -11.449 6.785 -5.341 1.00 0.00 O ATOM 0 H GLU A 48 -13.294 5.858 -9.513 1.00 0.00 H new ATOM 0 HA GLU A 48 -11.678 7.902 -10.929 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.362 8.187 -8.956 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -12.046 8.450 -8.547 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -12.114 6.072 -7.671 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.381 5.996 -7.918 1.00 0.00 H new ATOM 723 N SER A 49 -9.604 6.359 -11.051 1.00 0.00 N ATOM 724 CA SER A 49 -8.623 5.396 -11.535 1.00 0.00 C ATOM 725 C SER A 49 -7.689 4.973 -10.401 1.00 0.00 C ATOM 726 O SER A 49 -7.646 5.622 -9.360 1.00 0.00 O ATOM 727 CB SER A 49 -7.832 6.006 -12.697 1.00 0.00 C ATOM 728 OG SER A 49 -6.981 5.052 -13.312 1.00 0.00 O ATOM 0 H SER A 49 -9.286 7.328 -11.067 1.00 0.00 H new ATOM 0 HA SER A 49 -9.140 4.506 -11.894 1.00 0.00 H new ATOM 0 HB2 SER A 49 -8.524 6.407 -13.438 1.00 0.00 H new ATOM 0 HB3 SER A 49 -7.236 6.843 -12.332 1.00 0.00 H new ATOM 0 HG SER A 49 -6.494 5.475 -14.049 1.00 0.00 H new ATOM 734 N GLN A 50 -6.937 3.891 -10.609 1.00 0.00 N ATOM 735 CA GLN A 50 -6.039 3.364 -9.580 1.00 0.00 C ATOM 736 C GLN A 50 -4.972 4.388 -9.208 1.00 0.00 C ATOM 737 O GLN A 50 -4.807 4.720 -8.033 1.00 0.00 O ATOM 738 CB GLN A 50 -5.376 2.065 -10.045 1.00 0.00 C ATOM 739 CG GLN A 50 -6.350 0.914 -10.235 1.00 0.00 C ATOM 740 CD GLN A 50 -5.661 -0.377 -10.637 1.00 0.00 C ATOM 741 OE1 GLN A 50 -4.511 -0.626 -10.273 1.00 0.00 O ATOM 742 NE2 GLN A 50 -6.362 -1.210 -11.388 1.00 0.00 N ATOM 0 H GLN A 50 -6.932 3.362 -11.481 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.641 3.152 -8.696 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.857 2.249 -10.986 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -4.620 1.773 -9.316 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.901 0.753 -9.308 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -7.080 1.184 -10.998 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.312 -0.967 -11.669 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.953 -2.095 -11.686 1.00 0.00 H new ATOM 751 N ARG A 51 -4.256 4.893 -10.212 1.00 0.00 N ATOM 752 CA ARG A 51 -3.243 5.925 -9.984 1.00 0.00 C ATOM 753 C ARG A 51 -3.881 7.147 -9.349 1.00 0.00 C ATOM 754 O ARG A 51 -3.320 7.767 -8.450 1.00 0.00 O ATOM 755 CB ARG A 51 -2.580 6.359 -11.291 1.00 0.00 C ATOM 756 CG ARG A 51 -2.012 5.223 -12.115 1.00 0.00 C ATOM 757 CD ARG A 51 -1.289 5.756 -13.339 1.00 0.00 C ATOM 758 NE ARG A 51 -0.788 4.690 -14.203 1.00 0.00 N ATOM 759 CZ ARG A 51 0.054 4.896 -15.218 1.00 0.00 C ATOM 760 NH1 ARG A 51 0.544 6.110 -15.436 1.00 0.00 N ATOM 761 NH2 ARG A 51 0.416 3.890 -16.004 1.00 0.00 N ATOM 0 H ARG A 51 -4.357 4.607 -11.186 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.488 5.497 -9.325 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.312 6.897 -11.893 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.778 7.061 -11.061 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.324 4.635 -11.507 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.815 4.554 -12.424 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.967 6.392 -13.908 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.456 6.382 -13.020 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.099 3.736 -14.021 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.277 6.884 -14.828 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.188 6.269 -16.211 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.050 2.953 -15.834 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.060 4.054 -16.778 1.00 0.00 H new ATOM 775 N GLN A 52 -5.083 7.450 -9.810 1.00 0.00 N ATOM 776 CA GLN A 52 -5.798 8.643 -9.393 1.00 0.00 C ATOM 777 C GLN A 52 -6.210 8.533 -7.932 1.00 0.00 C ATOM 778 O GLN A 52 -6.062 9.484 -7.163 1.00 0.00 O ATOM 779 CB GLN A 52 -7.016 8.829 -10.294 1.00 0.00 C ATOM 780 CG GLN A 52 -7.905 9.993 -9.913 1.00 0.00 C ATOM 781 CD GLN A 52 -8.926 10.298 -10.987 1.00 0.00 C ATOM 782 OE1 GLN A 52 -10.032 9.758 -10.986 1.00 0.00 O ATOM 783 NE2 GLN A 52 -8.552 11.149 -11.926 1.00 0.00 N ATOM 0 H GLN A 52 -5.590 6.876 -10.484 1.00 0.00 H new ATOM 0 HA GLN A 52 -5.148 9.513 -9.486 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -6.676 8.969 -11.320 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.609 7.914 -10.276 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.418 9.767 -8.978 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -7.291 10.876 -9.735 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -7.626 11.574 -11.889 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.190 11.381 -12.688 1.00 0.00 H new ATOM 792 N ALA A 53 -6.694 7.360 -7.554 1.00 0.00 N ATOM 793 CA ALA A 53 -7.086 7.100 -6.180 1.00 0.00 C ATOM 794 C ALA A 53 -5.884 7.215 -5.257 1.00 0.00 C ATOM 795 O ALA A 53 -5.966 7.839 -4.206 1.00 0.00 O ATOM 796 CB ALA A 53 -7.724 5.726 -6.056 1.00 0.00 C ATOM 0 H ALA A 53 -6.825 6.569 -8.185 1.00 0.00 H new ATOM 0 HA ALA A 53 -7.823 7.847 -5.884 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.011 5.550 -5.019 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -8.609 5.677 -6.690 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -7.010 4.964 -6.369 1.00 0.00 H new ATOM 802 N LEU A 54 -4.758 6.646 -5.674 1.00 0.00 N ATOM 803 CA LEU A 54 -3.537 6.699 -4.881 1.00 0.00 C ATOM 804 C LEU A 54 -3.104 8.139 -4.661 1.00 0.00 C ATOM 805 O LEU A 54 -2.846 8.555 -3.538 1.00 0.00 O ATOM 806 CB LEU A 54 -2.416 5.923 -5.577 1.00 0.00 C ATOM 807 CG LEU A 54 -2.543 4.404 -5.512 1.00 0.00 C ATOM 808 CD1 LEU A 54 -1.742 3.743 -6.617 1.00 0.00 C ATOM 809 CD2 LEU A 54 -2.087 3.908 -4.148 1.00 0.00 C ATOM 0 H LEU A 54 -4.666 6.143 -6.557 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.740 6.241 -3.913 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.382 6.225 -6.624 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.464 6.212 -5.131 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.590 4.136 -5.656 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.850 2.661 -6.547 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.109 4.083 -7.586 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.690 4.010 -6.514 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.179 2.823 -4.106 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.046 4.190 -3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.708 4.355 -3.372 1.00 0.00 H new ATOM 821 N VAL A 55 -3.063 8.900 -5.741 1.00 0.00 N ATOM 822 CA VAL A 55 -2.602 10.279 -5.690 1.00 0.00 C ATOM 823 C VAL A 55 -3.471 11.124 -4.760 1.00 0.00 C ATOM 824 O VAL A 55 -2.955 11.888 -3.942 1.00 0.00 O ATOM 825 CB VAL A 55 -2.571 10.912 -7.099 1.00 0.00 C ATOM 826 CG1 VAL A 55 -2.301 12.409 -7.019 1.00 0.00 C ATOM 827 CG2 VAL A 55 -1.518 10.232 -7.959 1.00 0.00 C ATOM 0 H VAL A 55 -3.345 8.585 -6.669 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.587 10.261 -5.293 1.00 0.00 H new ATOM 0 HB VAL A 55 -3.549 10.767 -7.558 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.284 12.830 -8.024 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.087 12.890 -6.437 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.338 12.580 -6.538 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.507 10.688 -8.949 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.539 10.348 -7.495 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.752 9.171 -8.050 1.00 0.00 H new ATOM 837 N ARG A 56 -4.783 10.971 -4.865 1.00 0.00 N ATOM 838 CA ARG A 56 -5.683 11.771 -4.052 1.00 0.00 C ATOM 839 C ARG A 56 -5.701 11.274 -2.604 1.00 0.00 C ATOM 840 O ARG A 56 -5.660 12.077 -1.677 1.00 0.00 O ATOM 841 CB ARG A 56 -7.091 11.827 -4.674 1.00 0.00 C ATOM 842 CG ARG A 56 -7.851 10.509 -4.719 1.00 0.00 C ATOM 843 CD ARG A 56 -8.764 10.352 -3.516 1.00 0.00 C ATOM 844 NE ARG A 56 -9.679 9.222 -3.656 1.00 0.00 N ATOM 845 CZ ARG A 56 -10.478 8.797 -2.683 1.00 0.00 C ATOM 846 NH1 ARG A 56 -10.484 9.417 -1.509 1.00 0.00 N ATOM 847 NH2 ARG A 56 -11.276 7.756 -2.884 1.00 0.00 N ATOM 0 H ARG A 56 -5.241 10.312 -5.494 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.309 12.795 -4.031 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.686 12.548 -4.114 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.003 12.208 -5.691 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.441 10.459 -5.634 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.143 9.681 -4.751 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.159 10.217 -2.619 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.340 11.267 -3.378 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.706 8.732 -4.550 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.875 10.220 -1.353 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.098 9.090 -0.763 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.277 7.281 -3.786 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.889 7.431 -2.136 1.00 0.00 H new ATOM 861 N GLU A 57 -5.721 9.954 -2.415 1.00 0.00 N ATOM 862 CA GLU A 57 -5.698 9.368 -1.069 1.00 0.00 C ATOM 863 C GLU A 57 -4.421 9.739 -0.320 1.00 0.00 C ATOM 864 O GLU A 57 -4.464 10.046 0.871 1.00 0.00 O ATOM 865 CB GLU A 57 -5.848 7.842 -1.124 1.00 0.00 C ATOM 866 CG GLU A 57 -7.266 7.371 -1.429 1.00 0.00 C ATOM 867 CD GLU A 57 -8.218 7.540 -0.257 1.00 0.00 C ATOM 868 OE1 GLU A 57 -8.334 8.664 0.265 1.00 0.00 O ATOM 869 OE2 GLU A 57 -8.860 6.541 0.147 1.00 0.00 O ATOM 0 H GLU A 57 -5.753 9.271 -3.172 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.548 9.782 -0.526 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -5.173 7.448 -1.884 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.533 7.421 -0.169 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.651 7.927 -2.284 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.239 6.320 -1.718 1.00 0.00 H new ATOM 876 N LEU A 58 -3.283 9.723 -1.009 1.00 0.00 N ATOM 877 CA LEU A 58 -2.026 10.094 -0.372 1.00 0.00 C ATOM 878 C LEU A 58 -2.004 11.582 -0.063 1.00 0.00 C ATOM 879 O LEU A 58 -1.371 12.005 0.889 1.00 0.00 O ATOM 880 CB LEU A 58 -0.814 9.738 -1.230 1.00 0.00 C ATOM 881 CG LEU A 58 -0.714 8.277 -1.670 1.00 0.00 C ATOM 882 CD1 LEU A 58 0.585 8.039 -2.417 1.00 0.00 C ATOM 883 CD2 LEU A 58 -0.830 7.341 -0.480 1.00 0.00 C ATOM 0 H LEU A 58 -3.206 9.462 -1.992 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.963 9.522 0.554 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.827 10.366 -2.121 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.088 9.992 -0.674 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.545 8.065 -2.343 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.642 6.995 -2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.620 8.679 -3.299 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.427 8.272 -1.766 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.756 6.308 -0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.026 7.549 0.226 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.792 7.493 0.010 1.00 0.00 H new ATOM 895 N ARG A 59 -2.673 12.383 -0.877 1.00 0.00 N ATOM 896 CA ARG A 59 -2.802 13.800 -0.574 1.00 0.00 C ATOM 897 C ARG A 59 -3.596 14.006 0.709 1.00 0.00 C ATOM 898 O ARG A 59 -3.308 14.913 1.492 1.00 0.00 O ATOM 899 CB ARG A 59 -3.461 14.558 -1.724 1.00 0.00 C ATOM 900 CG ARG A 59 -3.622 16.037 -1.427 1.00 0.00 C ATOM 901 CD ARG A 59 -4.071 16.820 -2.647 1.00 0.00 C ATOM 902 NE ARG A 59 -3.901 18.257 -2.445 1.00 0.00 N ATOM 903 CZ ARG A 59 -3.043 19.003 -3.138 1.00 0.00 C ATOM 904 NH1 ARG A 59 -2.340 18.457 -4.124 1.00 0.00 N ATOM 905 NH2 ARG A 59 -2.890 20.290 -2.852 1.00 0.00 N ATOM 0 H ARG A 59 -3.128 12.083 -1.739 1.00 0.00 H new ATOM 0 HA ARG A 59 -1.797 14.198 -0.436 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.862 14.435 -2.627 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.439 14.123 -1.929 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.349 16.168 -0.625 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -2.675 16.439 -1.067 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.497 16.502 -3.518 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.118 16.601 -2.858 1.00 0.00 H new ATOM 0 HE ARG A 59 -4.471 18.714 -1.734 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.458 17.469 -4.348 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.682 19.026 -4.657 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -3.431 20.713 -2.098 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.231 20.856 -3.386 1.00 0.00 H new ATOM 919 N GLU A 60 -4.577 13.151 0.929 1.00 0.00 N ATOM 920 CA GLU A 60 -5.440 13.273 2.088 1.00 0.00 C ATOM 921 C GLU A 60 -4.781 12.680 3.328 1.00 0.00 C ATOM 922 O GLU A 60 -4.859 13.254 4.417 1.00 0.00 O ATOM 923 CB GLU A 60 -6.783 12.589 1.821 1.00 0.00 C ATOM 924 CG GLU A 60 -7.465 13.078 0.553 1.00 0.00 C ATOM 925 CD GLU A 60 -8.856 12.502 0.370 1.00 0.00 C ATOM 926 OE1 GLU A 60 -9.663 12.567 1.323 1.00 0.00 O ATOM 927 OE2 GLU A 60 -9.151 11.974 -0.722 1.00 0.00 O ATOM 0 H GLU A 60 -4.796 12.363 0.319 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.613 14.333 2.273 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.627 11.513 1.749 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.445 12.759 2.670 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.528 14.166 0.577 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.852 12.813 -0.308 1.00 0.00 H new ATOM 934 N GLU A 61 -4.125 11.542 3.163 1.00 0.00 N ATOM 935 CA GLU A 61 -3.497 10.863 4.290 1.00 0.00 C ATOM 936 C GLU A 61 -2.057 11.306 4.498 1.00 0.00 C ATOM 937 O GLU A 61 -1.660 11.595 5.623 1.00 0.00 O ATOM 938 CB GLU A 61 -3.547 9.344 4.121 1.00 0.00 C ATOM 939 CG GLU A 61 -4.936 8.774 4.246 1.00 0.00 C ATOM 940 CD GLU A 61 -5.421 8.885 5.670 1.00 0.00 C ATOM 941 OE1 GLU A 61 -4.633 8.536 6.583 1.00 0.00 O ATOM 942 OE2 GLU A 61 -6.559 9.355 5.891 1.00 0.00 O ATOM 0 H GLU A 61 -4.013 11.070 2.266 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.069 11.143 5.174 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.141 9.081 3.144 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -2.904 8.881 4.869 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.616 9.306 3.581 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.937 7.729 3.935 1.00 0.00 H new ATOM 949 N LEU A 62 -1.281 11.360 3.423 1.00 0.00 N ATOM 950 CA LEU A 62 0.145 11.629 3.537 1.00 0.00 C ATOM 951 C LEU A 62 0.488 13.061 3.149 1.00 0.00 C ATOM 952 O LEU A 62 1.653 13.448 3.203 1.00 0.00 O ATOM 953 CB LEU A 62 0.944 10.672 2.652 1.00 0.00 C ATOM 954 CG LEU A 62 0.691 9.183 2.877 1.00 0.00 C ATOM 955 CD1 LEU A 62 1.613 8.369 1.985 1.00 0.00 C ATOM 956 CD2 LEU A 62 0.900 8.810 4.337 1.00 0.00 C ATOM 0 H LEU A 62 -1.613 11.222 2.468 1.00 0.00 H new ATOM 0 HA LEU A 62 0.411 11.480 4.584 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.725 10.904 1.610 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.005 10.867 2.806 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.345 8.962 2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.431 7.307 2.147 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.420 8.615 0.941 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.650 8.600 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.714 7.744 4.471 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.925 9.038 4.628 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.211 9.380 4.960 1.00 0.00 H new ATOM 968 N GLY A 63 -0.524 13.853 2.795 1.00 0.00 N ATOM 969 CA GLY A 63 -0.288 15.195 2.284 1.00 0.00 C ATOM 970 C GLY A 63 0.778 15.294 1.197 1.00 0.00 C ATOM 971 O GLY A 63 1.484 16.300 1.126 1.00 0.00 O ATOM 0 H GLY A 63 -1.507 13.587 2.854 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.225 15.587 1.889 1.00 0.00 H new ATOM 0 HA3 GLY A 63 0.001 15.838 3.115 1.00 0.00 H new ATOM 975 N ILE A 64 0.907 14.280 0.346 1.00 0.00 N ATOM 976 CA ILE A 64 1.891 14.342 -0.733 1.00 0.00 C ATOM 977 C ILE A 64 1.249 14.143 -2.098 1.00 0.00 C ATOM 978 O ILE A 64 0.268 13.411 -2.243 1.00 0.00 O ATOM 979 CB ILE A 64 3.051 13.327 -0.565 1.00 0.00 C ATOM 980 CG1 ILE A 64 2.537 11.887 -0.454 1.00 0.00 C ATOM 981 CG2 ILE A 64 3.900 13.686 0.641 1.00 0.00 C ATOM 982 CD1 ILE A 64 3.652 10.857 -0.342 1.00 0.00 C ATOM 0 H ILE A 64 0.356 13.422 0.379 1.00 0.00 H new ATOM 0 HA ILE A 64 2.312 15.346 -0.672 1.00 0.00 H new ATOM 0 HB ILE A 64 3.670 13.384 -1.461 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.888 11.806 0.418 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.927 11.658 -1.328 1.00 0.00 H new ATOM 0 HG21 ILE A 64 4.709 12.963 0.744 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.319 14.683 0.507 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.282 13.669 1.539 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.219 9.859 -0.267 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.288 10.911 -1.226 1.00 0.00 H new ATOM 0 HD13 ILE A 64 4.249 11.062 0.547 1.00 0.00 H new ATOM 994 N GLU A 65 1.808 14.822 -3.088 1.00 0.00 N ATOM 995 CA GLU A 65 1.374 14.690 -4.468 1.00 0.00 C ATOM 996 C GLU A 65 2.234 13.644 -5.163 1.00 0.00 C ATOM 997 O GLU A 65 3.361 13.927 -5.571 1.00 0.00 O ATOM 998 CB GLU A 65 1.487 16.035 -5.194 1.00 0.00 C ATOM 999 CG GLU A 65 0.688 17.148 -4.537 1.00 0.00 C ATOM 1000 CD GLU A 65 0.699 18.436 -5.340 1.00 0.00 C ATOM 1001 OE1 GLU A 65 1.746 19.114 -5.382 1.00 0.00 O ATOM 1002 OE2 GLU A 65 -0.346 18.776 -5.936 1.00 0.00 O ATOM 0 H GLU A 65 2.576 15.480 -2.956 1.00 0.00 H new ATOM 0 HA GLU A 65 0.330 14.377 -4.490 1.00 0.00 H new ATOM 0 HB2 GLU A 65 2.536 16.328 -5.237 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.147 15.913 -6.223 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.342 16.818 -4.403 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.093 17.342 -3.544 1.00 0.00 H new ATOM 1009 N ALA A 66 1.715 12.434 -5.262 1.00 0.00 N ATOM 1010 CA ALA A 66 2.487 11.315 -5.783 1.00 0.00 C ATOM 1011 C ALA A 66 2.405 11.225 -7.302 1.00 0.00 C ATOM 1012 O ALA A 66 1.409 11.617 -7.910 1.00 0.00 O ATOM 1013 CB ALA A 66 2.007 10.016 -5.154 1.00 0.00 C ATOM 0 H ALA A 66 0.761 12.198 -4.989 1.00 0.00 H new ATOM 0 HA ALA A 66 3.532 11.483 -5.521 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.589 9.184 -5.549 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.134 10.067 -4.073 1.00 0.00 H new ATOM 0 HB3 ALA A 66 0.953 9.865 -5.389 1.00 0.00 H new ATOM 1019 N THR A 67 3.462 10.709 -7.904 1.00 0.00 N ATOM 1020 CA THR A 67 3.482 10.454 -9.329 1.00 0.00 C ATOM 1021 C THR A 67 3.540 8.948 -9.572 1.00 0.00 C ATOM 1022 O THR A 67 4.568 8.311 -9.338 1.00 0.00 O ATOM 1023 CB THR A 67 4.687 11.137 -10.000 1.00 0.00 C ATOM 1024 OG1 THR A 67 4.741 12.522 -9.621 1.00 0.00 O ATOM 1025 CG2 THR A 67 4.591 11.025 -11.514 1.00 0.00 C ATOM 0 H THR A 67 4.324 10.457 -7.421 1.00 0.00 H new ATOM 0 HA THR A 67 2.573 10.867 -9.767 1.00 0.00 H new ATOM 0 HB THR A 67 5.596 10.635 -9.668 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.659 12.757 -9.372 1.00 0.00 H new ATOM 0 HG21 THR A 67 5.452 11.514 -11.970 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.576 9.974 -11.801 1.00 0.00 H new ATOM 0 HG23 THR A 67 3.676 11.507 -11.857 1.00 0.00 H new ATOM 1033 N VAL A 68 2.427 8.380 -10.014 1.00 0.00 N ATOM 1034 CA VAL A 68 2.317 6.936 -10.169 1.00 0.00 C ATOM 1035 C VAL A 68 2.824 6.492 -11.536 1.00 0.00 C ATOM 1036 O VAL A 68 2.435 7.055 -12.562 1.00 0.00 O ATOM 1037 CB VAL A 68 0.856 6.465 -9.996 1.00 0.00 C ATOM 1038 CG1 VAL A 68 0.769 4.946 -9.981 1.00 0.00 C ATOM 1039 CG2 VAL A 68 0.249 7.049 -8.730 1.00 0.00 C ATOM 0 H VAL A 68 1.587 8.897 -10.272 1.00 0.00 H new ATOM 0 HA VAL A 68 2.933 6.483 -9.392 1.00 0.00 H new ATOM 0 HB VAL A 68 0.284 6.827 -10.850 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.271 4.642 -9.858 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.154 4.550 -10.921 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.361 4.556 -9.153 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.780 6.705 -8.628 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.828 6.724 -7.866 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.263 8.137 -8.788 1.00 0.00 H new ATOM 1049 N GLY A 69 3.686 5.481 -11.553 1.00 0.00 N ATOM 1050 CA GLY A 69 4.224 4.995 -12.807 1.00 0.00 C ATOM 1051 C GLY A 69 5.143 3.800 -12.635 1.00 0.00 C ATOM 1052 O GLY A 69 6.314 3.878 -13.007 1.00 0.00 O ATOM 0 H GLY A 69 4.020 4.992 -10.723 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.401 4.721 -13.467 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.772 5.800 -13.297 1.00 0.00 H new ATOM 1056 N GLU A 70 4.580 2.687 -12.122 1.00 0.00 N ATOM 1057 CA GLU A 70 5.312 1.447 -11.792 1.00 0.00 C ATOM 1058 C GLU A 70 4.601 0.718 -10.643 1.00 0.00 C ATOM 1059 O GLU A 70 4.552 1.201 -9.512 1.00 0.00 O ATOM 1060 CB GLU A 70 6.793 1.664 -11.427 1.00 0.00 C ATOM 1061 CG GLU A 70 7.036 2.510 -10.190 1.00 0.00 C ATOM 1062 CD GLU A 70 8.456 2.388 -9.688 1.00 0.00 C ATOM 1063 OE1 GLU A 70 8.927 1.246 -9.510 1.00 0.00 O ATOM 1064 OE2 GLU A 70 9.098 3.426 -9.432 1.00 0.00 O ATOM 0 H GLU A 70 3.582 2.624 -11.921 1.00 0.00 H new ATOM 0 HA GLU A 70 5.309 0.844 -12.700 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.261 0.691 -11.280 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.294 2.134 -12.273 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.821 3.554 -10.417 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.346 2.207 -9.402 1.00 0.00 H new ATOM 1071 N TYR A 71 4.009 -0.430 -10.937 1.00 0.00 N ATOM 1072 CA TYR A 71 3.317 -1.206 -9.925 1.00 0.00 C ATOM 1073 C TYR A 71 4.194 -2.346 -9.417 1.00 0.00 C ATOM 1074 O TYR A 71 5.017 -2.878 -10.163 1.00 0.00 O ATOM 1075 CB TYR A 71 2.032 -1.767 -10.517 1.00 0.00 C ATOM 1076 CG TYR A 71 1.122 -0.722 -11.125 1.00 0.00 C ATOM 1077 CD1 TYR A 71 0.521 0.255 -10.341 1.00 0.00 C ATOM 1078 CD2 TYR A 71 0.860 -0.722 -12.487 1.00 0.00 C ATOM 1079 CE1 TYR A 71 -0.315 1.203 -10.902 1.00 0.00 C ATOM 1080 CE2 TYR A 71 0.029 0.221 -13.054 1.00 0.00 C ATOM 1081 CZ TYR A 71 -0.557 1.181 -12.260 1.00 0.00 C ATOM 1082 OH TYR A 71 -1.386 2.121 -12.829 1.00 0.00 O ATOM 0 H TYR A 71 3.995 -0.843 -11.870 1.00 0.00 H new ATOM 0 HA TYR A 71 3.085 -0.556 -9.082 1.00 0.00 H new ATOM 0 HB2 TYR A 71 2.287 -2.500 -11.282 1.00 0.00 H new ATOM 0 HB3 TYR A 71 1.487 -2.298 -9.736 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.710 0.274 -9.278 1.00 0.00 H new ATOM 0 HD2 TYR A 71 1.315 -1.474 -13.115 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -0.776 1.956 -10.280 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -0.161 0.207 -14.117 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.063 2.397 -12.177 1.00 0.00 H new ATOM 1092 N VAL A 72 4.018 -2.723 -8.152 1.00 0.00 N ATOM 1093 CA VAL A 72 4.812 -3.799 -7.561 1.00 0.00 C ATOM 1094 C VAL A 72 4.076 -5.131 -7.620 1.00 0.00 C ATOM 1095 O VAL A 72 4.434 -6.014 -8.397 1.00 0.00 O ATOM 1096 CB VAL A 72 5.157 -3.495 -6.087 1.00 0.00 C ATOM 1097 CG1 VAL A 72 5.945 -4.640 -5.457 1.00 0.00 C ATOM 1098 CG2 VAL A 72 5.925 -2.191 -5.982 1.00 0.00 C ATOM 0 H VAL A 72 3.337 -2.303 -7.520 1.00 0.00 H new ATOM 0 HA VAL A 72 5.730 -3.866 -8.146 1.00 0.00 H new ATOM 0 HB VAL A 72 4.223 -3.393 -5.535 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.173 -4.397 -4.419 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.351 -5.554 -5.494 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.874 -4.789 -6.008 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.161 -1.991 -4.937 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.849 -2.266 -6.555 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.317 -1.378 -6.379 1.00 0.00 H new ATOM 1108 N ALA A 73 3.030 -5.262 -6.814 1.00 0.00 N ATOM 1109 CA ALA A 73 2.257 -6.495 -6.779 1.00 0.00 C ATOM 1110 C ALA A 73 0.848 -6.241 -6.269 1.00 0.00 C ATOM 1111 O ALA A 73 0.504 -5.116 -5.910 1.00 0.00 O ATOM 1112 CB ALA A 73 2.955 -7.529 -5.907 1.00 0.00 C ATOM 0 H ALA A 73 2.700 -4.534 -6.180 1.00 0.00 H new ATOM 0 HA ALA A 73 2.185 -6.880 -7.796 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.367 -8.447 -5.889 1.00 0.00 H new ATOM 0 HB2 ALA A 73 3.944 -7.740 -6.314 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.055 -7.142 -4.893 1.00 0.00 H new ATOM 1118 N SER A 74 0.041 -7.289 -6.232 1.00 0.00 N ATOM 1119 CA SER A 74 -1.323 -7.190 -5.746 1.00 0.00 C ATOM 1120 C SER A 74 -1.631 -8.364 -4.824 1.00 0.00 C ATOM 1121 O SER A 74 -1.065 -9.447 -4.981 1.00 0.00 O ATOM 1122 CB SER A 74 -2.303 -7.184 -6.921 1.00 0.00 C ATOM 1123 OG SER A 74 -1.906 -6.257 -7.916 1.00 0.00 O ATOM 0 H SER A 74 0.311 -8.224 -6.536 1.00 0.00 H new ATOM 0 HA SER A 74 -1.432 -6.259 -5.190 1.00 0.00 H new ATOM 0 HB2 SER A 74 -2.362 -8.183 -7.354 1.00 0.00 H new ATOM 0 HB3 SER A 74 -3.301 -6.932 -6.564 1.00 0.00 H new ATOM 0 HG SER A 74 -2.570 -5.539 -7.978 1.00 0.00 H new ATOM 1129 N HIS A 75 -2.511 -8.148 -3.860 1.00 0.00 N ATOM 1130 CA HIS A 75 -2.923 -9.211 -2.959 1.00 0.00 C ATOM 1131 C HIS A 75 -4.391 -9.040 -2.585 1.00 0.00 C ATOM 1132 O HIS A 75 -4.885 -7.920 -2.477 1.00 0.00 O ATOM 1133 CB HIS A 75 -2.070 -9.229 -1.693 1.00 0.00 C ATOM 1134 CG HIS A 75 -2.273 -10.479 -0.896 1.00 0.00 C ATOM 1135 ND1 HIS A 75 -3.053 -10.533 0.236 1.00 0.00 N ATOM 1136 CD2 HIS A 75 -1.806 -11.735 -1.090 1.00 0.00 C ATOM 1137 CE1 HIS A 75 -3.058 -11.769 0.702 1.00 0.00 C ATOM 1138 NE2 HIS A 75 -2.310 -12.516 -0.082 1.00 0.00 N ATOM 0 H HIS A 75 -2.953 -7.246 -3.682 1.00 0.00 H new ATOM 0 HA HIS A 75 -2.785 -10.160 -3.477 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -1.018 -9.139 -1.964 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -2.316 -8.363 -1.078 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -1.157 -12.061 -1.890 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -3.587 -12.110 1.580 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -2.134 -13.513 0.040 1.00 0.00 H new ATOM 1147 N GLN A 76 -5.078 -10.147 -2.382 1.00 0.00 N ATOM 1148 CA GLN A 76 -6.481 -10.109 -2.022 1.00 0.00 C ATOM 1149 C GLN A 76 -6.725 -10.727 -0.654 1.00 0.00 C ATOM 1150 O GLN A 76 -6.070 -11.689 -0.259 1.00 0.00 O ATOM 1151 CB GLN A 76 -7.322 -10.800 -3.090 1.00 0.00 C ATOM 1152 CG GLN A 76 -7.440 -9.969 -4.350 1.00 0.00 C ATOM 1153 CD GLN A 76 -8.154 -10.692 -5.475 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -9.370 -10.603 -5.616 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -7.397 -11.401 -6.298 1.00 0.00 N ATOM 0 H GLN A 76 -4.686 -11.085 -2.461 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.784 -9.063 -1.964 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.877 -11.765 -3.333 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.318 -10.999 -2.694 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -7.975 -9.047 -4.121 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.443 -9.684 -4.685 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -6.389 -11.451 -6.148 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.822 -11.897 -7.082 1.00 0.00 H new ATOM 1164 N ARG A 77 -7.661 -10.136 0.064 1.00 0.00 N ATOM 1165 CA ARG A 77 -8.081 -10.622 1.371 1.00 0.00 C ATOM 1166 C ARG A 77 -9.563 -10.330 1.498 1.00 0.00 C ATOM 1167 O ARG A 77 -10.066 -9.493 0.767 1.00 0.00 O ATOM 1168 CB ARG A 77 -7.286 -9.938 2.501 1.00 0.00 C ATOM 1169 CG ARG A 77 -7.700 -8.498 2.795 1.00 0.00 C ATOM 1170 CD ARG A 77 -6.746 -7.839 3.787 1.00 0.00 C ATOM 1171 NE ARG A 77 -7.253 -6.570 4.325 1.00 0.00 N ATOM 1172 CZ ARG A 77 -6.478 -5.514 4.621 1.00 0.00 C ATOM 1173 NH1 ARG A 77 -5.177 -5.530 4.338 1.00 0.00 N ATOM 1174 NH2 ARG A 77 -7.006 -4.439 5.197 1.00 0.00 N ATOM 0 H ARG A 77 -8.157 -9.299 -0.243 1.00 0.00 H new ATOM 0 HA ARG A 77 -7.890 -11.691 1.460 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -7.397 -10.526 3.412 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.228 -9.951 2.241 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.716 -7.925 1.868 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -8.713 -8.483 3.197 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -6.559 -8.526 4.612 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -5.789 -7.661 3.297 1.00 0.00 H new ATOM 0 HE ARG A 77 -8.257 -6.485 4.484 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -4.762 -6.349 3.893 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -4.595 -4.724 4.566 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -8.002 -4.415 5.415 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -6.415 -3.638 5.421 1.00 0.00 H new ATOM 1188 N GLU A 78 -10.280 -10.997 2.381 1.00 0.00 N ATOM 1189 CA GLU A 78 -11.711 -10.751 2.459 1.00 0.00 C ATOM 1190 C GLU A 78 -12.075 -9.964 3.712 1.00 0.00 C ATOM 1191 O GLU A 78 -11.426 -10.079 4.754 1.00 0.00 O ATOM 1192 CB GLU A 78 -12.526 -12.053 2.392 1.00 0.00 C ATOM 1193 CG GLU A 78 -12.664 -12.784 3.718 1.00 0.00 C ATOM 1194 CD GLU A 78 -13.643 -13.939 3.646 1.00 0.00 C ATOM 1195 OE1 GLU A 78 -13.221 -15.062 3.291 1.00 0.00 O ATOM 1196 OE2 GLU A 78 -14.840 -13.730 3.950 1.00 0.00 O ATOM 0 H GLU A 78 -9.915 -11.690 3.034 1.00 0.00 H new ATOM 0 HA GLU A 78 -11.970 -10.150 1.587 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -13.522 -11.823 2.014 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.058 -12.722 1.670 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -11.688 -13.158 4.026 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -12.992 -12.081 4.484 1.00 0.00 H new ATOM 1203 N VAL A 79 -13.107 -9.147 3.583 1.00 0.00 N ATOM 1204 CA VAL A 79 -13.698 -8.469 4.711 1.00 0.00 C ATOM 1205 C VAL A 79 -15.166 -8.884 4.814 1.00 0.00 C ATOM 1206 O VAL A 79 -16.036 -8.326 4.144 1.00 0.00 O ATOM 1207 CB VAL A 79 -13.561 -6.928 4.610 1.00 0.00 C ATOM 1208 CG1 VAL A 79 -14.019 -6.412 3.255 1.00 0.00 C ATOM 1209 CG2 VAL A 79 -14.321 -6.239 5.734 1.00 0.00 C ATOM 0 H VAL A 79 -13.555 -8.939 2.690 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.163 -8.762 5.614 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.503 -6.688 4.714 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.908 -5.328 3.222 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -13.412 -6.863 2.470 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -15.066 -6.675 3.100 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.209 -5.159 5.640 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -15.377 -6.501 5.673 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.922 -6.563 6.695 1.00 0.00 H new ATOM 1219 N SER A 80 -15.409 -9.905 5.629 1.00 0.00 N ATOM 1220 CA SER A 80 -16.743 -10.470 5.818 1.00 0.00 C ATOM 1221 C SER A 80 -17.445 -10.722 4.475 1.00 0.00 C ATOM 1222 O SER A 80 -18.340 -9.972 4.080 1.00 0.00 O ATOM 1223 CB SER A 80 -17.589 -9.548 6.703 1.00 0.00 C ATOM 1224 OG SER A 80 -18.750 -10.208 7.182 1.00 0.00 O ATOM 0 H SER A 80 -14.685 -10.366 6.179 1.00 0.00 H new ATOM 0 HA SER A 80 -16.631 -11.433 6.316 1.00 0.00 H new ATOM 0 HB2 SER A 80 -16.991 -9.203 7.547 1.00 0.00 H new ATOM 0 HB3 SER A 80 -17.880 -8.664 6.136 1.00 0.00 H new ATOM 0 HG SER A 80 -19.267 -9.594 7.744 1.00 0.00 H new ATOM 1230 N GLY A 81 -17.018 -11.763 3.763 1.00 0.00 N ATOM 1231 CA GLY A 81 -17.680 -12.146 2.525 1.00 0.00 C ATOM 1232 C GLY A 81 -17.345 -11.267 1.327 1.00 0.00 C ATOM 1233 O GLY A 81 -17.733 -11.581 0.202 1.00 0.00 O ATOM 0 H GLY A 81 -16.224 -12.349 4.021 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.412 -13.176 2.289 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.758 -12.125 2.684 1.00 0.00 H new ATOM 1237 N ARG A 82 -16.649 -10.165 1.552 1.00 0.00 N ATOM 1238 CA ARG A 82 -16.265 -9.277 0.461 1.00 0.00 C ATOM 1239 C ARG A 82 -14.765 -9.347 0.245 1.00 0.00 C ATOM 1240 O ARG A 82 -14.010 -9.394 1.200 1.00 0.00 O ATOM 1241 CB ARG A 82 -16.685 -7.839 0.767 1.00 0.00 C ATOM 1242 CG ARG A 82 -18.170 -7.701 1.038 1.00 0.00 C ATOM 1243 CD ARG A 82 -18.579 -6.254 1.239 1.00 0.00 C ATOM 1244 NE ARG A 82 -19.999 -6.136 1.575 1.00 0.00 N ATOM 1245 CZ ARG A 82 -20.482 -5.317 2.510 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -19.665 -4.523 3.192 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -21.786 -5.291 2.757 1.00 0.00 N ATOM 0 H ARG A 82 -16.338 -9.862 2.475 1.00 0.00 H new ATOM 0 HA ARG A 82 -16.773 -9.599 -0.448 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -16.128 -7.480 1.633 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.414 -7.200 -0.074 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.731 -8.124 0.205 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -18.432 -8.278 1.925 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -17.979 -5.813 2.035 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.371 -5.687 0.331 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.661 -6.717 1.061 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.663 -4.538 3.002 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -20.039 -3.898 3.906 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -22.417 -5.897 2.232 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -22.157 -4.665 3.472 1.00 0.00 H new ATOM 1261 N ILE A 83 -14.328 -9.336 -0.999 1.00 0.00 N ATOM 1262 CA ILE A 83 -12.912 -9.506 -1.292 1.00 0.00 C ATOM 1263 C ILE A 83 -12.261 -8.155 -1.542 1.00 0.00 C ATOM 1264 O ILE A 83 -12.619 -7.446 -2.478 1.00 0.00 O ATOM 1265 CB ILE A 83 -12.671 -10.443 -2.509 1.00 0.00 C ATOM 1266 CG1 ILE A 83 -12.795 -11.921 -2.107 1.00 0.00 C ATOM 1267 CG2 ILE A 83 -11.301 -10.193 -3.127 1.00 0.00 C ATOM 1268 CD1 ILE A 83 -14.171 -12.330 -1.635 1.00 0.00 C ATOM 0 H ILE A 83 -14.923 -9.213 -1.818 1.00 0.00 H new ATOM 0 HA ILE A 83 -12.457 -9.977 -0.420 1.00 0.00 H new ATOM 0 HB ILE A 83 -13.439 -10.217 -3.249 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.519 -12.541 -2.960 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.076 -12.130 -1.315 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.157 -10.861 -3.976 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.237 -9.159 -3.464 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -10.527 -10.380 -2.383 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -14.166 -13.388 -1.372 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.446 -11.740 -0.760 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -14.895 -12.157 -2.431 1.00 0.00 H new ATOM 1280 N ILE A 84 -11.325 -7.792 -0.685 1.00 0.00 N ATOM 1281 CA ILE A 84 -10.571 -6.570 -0.864 1.00 0.00 C ATOM 1282 C ILE A 84 -9.363 -6.832 -1.751 1.00 0.00 C ATOM 1283 O ILE A 84 -8.587 -7.760 -1.514 1.00 0.00 O ATOM 1284 CB ILE A 84 -10.096 -5.949 0.469 1.00 0.00 C ATOM 1285 CG1 ILE A 84 -10.683 -6.671 1.678 1.00 0.00 C ATOM 1286 CG2 ILE A 84 -10.485 -4.491 0.537 1.00 0.00 C ATOM 1287 CD1 ILE A 84 -10.711 -5.804 2.921 1.00 0.00 C ATOM 0 H ILE A 84 -11.070 -8.329 0.144 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.246 -5.855 -1.333 1.00 0.00 H new ATOM 0 HB ILE A 84 -9.011 -6.052 0.498 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -11.697 -6.997 1.444 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.098 -7.568 1.879 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -10.144 -4.067 1.481 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -10.023 -3.952 -0.290 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -11.569 -4.400 0.469 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -11.138 -6.369 3.749 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.696 -5.499 3.175 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -11.319 -4.919 2.734 1.00 0.00 H new ATOM 1299 N HIS A 85 -9.214 -6.001 -2.761 1.00 0.00 N ATOM 1300 CA HIS A 85 -8.170 -6.160 -3.753 1.00 0.00 C ATOM 1301 C HIS A 85 -7.124 -5.072 -3.559 1.00 0.00 C ATOM 1302 O HIS A 85 -7.341 -3.925 -3.941 1.00 0.00 O ATOM 1303 CB HIS A 85 -8.787 -6.083 -5.159 1.00 0.00 C ATOM 1304 CG HIS A 85 -7.839 -6.398 -6.278 1.00 0.00 C ATOM 1305 ND1 HIS A 85 -7.839 -7.605 -6.942 1.00 0.00 N ATOM 1306 CD2 HIS A 85 -6.877 -5.650 -6.867 1.00 0.00 C ATOM 1307 CE1 HIS A 85 -6.917 -7.587 -7.884 1.00 0.00 C ATOM 1308 NE2 HIS A 85 -6.317 -6.413 -7.863 1.00 0.00 N ATOM 0 H HIS A 85 -9.816 -5.193 -2.918 1.00 0.00 H new ATOM 0 HA HIS A 85 -7.688 -7.131 -3.639 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -9.629 -6.773 -5.210 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -9.187 -5.080 -5.311 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -6.601 -4.640 -6.603 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -6.691 -8.398 -8.560 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -5.562 -6.120 -8.483 1.00 0.00 H new ATOM 1317 N LEU A 86 -6.004 -5.424 -2.946 1.00 0.00 N ATOM 1318 CA LEU A 86 -4.954 -4.458 -2.662 1.00 0.00 C ATOM 1319 C LEU A 86 -3.906 -4.468 -3.758 1.00 0.00 C ATOM 1320 O LEU A 86 -3.331 -5.511 -4.068 1.00 0.00 O ATOM 1321 CB LEU A 86 -4.294 -4.742 -1.310 1.00 0.00 C ATOM 1322 CG LEU A 86 -5.050 -4.228 -0.084 1.00 0.00 C ATOM 1323 CD1 LEU A 86 -6.269 -5.089 0.219 1.00 0.00 C ATOM 1324 CD2 LEU A 86 -4.122 -4.161 1.116 1.00 0.00 C ATOM 0 H LEU A 86 -5.799 -6.374 -2.635 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.415 -3.471 -2.622 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -4.164 -5.819 -1.209 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.298 -4.299 -1.312 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.408 -3.222 -0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.783 -4.696 1.096 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -6.946 -5.075 -0.635 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -5.952 -6.113 0.413 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.673 -3.794 1.982 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.731 -5.156 1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.295 -3.485 0.899 1.00 0.00 H new ATOM 1336 N HIS A 87 -3.669 -3.312 -4.354 1.00 0.00 N ATOM 1337 CA HIS A 87 -2.669 -3.191 -5.399 1.00 0.00 C ATOM 1338 C HIS A 87 -1.539 -2.278 -4.939 1.00 0.00 C ATOM 1339 O HIS A 87 -1.740 -1.080 -4.755 1.00 0.00 O ATOM 1340 CB HIS A 87 -3.297 -2.638 -6.678 1.00 0.00 C ATOM 1341 CG HIS A 87 -2.494 -2.930 -7.909 1.00 0.00 C ATOM 1342 ND1 HIS A 87 -2.848 -3.523 -9.073 1.00 0.00 N flip ATOM 1343 CD2 HIS A 87 -1.149 -2.648 -8.022 1.00 0.00 C flip ATOM 1344 CE1 HIS A 87 -1.725 -3.590 -9.857 1.00 0.00 C flip ATOM 1345 NE2 HIS A 87 -0.718 -3.055 -9.200 1.00 0.00 N flip ATOM 0 H HIS A 87 -4.156 -2.444 -4.131 1.00 0.00 H new ATOM 0 HA HIS A 87 -2.265 -4.181 -5.608 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -4.295 -3.060 -6.796 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -3.416 -1.559 -6.578 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -3.779 -3.858 -9.321 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -0.544 -2.170 -7.266 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -1.675 -4.012 -10.850 1.00 0.00 H new ATOM 1354 N ALA A 88 -0.356 -2.847 -4.763 1.00 0.00 N ATOM 1355 CA ALA A 88 0.800 -2.088 -4.307 1.00 0.00 C ATOM 1356 C ALA A 88 1.571 -1.512 -5.485 1.00 0.00 C ATOM 1357 O ALA A 88 1.659 -2.134 -6.548 1.00 0.00 O ATOM 1358 CB ALA A 88 1.720 -2.965 -3.468 1.00 0.00 C ATOM 0 H ALA A 88 -0.170 -3.836 -4.930 1.00 0.00 H new ATOM 0 HA ALA A 88 0.437 -1.265 -3.692 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.578 -2.380 -3.137 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.176 -3.336 -2.599 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.065 -3.808 -4.067 1.00 0.00 H new ATOM 1364 N TRP A 89 2.118 -0.323 -5.296 1.00 0.00 N ATOM 1365 CA TRP A 89 2.951 0.308 -6.308 1.00 0.00 C ATOM 1366 C TRP A 89 4.148 0.984 -5.642 1.00 0.00 C ATOM 1367 O TRP A 89 4.065 1.402 -4.484 1.00 0.00 O ATOM 1368 CB TRP A 89 2.142 1.333 -7.120 1.00 0.00 C ATOM 1369 CG TRP A 89 1.863 2.607 -6.386 1.00 0.00 C ATOM 1370 CD1 TRP A 89 1.032 2.765 -5.326 1.00 0.00 C ATOM 1371 CD2 TRP A 89 2.413 3.900 -6.659 1.00 0.00 C ATOM 1372 NE1 TRP A 89 1.024 4.076 -4.925 1.00 0.00 N ATOM 1373 CE2 TRP A 89 1.864 4.793 -5.723 1.00 0.00 C ATOM 1374 CE3 TRP A 89 3.312 4.390 -7.600 1.00 0.00 C ATOM 1375 CZ2 TRP A 89 2.184 6.146 -5.701 1.00 0.00 C ATOM 1376 CZ3 TRP A 89 3.635 5.731 -7.577 1.00 0.00 C ATOM 1377 CH2 TRP A 89 3.072 6.597 -6.634 1.00 0.00 C ATOM 0 H TRP A 89 2.000 0.228 -4.446 1.00 0.00 H new ATOM 0 HA TRP A 89 3.309 -0.460 -6.994 1.00 0.00 H new ATOM 0 HB2 TRP A 89 2.685 1.565 -8.036 1.00 0.00 H new ATOM 0 HB3 TRP A 89 1.195 0.881 -7.416 1.00 0.00 H new ATOM 0 HD1 TRP A 89 0.460 1.973 -4.865 1.00 0.00 H new ATOM 0 HE1 TRP A 89 0.476 4.454 -4.152 1.00 0.00 H new ATOM 0 HE3 TRP A 89 3.750 3.732 -8.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 1.747 6.814 -4.974 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 4.336 6.120 -8.301 1.00 0.00 H new ATOM 0 HH2 TRP A 89 3.345 7.642 -6.644 1.00 0.00 H new ATOM 1388 N HIS A 90 5.255 1.071 -6.361 1.00 0.00 N ATOM 1389 CA HIS A 90 6.440 1.752 -5.860 1.00 0.00 C ATOM 1390 C HIS A 90 6.373 3.210 -6.262 1.00 0.00 C ATOM 1391 O HIS A 90 6.094 3.517 -7.413 1.00 0.00 O ATOM 1392 CB HIS A 90 7.715 1.108 -6.424 1.00 0.00 C ATOM 1393 CG HIS A 90 8.986 1.825 -6.065 1.00 0.00 C ATOM 1394 ND1 HIS A 90 9.635 2.687 -6.922 1.00 0.00 N ATOM 1395 CD2 HIS A 90 9.737 1.788 -4.942 1.00 0.00 C ATOM 1396 CE1 HIS A 90 10.724 3.147 -6.343 1.00 0.00 C ATOM 1397 NE2 HIS A 90 10.812 2.620 -5.140 1.00 0.00 N ATOM 0 H HIS A 90 5.359 0.678 -7.296 1.00 0.00 H new ATOM 0 HA HIS A 90 6.471 1.668 -4.774 1.00 0.00 H new ATOM 0 HB2 HIS A 90 7.778 0.081 -6.064 1.00 0.00 H new ATOM 0 HB3 HIS A 90 7.633 1.061 -7.510 1.00 0.00 H new ATOM 0 HD2 HIS A 90 9.530 1.211 -4.053 1.00 0.00 H new ATOM 0 HE1 HIS A 90 11.427 3.840 -6.781 1.00 0.00 H new ATOM 0 HE2 HIS A 90 11.556 2.800 -4.466 1.00 0.00 H new ATOM 1406 N VAL A 91 6.640 4.099 -5.324 1.00 0.00 N ATOM 1407 CA VAL A 91 6.551 5.527 -5.590 1.00 0.00 C ATOM 1408 C VAL A 91 7.888 6.051 -6.102 1.00 0.00 C ATOM 1409 O VAL A 91 8.855 6.146 -5.346 1.00 0.00 O ATOM 1410 CB VAL A 91 6.159 6.309 -4.317 1.00 0.00 C ATOM 1411 CG1 VAL A 91 5.922 7.778 -4.631 1.00 0.00 C ATOM 1412 CG2 VAL A 91 4.932 5.689 -3.671 1.00 0.00 C ATOM 0 H VAL A 91 6.920 3.861 -4.372 1.00 0.00 H new ATOM 0 HA VAL A 91 5.780 5.675 -6.346 1.00 0.00 H new ATOM 0 HB VAL A 91 6.987 6.249 -3.611 1.00 0.00 H new ATOM 0 HG11 VAL A 91 5.647 8.306 -3.718 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.833 8.214 -5.042 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.116 7.869 -5.359 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.669 6.252 -2.775 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.099 5.714 -4.373 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.147 4.655 -3.400 1.00 0.00 H new ATOM 1422 N PRO A 92 7.965 6.369 -7.404 1.00 0.00 N ATOM 1423 CA PRO A 92 9.184 6.893 -8.013 1.00 0.00 C ATOM 1424 C PRO A 92 9.375 8.375 -7.713 1.00 0.00 C ATOM 1425 O PRO A 92 10.502 8.871 -7.640 1.00 0.00 O ATOM 1426 CB PRO A 92 8.947 6.669 -9.509 1.00 0.00 C ATOM 1427 CG PRO A 92 7.467 6.730 -9.677 1.00 0.00 C ATOM 1428 CD PRO A 92 6.872 6.224 -8.388 1.00 0.00 C ATOM 0 HA PRO A 92 10.083 6.407 -7.635 1.00 0.00 H new ATOM 0 HB2 PRO A 92 9.444 7.433 -10.106 1.00 0.00 H new ATOM 0 HB3 PRO A 92 9.342 5.706 -9.832 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.141 7.750 -9.881 1.00 0.00 H new ATOM 0 HG3 PRO A 92 7.146 6.118 -10.520 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.996 6.804 -8.099 1.00 0.00 H new ATOM 0 HD3 PRO A 92 6.551 5.186 -8.477 1.00 0.00 H new ATOM 1436 N ASP A 93 8.266 9.073 -7.519 1.00 0.00 N ATOM 1437 CA ASP A 93 8.295 10.505 -7.282 1.00 0.00 C ATOM 1438 C ASP A 93 7.085 10.942 -6.473 1.00 0.00 C ATOM 1439 O ASP A 93 5.969 10.472 -6.697 1.00 0.00 O ATOM 1440 CB ASP A 93 8.320 11.256 -8.608 1.00 0.00 C ATOM 1441 CG ASP A 93 8.260 12.757 -8.433 1.00 0.00 C ATOM 1442 OD1 ASP A 93 9.197 13.332 -7.843 1.00 0.00 O ATOM 1443 OD2 ASP A 93 7.270 13.366 -8.888 1.00 0.00 O ATOM 0 H ASP A 93 7.331 8.666 -7.522 1.00 0.00 H new ATOM 0 HA ASP A 93 9.197 10.738 -6.717 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.228 10.994 -9.151 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.478 10.932 -9.220 1.00 0.00 H new ATOM 1448 N PHE A 94 7.327 11.830 -5.530 1.00 0.00 N ATOM 1449 CA PHE A 94 6.276 12.388 -4.691 1.00 0.00 C ATOM 1450 C PHE A 94 6.635 13.817 -4.296 1.00 0.00 C ATOM 1451 O PHE A 94 7.789 14.111 -3.979 1.00 0.00 O ATOM 1452 CB PHE A 94 6.038 11.517 -3.441 1.00 0.00 C ATOM 1453 CG PHE A 94 7.265 11.292 -2.598 1.00 0.00 C ATOM 1454 CD1 PHE A 94 8.205 10.334 -2.951 1.00 0.00 C ATOM 1455 CD2 PHE A 94 7.478 12.039 -1.451 1.00 0.00 C ATOM 1456 CE1 PHE A 94 9.331 10.128 -2.178 1.00 0.00 C ATOM 1457 CE2 PHE A 94 8.601 11.837 -0.675 1.00 0.00 C ATOM 1458 CZ PHE A 94 9.530 10.883 -1.037 1.00 0.00 C ATOM 0 H PHE A 94 8.259 12.188 -5.320 1.00 0.00 H new ATOM 0 HA PHE A 94 5.347 12.401 -5.262 1.00 0.00 H new ATOM 0 HB2 PHE A 94 5.271 11.987 -2.826 1.00 0.00 H new ATOM 0 HB3 PHE A 94 5.646 10.550 -3.756 1.00 0.00 H new ATOM 0 HD1 PHE A 94 8.054 9.742 -3.842 1.00 0.00 H new ATOM 0 HD2 PHE A 94 6.757 12.788 -1.161 1.00 0.00 H new ATOM 0 HE1 PHE A 94 10.054 9.379 -2.464 1.00 0.00 H new ATOM 0 HE2 PHE A 94 8.753 12.426 0.217 1.00 0.00 H new ATOM 0 HZ PHE A 94 10.410 10.727 -0.431 1.00 0.00 H new ATOM 1468 N HIS A 95 5.658 14.706 -4.364 1.00 0.00 N ATOM 1469 CA HIS A 95 5.874 16.111 -4.050 1.00 0.00 C ATOM 1470 C HIS A 95 5.241 16.462 -2.710 1.00 0.00 C ATOM 1471 O HIS A 95 4.149 15.992 -2.392 1.00 0.00 O ATOM 1472 CB HIS A 95 5.274 16.994 -5.152 1.00 0.00 C ATOM 1473 CG HIS A 95 5.794 16.697 -6.528 1.00 0.00 C ATOM 1474 ND1 HIS A 95 5.022 16.809 -7.663 1.00 0.00 N ATOM 1475 CD2 HIS A 95 7.014 16.287 -6.949 1.00 0.00 C ATOM 1476 CE1 HIS A 95 5.741 16.480 -8.717 1.00 0.00 C ATOM 1477 NE2 HIS A 95 6.954 16.158 -8.314 1.00 0.00 N ATOM 0 H HIS A 95 4.701 14.479 -4.635 1.00 0.00 H new ATOM 0 HA HIS A 95 6.948 16.290 -3.989 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.191 16.872 -5.151 1.00 0.00 H new ATOM 0 HB3 HIS A 95 5.477 18.039 -4.916 1.00 0.00 H new ATOM 0 HD2 HIS A 95 7.875 16.097 -6.326 1.00 0.00 H new ATOM 0 HE1 HIS A 95 5.394 16.475 -9.740 1.00 0.00 H new ATOM 0 HE2 HIS A 95 7.721 15.862 -8.917 1.00 0.00 H new ATOM 1486 N GLY A 96 5.926 17.282 -1.926 1.00 0.00 N ATOM 1487 CA GLY A 96 5.400 17.681 -0.636 1.00 0.00 C ATOM 1488 C GLY A 96 6.126 17.005 0.511 1.00 0.00 C ATOM 1489 O GLY A 96 7.245 16.522 0.344 1.00 0.00 O ATOM 0 H GLY A 96 6.836 17.678 -2.160 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.484 18.763 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.339 17.437 -0.587 1.00 0.00 H new ATOM 1493 N THR A 97 5.499 16.975 1.678 1.00 0.00 N ATOM 1494 CA THR A 97 6.076 16.315 2.831 1.00 0.00 C ATOM 1495 C THR A 97 5.089 15.302 3.387 1.00 0.00 C ATOM 1496 O THR A 97 3.904 15.599 3.538 1.00 0.00 O ATOM 1497 CB THR A 97 6.461 17.327 3.927 1.00 0.00 C ATOM 1498 OG1 THR A 97 7.344 18.315 3.376 1.00 0.00 O ATOM 1499 CG2 THR A 97 7.141 16.630 5.099 1.00 0.00 C ATOM 0 H THR A 97 4.588 17.402 1.848 1.00 0.00 H new ATOM 0 HA THR A 97 6.985 15.807 2.510 1.00 0.00 H new ATOM 0 HB THR A 97 5.552 17.804 4.292 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.588 18.960 4.072 1.00 0.00 H new ATOM 0 HG21 THR A 97 7.402 17.367 5.859 1.00 0.00 H new ATOM 0 HG22 THR A 97 6.462 15.893 5.527 1.00 0.00 H new ATOM 0 HG23 THR A 97 8.046 16.131 4.751 1.00 0.00 H new ATOM 1507 N LEU A 98 5.582 14.110 3.681 1.00 0.00 N ATOM 1508 CA LEU A 98 4.725 13.019 4.126 1.00 0.00 C ATOM 1509 C LEU A 98 4.262 13.233 5.559 1.00 0.00 C ATOM 1510 O LEU A 98 5.067 13.401 6.477 1.00 0.00 O ATOM 1511 CB LEU A 98 5.381 11.623 3.972 1.00 0.00 C ATOM 1512 CG LEU A 98 6.925 11.521 3.950 1.00 0.00 C ATOM 1513 CD1 LEU A 98 7.493 11.979 2.610 1.00 0.00 C ATOM 1514 CD2 LEU A 98 7.567 12.279 5.109 1.00 0.00 C ATOM 0 H LEU A 98 6.572 13.871 3.620 1.00 0.00 H new ATOM 0 HA LEU A 98 3.857 13.033 3.467 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.021 10.998 4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.008 11.184 3.046 1.00 0.00 H new ATOM 0 HG LEU A 98 7.175 10.468 4.078 1.00 0.00 H new ATOM 0 HD11 LEU A 98 8.580 11.895 2.628 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.093 11.353 1.812 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.212 13.017 2.431 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.651 12.179 5.053 1.00 0.00 H new ATOM 0 HD22 LEU A 98 7.296 13.333 5.049 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.213 11.867 6.054 1.00 0.00 H new ATOM 1526 N GLN A 99 2.953 13.239 5.735 1.00 0.00 N ATOM 1527 CA GLN A 99 2.356 13.398 7.045 1.00 0.00 C ATOM 1528 C GLN A 99 1.365 12.267 7.295 1.00 0.00 C ATOM 1529 O GLN A 99 1.046 11.508 6.384 1.00 0.00 O ATOM 1530 CB GLN A 99 1.661 14.759 7.156 1.00 0.00 C ATOM 1531 CG GLN A 99 0.384 14.875 6.334 1.00 0.00 C ATOM 1532 CD GLN A 99 -0.368 16.160 6.620 1.00 0.00 C ATOM 1533 OE1 GLN A 99 -0.303 16.697 7.727 1.00 0.00 O ATOM 1534 NE2 GLN A 99 -1.090 16.659 5.628 1.00 0.00 N ATOM 0 H GLN A 99 2.278 13.134 4.977 1.00 0.00 H new ATOM 0 HA GLN A 99 3.139 13.357 7.802 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.425 14.950 8.203 1.00 0.00 H new ATOM 0 HB3 GLN A 99 2.356 15.537 6.839 1.00 0.00 H new ATOM 0 HG2 GLN A 99 0.632 14.830 5.273 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -0.262 14.023 6.547 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -1.116 16.182 4.727 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -1.620 17.520 5.766 1.00 0.00 H new ATOM 1543 N ALA A 100 0.914 12.133 8.528 1.00 0.00 N ATOM 1544 CA ALA A 100 -0.059 11.107 8.868 1.00 0.00 C ATOM 1545 C ALA A 100 -1.415 11.715 9.218 1.00 0.00 C ATOM 1546 O ALA A 100 -1.519 12.547 10.119 1.00 0.00 O ATOM 1547 CB ALA A 100 0.465 10.251 10.011 1.00 0.00 C ATOM 0 H ALA A 100 1.204 12.719 9.311 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.206 10.473 7.993 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.270 9.485 10.259 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.398 9.774 9.710 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.643 10.879 10.884 1.00 0.00 H new ATOM 1553 N HIS A 101 -2.453 11.309 8.491 1.00 0.00 N ATOM 1554 CA HIS A 101 -3.814 11.779 8.743 1.00 0.00 C ATOM 1555 C HIS A 101 -4.547 10.802 9.650 1.00 0.00 C ATOM 1556 O HIS A 101 -4.765 11.066 10.833 1.00 0.00 O ATOM 1557 CB HIS A 101 -4.571 11.897 7.416 1.00 0.00 C ATOM 1558 CG HIS A 101 -5.979 12.394 7.536 1.00 0.00 C ATOM 1559 ND1 HIS A 101 -7.060 11.672 7.079 1.00 0.00 N ATOM 1560 CD2 HIS A 101 -6.482 13.544 8.038 1.00 0.00 C ATOM 1561 CE1 HIS A 101 -8.167 12.357 7.294 1.00 0.00 C ATOM 1562 NE2 HIS A 101 -7.843 13.496 7.876 1.00 0.00 N ATOM 0 H HIS A 101 -2.377 10.650 7.716 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.765 12.753 9.229 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -4.019 12.568 6.758 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.586 10.919 6.935 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -7.012 10.751 6.642 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -5.918 14.350 8.483 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -9.167 12.040 7.038 1.00 0.00 H new ATOM 1571 N GLU A 102 -4.928 9.673 9.071 1.00 0.00 N ATOM 1572 CA GLU A 102 -5.603 8.620 9.798 1.00 0.00 C ATOM 1573 C GLU A 102 -4.603 7.862 10.639 1.00 0.00 C ATOM 1574 O GLU A 102 -4.814 7.601 11.818 1.00 0.00 O ATOM 1575 CB GLU A 102 -6.253 7.664 8.807 1.00 0.00 C ATOM 1576 CG GLU A 102 -7.713 7.402 9.101 1.00 0.00 C ATOM 1577 CD GLU A 102 -7.926 6.779 10.472 1.00 0.00 C ATOM 1578 OE1 GLU A 102 -7.757 5.550 10.610 1.00 0.00 O ATOM 1579 OE2 GLU A 102 -8.250 7.518 11.425 1.00 0.00 O ATOM 0 H GLU A 102 -4.776 9.466 8.084 1.00 0.00 H new ATOM 0 HA GLU A 102 -6.364 9.056 10.445 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.160 8.075 7.802 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -5.712 6.718 8.817 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.267 8.339 9.041 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.122 6.741 8.337 1.00 0.00 H new ATOM 1586 N HIS A 103 -3.499 7.532 10.006 1.00 0.00 N ATOM 1587 CA HIS A 103 -2.452 6.761 10.636 1.00 0.00 C ATOM 1588 C HIS A 103 -1.739 7.629 11.666 1.00 0.00 C ATOM 1589 O HIS A 103 -1.705 8.848 11.527 1.00 0.00 O ATOM 1590 CB HIS A 103 -1.488 6.257 9.562 1.00 0.00 C ATOM 1591 CG HIS A 103 -2.158 5.409 8.515 1.00 0.00 C ATOM 1592 ND1 HIS A 103 -2.889 5.928 7.458 1.00 0.00 N ATOM 1593 CD2 HIS A 103 -2.211 4.065 8.373 1.00 0.00 C ATOM 1594 CE1 HIS A 103 -3.358 4.934 6.725 1.00 0.00 C ATOM 1595 NE2 HIS A 103 -2.960 3.798 7.259 1.00 0.00 N ATOM 0 H HIS A 103 -3.302 7.791 9.039 1.00 0.00 H new ATOM 0 HA HIS A 103 -2.870 5.897 11.153 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -1.013 7.111 9.079 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -0.696 5.678 10.037 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -1.747 3.336 9.020 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -3.965 5.036 5.838 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -3.175 2.868 6.900 1.00 0.00 H new ATOM 1604 N GLN A 104 -1.196 7.013 12.701 1.00 0.00 N ATOM 1605 CA GLN A 104 -0.602 7.773 13.794 1.00 0.00 C ATOM 1606 C GLN A 104 0.889 8.003 13.560 1.00 0.00 C ATOM 1607 O GLN A 104 1.328 9.132 13.343 1.00 0.00 O ATOM 1608 CB GLN A 104 -0.824 7.047 15.122 1.00 0.00 C ATOM 1609 CG GLN A 104 -0.476 7.886 16.341 1.00 0.00 C ATOM 1610 CD GLN A 104 -0.680 7.132 17.638 1.00 0.00 C ATOM 1611 OE1 GLN A 104 -1.765 7.146 18.212 1.00 0.00 O ATOM 1612 NE2 GLN A 104 0.369 6.486 18.115 1.00 0.00 N ATOM 0 H GLN A 104 -1.152 6.000 12.811 1.00 0.00 H new ATOM 0 HA GLN A 104 -1.090 8.747 13.834 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -1.868 6.740 15.189 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -0.223 6.138 15.134 1.00 0.00 H new ATOM 0 HG2 GLN A 104 0.563 8.210 16.272 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -1.091 8.786 16.347 1.00 0.00 H new ATOM 0 HE21 GLN A 104 1.252 6.501 17.605 1.00 0.00 H new ATOM 0 HE22 GLN A 104 0.296 5.972 18.993 1.00 0.00 H new ATOM 1621 N ALA A 105 1.660 6.928 13.589 1.00 0.00 N ATOM 1622 CA ALA A 105 3.106 7.026 13.455 1.00 0.00 C ATOM 1623 C ALA A 105 3.545 6.725 12.029 1.00 0.00 C ATOM 1624 O ALA A 105 2.866 5.995 11.306 1.00 0.00 O ATOM 1625 CB ALA A 105 3.789 6.079 14.427 1.00 0.00 C ATOM 0 H ALA A 105 1.310 5.977 13.704 1.00 0.00 H new ATOM 0 HA ALA A 105 3.400 8.049 13.691 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.870 6.162 14.317 1.00 0.00 H new ATOM 0 HB2 ALA A 105 3.507 6.339 15.447 1.00 0.00 H new ATOM 0 HB3 ALA A 105 3.480 5.055 14.215 1.00 0.00 H new ATOM 1631 N LEU A 106 4.681 7.283 11.637 1.00 0.00 N ATOM 1632 CA LEU A 106 5.248 7.060 10.316 1.00 0.00 C ATOM 1633 C LEU A 106 6.718 6.689 10.466 1.00 0.00 C ATOM 1634 O LEU A 106 7.488 7.435 11.073 1.00 0.00 O ATOM 1635 CB LEU A 106 5.116 8.322 9.456 1.00 0.00 C ATOM 1636 CG LEU A 106 4.278 8.176 8.185 1.00 0.00 C ATOM 1637 CD1 LEU A 106 2.855 7.764 8.518 1.00 0.00 C ATOM 1638 CD2 LEU A 106 4.282 9.478 7.399 1.00 0.00 C ATOM 0 H LEU A 106 5.236 7.904 12.227 1.00 0.00 H new ATOM 0 HA LEU A 106 4.708 6.251 9.824 1.00 0.00 H new ATOM 0 HB2 LEU A 106 4.680 9.112 10.068 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.115 8.653 9.174 1.00 0.00 H new ATOM 0 HG LEU A 106 4.723 7.393 7.571 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.279 7.667 7.597 1.00 0.00 H new ATOM 0 HD12 LEU A 106 2.866 6.808 9.042 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.397 8.521 9.154 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.682 9.360 6.497 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.862 10.275 8.013 1.00 0.00 H new ATOM 0 HD23 LEU A 106 5.305 9.733 7.123 1.00 0.00 H new ATOM 1650 N VAL A 107 7.105 5.542 9.932 1.00 0.00 N ATOM 1651 CA VAL A 107 8.474 5.067 10.079 1.00 0.00 C ATOM 1652 C VAL A 107 9.060 4.671 8.728 1.00 0.00 C ATOM 1653 O VAL A 107 8.344 4.183 7.850 1.00 0.00 O ATOM 1654 CB VAL A 107 8.551 3.863 11.055 1.00 0.00 C ATOM 1655 CG1 VAL A 107 7.874 2.632 10.473 1.00 0.00 C ATOM 1656 CG2 VAL A 107 9.992 3.551 11.429 1.00 0.00 C ATOM 0 H VAL A 107 6.496 4.925 9.395 1.00 0.00 H new ATOM 0 HA VAL A 107 9.059 5.888 10.493 1.00 0.00 H new ATOM 0 HB VAL A 107 8.015 4.146 11.961 1.00 0.00 H new ATOM 0 HG11 VAL A 107 7.946 1.807 11.182 1.00 0.00 H new ATOM 0 HG12 VAL A 107 6.824 2.852 10.278 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.365 2.353 9.541 1.00 0.00 H new ATOM 0 HG21 VAL A 107 10.015 2.703 12.114 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.557 3.306 10.529 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.439 4.420 11.912 1.00 0.00 H new ATOM 1666 N TRP A 108 10.348 4.916 8.554 1.00 0.00 N ATOM 1667 CA TRP A 108 11.056 4.467 7.369 1.00 0.00 C ATOM 1668 C TRP A 108 11.962 3.302 7.726 1.00 0.00 C ATOM 1669 O TRP A 108 12.882 3.442 8.533 1.00 0.00 O ATOM 1670 CB TRP A 108 11.891 5.597 6.765 1.00 0.00 C ATOM 1671 CG TRP A 108 11.084 6.787 6.344 1.00 0.00 C ATOM 1672 CD1 TRP A 108 10.359 6.924 5.195 1.00 0.00 C ATOM 1673 CD2 TRP A 108 10.930 8.015 7.066 1.00 0.00 C ATOM 1674 NE1 TRP A 108 9.761 8.160 5.162 1.00 0.00 N ATOM 1675 CE2 TRP A 108 10.096 8.849 6.300 1.00 0.00 C ATOM 1676 CE3 TRP A 108 11.417 8.489 8.290 1.00 0.00 C ATOM 1677 CZ2 TRP A 108 9.741 10.129 6.715 1.00 0.00 C ATOM 1678 CZ3 TRP A 108 11.060 9.759 8.702 1.00 0.00 C ATOM 1679 CH2 TRP A 108 10.229 10.566 7.916 1.00 0.00 C ATOM 0 H TRP A 108 10.926 5.426 9.222 1.00 0.00 H new ATOM 0 HA TRP A 108 10.319 4.151 6.630 1.00 0.00 H new ATOM 0 HB2 TRP A 108 12.637 5.915 7.494 1.00 0.00 H new ATOM 0 HB3 TRP A 108 12.433 5.213 5.901 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.269 6.171 4.426 1.00 0.00 H new ATOM 0 HE1 TRP A 108 9.164 8.509 4.412 1.00 0.00 H new ATOM 0 HE3 TRP A 108 12.060 7.873 8.901 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 9.102 10.756 6.110 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 11.428 10.135 9.645 1.00 0.00 H new ATOM 0 HH2 TRP A 108 9.968 11.554 8.265 1.00 0.00 H new ATOM 1690 N CYS A 109 11.693 2.152 7.142 1.00 0.00 N ATOM 1691 CA CYS A 109 12.520 0.981 7.374 1.00 0.00 C ATOM 1692 C CYS A 109 12.730 0.219 6.077 1.00 0.00 C ATOM 1693 O CYS A 109 11.916 0.305 5.161 1.00 0.00 O ATOM 1694 CB CYS A 109 11.899 0.076 8.444 1.00 0.00 C ATOM 1695 SG CYS A 109 10.230 -0.492 8.066 1.00 0.00 S ATOM 0 H CYS A 109 10.911 2.001 6.505 1.00 0.00 H new ATOM 0 HA CYS A 109 13.491 1.313 7.741 1.00 0.00 H new ATOM 0 HB2 CYS A 109 12.542 -0.793 8.585 1.00 0.00 H new ATOM 0 HB3 CYS A 109 11.880 0.615 9.391 1.00 0.00 H new ATOM 0 HG CYS A 109 9.774 -1.193 9.061 1.00 0.00 H new ATOM 1701 N SER A 110 13.814 -0.530 6.015 1.00 0.00 N ATOM 1702 CA SER A 110 14.184 -1.269 4.818 1.00 0.00 C ATOM 1703 C SER A 110 13.169 -2.378 4.547 1.00 0.00 C ATOM 1704 O SER A 110 12.444 -2.791 5.452 1.00 0.00 O ATOM 1705 CB SER A 110 15.583 -1.857 5.015 1.00 0.00 C ATOM 1706 OG SER A 110 16.456 -0.897 5.588 1.00 0.00 O ATOM 0 H SER A 110 14.465 -0.645 6.792 1.00 0.00 H new ATOM 0 HA SER A 110 14.189 -0.600 3.958 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.526 -2.734 5.659 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.981 -2.191 4.057 1.00 0.00 H new ATOM 0 HG SER A 110 17.344 -1.293 5.707 1.00 0.00 H new ATOM 1712 N PRO A 111 13.088 -2.853 3.294 1.00 0.00 N ATOM 1713 CA PRO A 111 12.148 -3.901 2.894 1.00 0.00 C ATOM 1714 C PRO A 111 12.114 -5.086 3.862 1.00 0.00 C ATOM 1715 O PRO A 111 11.057 -5.443 4.379 1.00 0.00 O ATOM 1716 CB PRO A 111 12.671 -4.355 1.535 1.00 0.00 C ATOM 1717 CG PRO A 111 13.444 -3.204 0.992 1.00 0.00 C ATOM 1718 CD PRO A 111 13.905 -2.380 2.162 1.00 0.00 C ATOM 0 HA PRO A 111 11.126 -3.523 2.878 1.00 0.00 H new ATOM 0 HB2 PRO A 111 13.302 -5.238 1.634 1.00 0.00 H new ATOM 0 HB3 PRO A 111 11.850 -4.623 0.870 1.00 0.00 H new ATOM 0 HG2 PRO A 111 14.296 -3.554 0.410 1.00 0.00 H new ATOM 0 HG3 PRO A 111 12.824 -2.607 0.323 1.00 0.00 H new ATOM 0 HD2 PRO A 111 14.968 -2.523 2.353 1.00 0.00 H new ATOM 0 HD3 PRO A 111 13.754 -1.316 1.981 1.00 0.00 H new ATOM 1726 N GLU A 112 13.272 -5.671 4.132 1.00 0.00 N ATOM 1727 CA GLU A 112 13.339 -6.848 4.995 1.00 0.00 C ATOM 1728 C GLU A 112 13.041 -6.475 6.447 1.00 0.00 C ATOM 1729 O GLU A 112 12.524 -7.289 7.212 1.00 0.00 O ATOM 1730 CB GLU A 112 14.697 -7.565 4.884 1.00 0.00 C ATOM 1731 CG GLU A 112 15.916 -6.659 4.988 1.00 0.00 C ATOM 1732 CD GLU A 112 16.167 -5.864 3.724 1.00 0.00 C ATOM 1733 OE1 GLU A 112 16.641 -6.452 2.730 1.00 0.00 O ATOM 1734 OE2 GLU A 112 15.882 -4.653 3.718 1.00 0.00 O ATOM 0 H GLU A 112 14.172 -5.356 3.771 1.00 0.00 H new ATOM 0 HA GLU A 112 12.574 -7.545 4.652 1.00 0.00 H new ATOM 0 HB2 GLU A 112 14.757 -8.320 5.668 1.00 0.00 H new ATOM 0 HB3 GLU A 112 14.735 -8.092 3.930 1.00 0.00 H new ATOM 0 HG2 GLU A 112 15.782 -5.972 5.823 1.00 0.00 H new ATOM 0 HG3 GLU A 112 16.795 -7.264 5.211 1.00 0.00 H new ATOM 1741 N GLU A 113 13.351 -5.236 6.808 1.00 0.00 N ATOM 1742 CA GLU A 113 13.033 -4.717 8.133 1.00 0.00 C ATOM 1743 C GLU A 113 11.520 -4.602 8.310 1.00 0.00 C ATOM 1744 O GLU A 113 10.979 -4.953 9.357 1.00 0.00 O ATOM 1745 CB GLU A 113 13.670 -3.340 8.334 1.00 0.00 C ATOM 1746 CG GLU A 113 15.188 -3.334 8.269 1.00 0.00 C ATOM 1747 CD GLU A 113 15.825 -4.052 9.438 1.00 0.00 C ATOM 1748 OE1 GLU A 113 15.547 -3.675 10.594 1.00 0.00 O ATOM 1749 OE2 GLU A 113 16.625 -4.980 9.207 1.00 0.00 O ATOM 0 H GLU A 113 13.825 -4.569 6.199 1.00 0.00 H new ATOM 0 HA GLU A 113 13.432 -5.410 8.874 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.283 -2.660 7.575 1.00 0.00 H new ATOM 0 HB3 GLU A 113 13.359 -2.947 9.302 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.510 -3.805 7.340 1.00 0.00 H new ATOM 0 HG3 GLU A 113 15.542 -2.304 8.244 1.00 0.00 H new ATOM 1756 N ALA A 114 10.851 -4.121 7.264 1.00 0.00 N ATOM 1757 CA ALA A 114 9.408 -3.889 7.284 1.00 0.00 C ATOM 1758 C ALA A 114 8.629 -5.166 7.554 1.00 0.00 C ATOM 1759 O ALA A 114 7.606 -5.144 8.232 1.00 0.00 O ATOM 1760 CB ALA A 114 8.957 -3.268 5.967 1.00 0.00 C ATOM 0 H ALA A 114 11.295 -3.881 6.378 1.00 0.00 H new ATOM 0 HA ALA A 114 9.199 -3.199 8.101 1.00 0.00 H new ATOM 0 HB1 ALA A 114 7.880 -3.100 5.994 1.00 0.00 H new ATOM 0 HB2 ALA A 114 9.469 -2.317 5.819 1.00 0.00 H new ATOM 0 HB3 ALA A 114 9.199 -3.942 5.145 1.00 0.00 H new ATOM 1766 N LEU A 115 9.120 -6.283 7.042 1.00 0.00 N ATOM 1767 CA LEU A 115 8.429 -7.552 7.209 1.00 0.00 C ATOM 1768 C LEU A 115 8.636 -8.104 8.619 1.00 0.00 C ATOM 1769 O LEU A 115 7.996 -9.077 9.017 1.00 0.00 O ATOM 1770 CB LEU A 115 8.899 -8.550 6.144 1.00 0.00 C ATOM 1771 CG LEU A 115 7.784 -9.280 5.377 1.00 0.00 C ATOM 1772 CD1 LEU A 115 7.241 -10.450 6.175 1.00 0.00 C ATOM 1773 CD2 LEU A 115 6.651 -8.323 5.026 1.00 0.00 C ATOM 0 H LEU A 115 9.989 -6.338 6.510 1.00 0.00 H new ATOM 0 HA LEU A 115 7.359 -7.389 7.077 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.522 -8.019 5.424 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.532 -9.296 6.625 1.00 0.00 H new ATOM 0 HG LEU A 115 8.221 -9.664 4.455 1.00 0.00 H new ATOM 0 HD11 LEU A 115 6.454 -10.945 5.605 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.045 -11.158 6.375 1.00 0.00 H new ATOM 0 HD13 LEU A 115 6.833 -10.088 7.119 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.874 -8.862 4.484 1.00 0.00 H new ATOM 0 HD22 LEU A 115 6.231 -7.905 5.941 1.00 0.00 H new ATOM 0 HD23 LEU A 115 7.036 -7.517 4.402 1.00 0.00 H new ATOM 1785 N GLN A 116 9.530 -7.476 9.376 1.00 0.00 N ATOM 1786 CA GLN A 116 9.705 -7.805 10.783 1.00 0.00 C ATOM 1787 C GLN A 116 8.756 -6.976 11.642 1.00 0.00 C ATOM 1788 O GLN A 116 8.670 -7.165 12.855 1.00 0.00 O ATOM 1789 CB GLN A 116 11.149 -7.565 11.223 1.00 0.00 C ATOM 1790 CG GLN A 116 12.154 -8.486 10.553 1.00 0.00 C ATOM 1791 CD GLN A 116 13.572 -8.227 11.018 1.00 0.00 C ATOM 1792 OE1 GLN A 116 14.301 -7.439 10.422 1.00 0.00 O ATOM 1793 NE2 GLN A 116 13.973 -8.890 12.091 1.00 0.00 N ATOM 0 H GLN A 116 10.144 -6.736 9.037 1.00 0.00 H new ATOM 0 HA GLN A 116 9.474 -8.862 10.915 1.00 0.00 H new ATOM 0 HB2 GLN A 116 11.418 -6.531 11.008 1.00 0.00 H new ATOM 0 HB3 GLN A 116 11.216 -7.693 12.303 1.00 0.00 H new ATOM 0 HG2 GLN A 116 11.889 -9.522 10.762 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.099 -8.355 9.472 1.00 0.00 H new ATOM 0 HE21 GLN A 116 13.337 -9.536 12.558 1.00 0.00 H new ATOM 0 HE22 GLN A 116 14.918 -8.755 12.451 1.00 0.00 H new ATOM 1802 N TYR A 117 8.045 -6.058 11.000 1.00 0.00 N ATOM 1803 CA TYR A 117 7.052 -5.240 11.677 1.00 0.00 C ATOM 1804 C TYR A 117 5.697 -5.935 11.630 1.00 0.00 C ATOM 1805 O TYR A 117 5.481 -6.827 10.806 1.00 0.00 O ATOM 1806 CB TYR A 117 6.948 -3.855 11.026 1.00 0.00 C ATOM 1807 CG TYR A 117 7.997 -2.868 11.490 1.00 0.00 C ATOM 1808 CD1 TYR A 117 9.288 -2.896 10.983 1.00 0.00 C ATOM 1809 CD2 TYR A 117 7.686 -1.899 12.432 1.00 0.00 C ATOM 1810 CE1 TYR A 117 10.240 -1.985 11.404 1.00 0.00 C ATOM 1811 CE2 TYR A 117 8.629 -0.986 12.858 1.00 0.00 C ATOM 1812 CZ TYR A 117 9.905 -1.033 12.342 1.00 0.00 C ATOM 1813 OH TYR A 117 10.848 -0.122 12.766 1.00 0.00 O ATOM 0 H TYR A 117 8.140 -5.862 10.004 1.00 0.00 H new ATOM 0 HA TYR A 117 7.361 -5.109 12.714 1.00 0.00 H new ATOM 0 HB2 TYR A 117 7.026 -3.968 9.945 1.00 0.00 H new ATOM 0 HB3 TYR A 117 5.961 -3.442 11.233 1.00 0.00 H new ATOM 0 HD1 TYR A 117 9.554 -3.641 10.248 1.00 0.00 H new ATOM 0 HD2 TYR A 117 6.687 -1.858 12.840 1.00 0.00 H new ATOM 0 HE1 TYR A 117 11.241 -2.020 10.999 1.00 0.00 H new ATOM 0 HE2 TYR A 117 8.368 -0.238 13.592 1.00 0.00 H new ATOM 0 HH TYR A 117 10.447 0.480 13.428 1.00 0.00 H new ATOM 1823 N PRO A 118 4.776 -5.570 12.527 1.00 0.00 N ATOM 1824 CA PRO A 118 3.422 -6.106 12.503 1.00 0.00 C ATOM 1825 C PRO A 118 2.601 -5.512 11.361 1.00 0.00 C ATOM 1826 O PRO A 118 1.820 -4.583 11.557 1.00 0.00 O ATOM 1827 CB PRO A 118 2.852 -5.710 13.866 1.00 0.00 C ATOM 1828 CG PRO A 118 3.624 -4.500 14.273 1.00 0.00 C ATOM 1829 CD PRO A 118 4.987 -4.623 13.640 1.00 0.00 C ATOM 0 HA PRO A 118 3.402 -7.183 12.334 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.786 -5.494 13.800 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.969 -6.515 14.591 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.123 -3.591 13.940 1.00 0.00 H new ATOM 0 HG3 PRO A 118 3.705 -4.440 15.358 1.00 0.00 H new ATOM 0 HD2 PRO A 118 5.350 -3.660 13.282 1.00 0.00 H new ATOM 0 HD3 PRO A 118 5.725 -4.998 14.349 1.00 0.00 H new ATOM 1837 N LEU A 119 2.824 -6.029 10.161 1.00 0.00 N ATOM 1838 CA LEU A 119 2.098 -5.585 8.979 1.00 0.00 C ATOM 1839 C LEU A 119 0.776 -6.338 8.858 1.00 0.00 C ATOM 1840 O LEU A 119 0.647 -7.459 9.355 1.00 0.00 O ATOM 1841 CB LEU A 119 2.939 -5.802 7.713 1.00 0.00 C ATOM 1842 CG LEU A 119 4.185 -4.917 7.577 1.00 0.00 C ATOM 1843 CD1 LEU A 119 4.926 -5.241 6.288 1.00 0.00 C ATOM 1844 CD2 LEU A 119 3.801 -3.444 7.614 1.00 0.00 C ATOM 0 H LEU A 119 3.508 -6.763 9.979 1.00 0.00 H new ATOM 0 HA LEU A 119 1.894 -4.519 9.084 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.253 -6.845 7.683 1.00 0.00 H new ATOM 0 HB3 LEU A 119 2.302 -5.636 6.844 1.00 0.00 H new ATOM 0 HG LEU A 119 4.847 -5.121 8.419 1.00 0.00 H new ATOM 0 HD11 LEU A 119 5.808 -4.605 6.205 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.233 -6.287 6.298 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.269 -5.063 5.436 1.00 0.00 H new ATOM 0 HD21 LEU A 119 4.697 -2.832 7.516 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.120 -3.225 6.791 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.310 -3.220 8.561 1.00 0.00 H new ATOM 1856 N ALA A 120 -0.202 -5.712 8.212 1.00 0.00 N ATOM 1857 CA ALA A 120 -1.494 -6.344 7.972 1.00 0.00 C ATOM 1858 C ALA A 120 -1.333 -7.597 7.102 1.00 0.00 C ATOM 1859 O ALA A 120 -0.373 -7.712 6.337 1.00 0.00 O ATOM 1860 CB ALA A 120 -2.447 -5.349 7.324 1.00 0.00 C ATOM 0 H ALA A 120 -0.124 -4.764 7.844 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.915 -6.656 8.928 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.410 -5.829 7.148 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.584 -4.493 7.985 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.031 -5.012 6.375 1.00 0.00 H new ATOM 1866 N PRO A 121 -2.277 -8.554 7.206 1.00 0.00 N ATOM 1867 CA PRO A 121 -2.186 -9.860 6.528 1.00 0.00 C ATOM 1868 C PRO A 121 -2.007 -9.773 5.009 1.00 0.00 C ATOM 1869 O PRO A 121 -1.516 -10.711 4.385 1.00 0.00 O ATOM 1870 CB PRO A 121 -3.520 -10.540 6.856 1.00 0.00 C ATOM 1871 CG PRO A 121 -4.408 -9.458 7.374 1.00 0.00 C ATOM 1872 CD PRO A 121 -3.500 -8.453 8.016 1.00 0.00 C ATOM 0 HA PRO A 121 -1.304 -10.400 6.872 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -3.949 -11.008 5.970 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -3.386 -11.326 7.599 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -4.983 -9.005 6.567 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -5.125 -9.852 8.094 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.923 -7.449 7.986 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.312 -8.689 9.063 1.00 0.00 H new ATOM 1880 N ALA A 122 -2.403 -8.657 4.412 1.00 0.00 N ATOM 1881 CA ALA A 122 -2.287 -8.499 2.968 1.00 0.00 C ATOM 1882 C ALA A 122 -1.035 -7.713 2.613 1.00 0.00 C ATOM 1883 O ALA A 122 -0.564 -7.757 1.478 1.00 0.00 O ATOM 1884 CB ALA A 122 -3.516 -7.813 2.400 1.00 0.00 C ATOM 0 H ALA A 122 -2.803 -7.855 4.899 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.211 -9.492 2.526 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.407 -7.706 1.321 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.400 -8.412 2.618 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.625 -6.828 2.853 1.00 0.00 H new ATOM 1890 N ASP A 123 -0.497 -7.023 3.599 1.00 0.00 N ATOM 1891 CA ASP A 123 0.658 -6.161 3.401 1.00 0.00 C ATOM 1892 C ASP A 123 1.935 -6.980 3.402 1.00 0.00 C ATOM 1893 O ASP A 123 2.930 -6.606 2.780 1.00 0.00 O ATOM 1894 CB ASP A 123 0.711 -5.102 4.500 1.00 0.00 C ATOM 1895 CG ASP A 123 -0.448 -4.124 4.415 1.00 0.00 C ATOM 1896 OD1 ASP A 123 -1.619 -4.580 4.433 1.00 0.00 O ATOM 1897 OD2 ASP A 123 -0.192 -2.906 4.322 1.00 0.00 O ATOM 0 H ASP A 123 -0.844 -7.042 4.558 1.00 0.00 H new ATOM 0 HA ASP A 123 0.565 -5.666 2.435 1.00 0.00 H new ATOM 0 HB2 ASP A 123 0.700 -5.591 5.474 1.00 0.00 H new ATOM 0 HB3 ASP A 123 1.651 -4.555 4.429 1.00 0.00 H new ATOM 1902 N ILE A 124 1.889 -8.117 4.086 1.00 0.00 N ATOM 1903 CA ILE A 124 3.030 -9.018 4.145 1.00 0.00 C ATOM 1904 C ILE A 124 3.365 -9.553 2.744 1.00 0.00 C ATOM 1905 O ILE A 124 4.465 -9.322 2.248 1.00 0.00 O ATOM 1906 CB ILE A 124 2.783 -10.191 5.129 1.00 0.00 C ATOM 1907 CG1 ILE A 124 2.535 -9.650 6.540 1.00 0.00 C ATOM 1908 CG2 ILE A 124 3.962 -11.155 5.120 1.00 0.00 C ATOM 1909 CD1 ILE A 124 2.162 -10.715 7.552 1.00 0.00 C ATOM 0 H ILE A 124 1.072 -8.436 4.607 1.00 0.00 H new ATOM 0 HA ILE A 124 3.881 -8.449 4.518 1.00 0.00 H new ATOM 0 HB ILE A 124 1.897 -10.738 4.806 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.432 -9.135 6.884 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.738 -8.908 6.499 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.770 -11.971 5.817 1.00 0.00 H new ATOM 0 HG22 ILE A 124 4.095 -11.558 4.116 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.867 -10.626 5.421 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.003 -10.252 8.526 1.00 0.00 H new ATOM 0 HD12 ILE A 124 1.247 -11.215 7.234 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.968 -11.446 7.625 1.00 0.00 H new ATOM 1921 N PRO A 125 2.417 -10.254 2.075 1.00 0.00 N ATOM 1922 CA PRO A 125 2.611 -10.763 0.708 1.00 0.00 C ATOM 1923 C PRO A 125 3.038 -9.677 -0.280 1.00 0.00 C ATOM 1924 O PRO A 125 3.788 -9.948 -1.222 1.00 0.00 O ATOM 1925 CB PRO A 125 1.234 -11.324 0.317 1.00 0.00 C ATOM 1926 CG PRO A 125 0.294 -10.846 1.367 1.00 0.00 C ATOM 1927 CD PRO A 125 1.107 -10.646 2.603 1.00 0.00 C ATOM 0 HA PRO A 125 3.411 -11.502 0.678 1.00 0.00 H new ATOM 0 HB2 PRO A 125 0.933 -10.971 -0.669 1.00 0.00 H new ATOM 0 HB3 PRO A 125 1.252 -12.413 0.274 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -0.186 -9.916 1.064 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -0.500 -11.573 1.538 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.683 -9.874 3.245 1.00 0.00 H new ATOM 0 HD3 PRO A 125 1.168 -11.557 3.198 1.00 0.00 H new ATOM 1935 N LEU A 126 2.572 -8.452 -0.059 1.00 0.00 N ATOM 1936 CA LEU A 126 2.925 -7.333 -0.927 1.00 0.00 C ATOM 1937 C LEU A 126 4.395 -6.986 -0.765 1.00 0.00 C ATOM 1938 O LEU A 126 5.100 -6.739 -1.743 1.00 0.00 O ATOM 1939 CB LEU A 126 2.067 -6.102 -0.613 1.00 0.00 C ATOM 1940 CG LEU A 126 0.588 -6.221 -0.981 1.00 0.00 C ATOM 1941 CD1 LEU A 126 -0.165 -4.966 -0.565 1.00 0.00 C ATOM 1942 CD2 LEU A 126 0.428 -6.470 -2.471 1.00 0.00 C ATOM 0 H LEU A 126 1.950 -8.209 0.712 1.00 0.00 H new ATOM 0 HA LEU A 126 2.736 -7.634 -1.957 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.142 -5.890 0.454 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.487 -5.244 -1.139 1.00 0.00 H new ATOM 0 HG LEU A 126 0.166 -7.071 -0.444 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -1.216 -5.067 -0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.078 -4.830 0.513 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.259 -4.101 -1.076 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.631 -6.552 -2.715 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.865 -5.641 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.935 -7.396 -2.742 1.00 0.00 H new ATOM 1954 N LEU A 127 4.857 -6.993 0.475 1.00 0.00 N ATOM 1955 CA LEU A 127 6.235 -6.660 0.766 1.00 0.00 C ATOM 1956 C LEU A 127 7.143 -7.805 0.335 1.00 0.00 C ATOM 1957 O LEU A 127 8.249 -7.572 -0.159 1.00 0.00 O ATOM 1958 CB LEU A 127 6.401 -6.348 2.258 1.00 0.00 C ATOM 1959 CG LEU A 127 7.735 -5.706 2.670 1.00 0.00 C ATOM 1960 CD1 LEU A 127 8.863 -6.727 2.710 1.00 0.00 C ATOM 1961 CD2 LEU A 127 8.083 -4.568 1.726 1.00 0.00 C ATOM 0 H LEU A 127 4.295 -7.226 1.294 1.00 0.00 H new ATOM 0 HA LEU A 127 6.519 -5.769 0.206 1.00 0.00 H new ATOM 0 HB2 LEU A 127 5.592 -5.683 2.562 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.279 -7.275 2.818 1.00 0.00 H new ATOM 0 HG LEU A 127 7.616 -5.310 3.678 1.00 0.00 H new ATOM 0 HD11 LEU A 127 9.789 -6.234 3.005 1.00 0.00 H new ATOM 0 HD12 LEU A 127 8.621 -7.508 3.431 1.00 0.00 H new ATOM 0 HD13 LEU A 127 8.987 -7.171 1.722 1.00 0.00 H new ATOM 0 HD21 LEU A 127 9.030 -4.121 2.028 1.00 0.00 H new ATOM 0 HD22 LEU A 127 8.171 -4.952 0.710 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.298 -3.813 1.762 1.00 0.00 H new ATOM 1973 N GLU A 128 6.668 -9.038 0.501 1.00 0.00 N ATOM 1974 CA GLU A 128 7.422 -10.209 0.073 1.00 0.00 C ATOM 1975 C GLU A 128 7.808 -10.091 -1.394 1.00 0.00 C ATOM 1976 O GLU A 128 8.933 -10.407 -1.775 1.00 0.00 O ATOM 1977 CB GLU A 128 6.617 -11.493 0.284 1.00 0.00 C ATOM 1978 CG GLU A 128 6.230 -11.751 1.729 1.00 0.00 C ATOM 1979 CD GLU A 128 5.741 -13.167 1.947 1.00 0.00 C ATOM 1980 OE1 GLU A 128 4.528 -13.423 1.779 1.00 0.00 O ATOM 1981 OE2 GLU A 128 6.573 -14.039 2.271 1.00 0.00 O ATOM 0 H GLU A 128 5.766 -9.249 0.928 1.00 0.00 H new ATOM 0 HA GLU A 128 8.325 -10.257 0.682 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.711 -11.445 -0.320 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.200 -12.339 -0.082 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.089 -11.562 2.373 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.450 -11.050 2.025 1.00 0.00 H new ATOM 1988 N ALA A 129 6.875 -9.626 -2.218 1.00 0.00 N ATOM 1989 CA ALA A 129 7.147 -9.466 -3.636 1.00 0.00 C ATOM 1990 C ALA A 129 7.885 -8.173 -3.925 1.00 0.00 C ATOM 1991 O ALA A 129 8.527 -8.045 -4.961 1.00 0.00 O ATOM 1992 CB ALA A 129 5.881 -9.521 -4.459 1.00 0.00 C ATOM 0 H ALA A 129 5.934 -9.357 -1.930 1.00 0.00 H new ATOM 0 HA ALA A 129 7.785 -10.302 -3.921 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.127 -9.397 -5.514 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.392 -10.484 -4.311 1.00 0.00 H new ATOM 0 HB3 ALA A 129 5.209 -8.721 -4.147 1.00 0.00 H new ATOM 1998 N PHE A 130 7.805 -7.209 -3.017 1.00 0.00 N ATOM 1999 CA PHE A 130 8.508 -5.953 -3.207 1.00 0.00 C ATOM 2000 C PHE A 130 9.998 -6.182 -3.029 1.00 0.00 C ATOM 2001 O PHE A 130 10.815 -5.725 -3.830 1.00 0.00 O ATOM 2002 CB PHE A 130 8.010 -4.890 -2.224 1.00 0.00 C ATOM 2003 CG PHE A 130 8.663 -3.550 -2.414 1.00 0.00 C ATOM 2004 CD1 PHE A 130 8.242 -2.699 -3.420 1.00 0.00 C ATOM 2005 CD2 PHE A 130 9.701 -3.145 -1.590 1.00 0.00 C ATOM 2006 CE1 PHE A 130 8.840 -1.468 -3.601 1.00 0.00 C ATOM 2007 CE2 PHE A 130 10.303 -1.915 -1.765 1.00 0.00 C ATOM 2008 CZ PHE A 130 9.873 -1.076 -2.773 1.00 0.00 C ATOM 0 H PHE A 130 7.267 -7.273 -2.153 1.00 0.00 H new ATOM 0 HA PHE A 130 8.313 -5.589 -4.216 1.00 0.00 H new ATOM 0 HB2 PHE A 130 6.931 -4.779 -2.335 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.192 -5.234 -1.206 1.00 0.00 H new ATOM 0 HD1 PHE A 130 7.436 -3.001 -4.072 1.00 0.00 H new ATOM 0 HD2 PHE A 130 10.043 -3.799 -0.802 1.00 0.00 H new ATOM 0 HE1 PHE A 130 8.500 -0.812 -4.389 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.109 -1.610 -1.114 1.00 0.00 H new ATOM 0 HZ PHE A 130 10.344 -0.114 -2.914 1.00 0.00 H new ATOM 2018 N MET A 131 10.347 -6.911 -1.981 1.00 0.00 N ATOM 2019 CA MET A 131 11.732 -7.278 -1.752 1.00 0.00 C ATOM 2020 C MET A 131 12.181 -8.280 -2.811 1.00 0.00 C ATOM 2021 O MET A 131 13.347 -8.286 -3.205 1.00 0.00 O ATOM 2022 CB MET A 131 11.936 -7.831 -0.332 1.00 0.00 C ATOM 2023 CG MET A 131 11.257 -9.167 -0.069 1.00 0.00 C ATOM 2024 SD MET A 131 11.589 -9.800 1.587 1.00 0.00 S ATOM 2025 CE MET A 131 10.685 -11.347 1.551 1.00 0.00 C ATOM 0 H MET A 131 9.693 -7.258 -1.280 1.00 0.00 H new ATOM 0 HA MET A 131 12.350 -6.384 -1.836 1.00 0.00 H new ATOM 0 HB2 MET A 131 13.005 -7.939 -0.149 1.00 0.00 H new ATOM 0 HB3 MET A 131 11.562 -7.101 0.385 1.00 0.00 H new ATOM 0 HG2 MET A 131 10.181 -9.056 -0.202 1.00 0.00 H new ATOM 0 HG3 MET A 131 11.596 -9.894 -0.807 1.00 0.00 H new ATOM 0 HE1 MET A 131 9.856 -11.301 2.257 1.00 0.00 H new ATOM 0 HE2 MET A 131 10.297 -11.518 0.547 1.00 0.00 H new ATOM 0 HE3 MET A 131 11.351 -12.164 1.827 1.00 0.00 H new ATOM 2035 N ALA A 132 11.254 -9.115 -3.287 1.00 0.00 N ATOM 2036 CA ALA A 132 11.526 -10.003 -4.409 1.00 0.00 C ATOM 2037 C ALA A 132 11.828 -9.211 -5.677 1.00 0.00 C ATOM 2038 O ALA A 132 12.756 -9.534 -6.419 1.00 0.00 O ATOM 2039 CB ALA A 132 10.333 -10.926 -4.643 1.00 0.00 C ATOM 0 H ALA A 132 10.309 -9.191 -2.910 1.00 0.00 H new ATOM 0 HA ALA A 132 12.404 -10.601 -4.165 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.544 -11.587 -5.484 1.00 0.00 H new ATOM 0 HB2 ALA A 132 10.153 -11.522 -3.748 1.00 0.00 H new ATOM 0 HB3 ALA A 132 9.449 -10.329 -4.864 1.00 0.00 H new ATOM 2045 N LEU A 133 11.056 -8.156 -5.905 1.00 0.00 N ATOM 2046 CA LEU A 133 11.183 -7.363 -7.118 1.00 0.00 C ATOM 2047 C LEU A 133 12.499 -6.601 -7.134 1.00 0.00 C ATOM 2048 O LEU A 133 13.097 -6.412 -8.185 1.00 0.00 O ATOM 2049 CB LEU A 133 10.011 -6.386 -7.250 1.00 0.00 C ATOM 2050 CG LEU A 133 9.152 -6.571 -8.502 1.00 0.00 C ATOM 2051 CD1 LEU A 133 8.505 -7.948 -8.508 1.00 0.00 C ATOM 2052 CD2 LEU A 133 8.096 -5.480 -8.586 1.00 0.00 C ATOM 0 H LEU A 133 10.334 -7.830 -5.263 1.00 0.00 H new ATOM 0 HA LEU A 133 11.168 -8.047 -7.967 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.373 -6.487 -6.372 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.403 -5.369 -7.244 1.00 0.00 H new ATOM 0 HG LEU A 133 9.796 -6.494 -9.378 1.00 0.00 H new ATOM 0 HD11 LEU A 133 7.898 -8.061 -9.406 1.00 0.00 H new ATOM 0 HD12 LEU A 133 9.280 -8.714 -8.495 1.00 0.00 H new ATOM 0 HD13 LEU A 133 7.873 -8.057 -7.627 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.493 -5.626 -9.482 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.455 -5.526 -7.706 1.00 0.00 H new ATOM 0 HD23 LEU A 133 8.582 -4.506 -8.630 1.00 0.00 H new ATOM 2064 N ARG A 134 12.951 -6.173 -5.966 1.00 0.00 N ATOM 2065 CA ARG A 134 14.208 -5.446 -5.868 1.00 0.00 C ATOM 2066 C ARG A 134 15.396 -6.402 -5.861 1.00 0.00 C ATOM 2067 O ARG A 134 16.531 -5.993 -6.100 1.00 0.00 O ATOM 2068 CB ARG A 134 14.221 -4.567 -4.618 1.00 0.00 C ATOM 2069 CG ARG A 134 13.178 -3.466 -4.657 1.00 0.00 C ATOM 2070 CD ARG A 134 13.183 -2.631 -3.389 1.00 0.00 C ATOM 2071 NE ARG A 134 14.456 -1.942 -3.172 1.00 0.00 N ATOM 2072 CZ ARG A 134 14.731 -0.724 -3.642 1.00 0.00 C ATOM 2073 NH1 ARG A 134 13.873 -0.110 -4.444 1.00 0.00 N ATOM 2074 NH2 ARG A 134 15.869 -0.121 -3.322 1.00 0.00 N ATOM 0 H ARG A 134 12.470 -6.315 -5.078 1.00 0.00 H new ATOM 0 HA ARG A 134 14.296 -4.805 -6.746 1.00 0.00 H new ATOM 0 HB2 ARG A 134 14.051 -5.190 -3.740 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.209 -4.120 -4.505 1.00 0.00 H new ATOM 0 HG2 ARG A 134 13.364 -2.821 -5.516 1.00 0.00 H new ATOM 0 HG3 ARG A 134 12.191 -3.907 -4.797 1.00 0.00 H new ATOM 0 HD2 ARG A 134 12.380 -1.895 -3.440 1.00 0.00 H new ATOM 0 HD3 ARG A 134 12.972 -3.274 -2.534 1.00 0.00 H new ATOM 0 HE ARG A 134 15.175 -2.421 -2.630 1.00 0.00 H new ATOM 0 HH11 ARG A 134 13.000 -0.569 -4.703 1.00 0.00 H new ATOM 0 HH12 ARG A 134 14.086 0.821 -4.802 1.00 0.00 H new ATOM 0 HH21 ARG A 134 16.540 -0.589 -2.713 1.00 0.00 H new ATOM 0 HH22 ARG A 134 16.072 0.810 -3.685 1.00 0.00 H new ATOM 2088 N ALA A 135 15.127 -7.675 -5.595 1.00 0.00 N ATOM 2089 CA ALA A 135 16.172 -8.691 -5.597 1.00 0.00 C ATOM 2090 C ALA A 135 16.361 -9.279 -6.993 1.00 0.00 C ATOM 2091 O ALA A 135 17.476 -9.606 -7.391 1.00 0.00 O ATOM 2092 CB ALA A 135 15.845 -9.793 -4.600 1.00 0.00 C ATOM 0 H ALA A 135 14.195 -8.028 -5.376 1.00 0.00 H new ATOM 0 HA ALA A 135 17.106 -8.214 -5.299 1.00 0.00 H new ATOM 0 HB1 ALA A 135 16.636 -10.543 -4.615 1.00 0.00 H new ATOM 0 HB2 ALA A 135 15.767 -9.367 -3.600 1.00 0.00 H new ATOM 0 HB3 ALA A 135 14.898 -10.259 -4.871 1.00 0.00 H new ATOM 2098 N ALA A 136 15.270 -9.407 -7.734 1.00 0.00 N ATOM 2099 CA ALA A 136 15.332 -9.952 -9.086 1.00 0.00 C ATOM 2100 C ALA A 136 15.505 -8.831 -10.104 1.00 0.00 C ATOM 2101 O ALA A 136 16.163 -9.009 -11.129 1.00 0.00 O ATOM 2102 CB ALA A 136 14.080 -10.762 -9.390 1.00 0.00 C ATOM 0 H ALA A 136 14.334 -9.143 -7.426 1.00 0.00 H new ATOM 0 HA ALA A 136 16.195 -10.614 -9.154 1.00 0.00 H new ATOM 0 HB1 ALA A 136 14.142 -11.162 -10.402 1.00 0.00 H new ATOM 0 HB2 ALA A 136 13.997 -11.585 -8.680 1.00 0.00 H new ATOM 0 HB3 ALA A 136 13.203 -10.121 -9.306 1.00 0.00 H new ATOM 2108 N ARG A 137 14.903 -7.686 -9.779 1.00 0.00 N ATOM 2109 CA ARG A 137 14.935 -6.463 -10.590 1.00 0.00 C ATOM 2110 C ARG A 137 14.189 -6.629 -11.918 1.00 0.00 C ATOM 2111 O ARG A 137 14.314 -7.642 -12.609 1.00 0.00 O ATOM 2112 CB ARG A 137 16.372 -5.957 -10.835 1.00 0.00 C ATOM 2113 CG ARG A 137 16.976 -6.380 -12.167 1.00 0.00 C ATOM 2114 CD ARG A 137 18.311 -5.703 -12.425 1.00 0.00 C ATOM 2115 NE ARG A 137 19.299 -6.019 -11.396 1.00 0.00 N ATOM 2116 CZ ARG A 137 20.522 -6.474 -11.656 1.00 0.00 C ATOM 2117 NH1 ARG A 137 20.887 -6.740 -12.905 1.00 0.00 N ATOM 2118 NH2 ARG A 137 21.375 -6.684 -10.659 1.00 0.00 N ATOM 0 H ARG A 137 14.364 -7.578 -8.920 1.00 0.00 H new ATOM 0 HA ARG A 137 14.413 -5.705 -10.006 1.00 0.00 H new ATOM 0 HB2 ARG A 137 16.374 -4.868 -10.780 1.00 0.00 H new ATOM 0 HB3 ARG A 137 17.012 -6.318 -10.030 1.00 0.00 H new ATOM 0 HG2 ARG A 137 17.110 -7.462 -12.178 1.00 0.00 H new ATOM 0 HG3 ARG A 137 16.284 -6.136 -12.973 1.00 0.00 H new ATOM 0 HD2 ARG A 137 18.691 -6.013 -13.398 1.00 0.00 H new ATOM 0 HD3 ARG A 137 18.167 -4.623 -12.468 1.00 0.00 H new ATOM 0 HE ARG A 137 19.035 -5.883 -10.420 1.00 0.00 H new ATOM 0 HH11 ARG A 137 20.229 -6.596 -13.670 1.00 0.00 H new ATOM 0 HH12 ARG A 137 21.826 -7.089 -13.099 1.00 0.00 H new ATOM 0 HH21 ARG A 137 21.092 -6.496 -9.697 1.00 0.00 H new ATOM 0 HH22 ARG A 137 22.313 -7.033 -10.855 1.00 0.00 H new ATOM 2132 N PRO A 138 13.355 -5.643 -12.268 1.00 0.00 N ATOM 2133 CA PRO A 138 12.760 -5.569 -13.597 1.00 0.00 C ATOM 2134 C PRO A 138 13.834 -5.305 -14.644 1.00 0.00 C ATOM 2135 O PRO A 138 14.656 -4.399 -14.489 1.00 0.00 O ATOM 2136 CB PRO A 138 11.787 -4.389 -13.496 1.00 0.00 C ATOM 2137 CG PRO A 138 12.306 -3.568 -12.367 1.00 0.00 C ATOM 2138 CD PRO A 138 12.911 -4.544 -11.398 1.00 0.00 C ATOM 0 HA PRO A 138 12.265 -6.493 -13.897 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.761 -3.816 -14.423 1.00 0.00 H new ATOM 0 HB3 PRO A 138 10.770 -4.730 -13.303 1.00 0.00 H new ATOM 0 HG2 PRO A 138 13.049 -2.850 -12.714 1.00 0.00 H new ATOM 0 HG3 PRO A 138 11.505 -2.996 -11.898 1.00 0.00 H new ATOM 0 HD2 PRO A 138 13.743 -4.104 -10.848 1.00 0.00 H new ATOM 0 HD3 PRO A 138 12.184 -4.882 -10.660 1.00 0.00 H new ATOM 2146 N ALA A 139 13.829 -6.094 -15.700 1.00 0.00 N ATOM 2147 CA ALA A 139 14.867 -6.020 -16.720 1.00 0.00 C ATOM 2148 C ALA A 139 14.544 -4.950 -17.758 1.00 0.00 C ATOM 2149 O ALA A 139 15.128 -4.924 -18.845 1.00 0.00 O ATOM 2150 CB ALA A 139 15.034 -7.374 -17.386 1.00 0.00 C ATOM 0 H ALA A 139 13.114 -6.800 -15.878 1.00 0.00 H new ATOM 0 HA ALA A 139 15.804 -5.742 -16.237 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.811 -7.312 -18.147 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.317 -8.115 -16.638 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.093 -7.669 -17.851 1.00 0.00 H new ATOM 2156 N ASP A 140 13.619 -4.069 -17.412 1.00 0.00 N ATOM 2157 CA ASP A 140 13.187 -3.010 -18.309 1.00 0.00 C ATOM 2158 C ASP A 140 13.310 -1.665 -17.619 1.00 0.00 C ATOM 2159 O ASP A 140 12.414 -1.322 -16.821 1.00 0.00 O ATOM 2160 CB ASP A 140 11.740 -3.233 -18.760 1.00 0.00 C ATOM 2161 CG ASP A 140 11.559 -4.541 -19.498 1.00 0.00 C ATOM 2162 OD1 ASP A 140 11.810 -4.579 -20.719 1.00 0.00 O ATOM 2163 OD2 ASP A 140 11.176 -5.543 -18.856 1.00 0.00 O ATOM 2164 OXT ASP A 140 14.308 -0.960 -17.861 1.00 0.00 O ATOM 0 H ASP A 140 13.149 -4.068 -16.507 1.00 0.00 H new ATOM 0 HA ASP A 140 13.829 -3.024 -19.190 1.00 0.00 H new ATOM 0 HB2 ASP A 140 11.085 -3.217 -17.889 1.00 0.00 H new ATOM 0 HB3 ASP A 140 11.433 -2.410 -19.405 1.00 0.00 H new TER 2169 ASP A 140