USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1096 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 108 SER OG : rot 180:sc= 0.215 USER MOD Set 1.2: A 110 THR OG1 : rot 106:sc= 0.229 USER MOD Set 2.1: A 9 ASN : amide:sc= -0.198 X(o=-0.55,f=-0.29) USER MOD Set 2.2: A 47 HIS : no HD1:sc= -0.352 X(o=-0.55,f=-1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.15) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 CYS SG : rot 150:sc= -2.07 USER MOD Single : A 14 ASN : amide:sc= -0.645 K(o=-0.64,f=-2.3!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl -117:sc= -0.536 (180deg=-1.79!) USER MOD Single : A 20 SER OG : rot -19:sc= 0.978 USER MOD Single : A 22 THR OG1 : rot -80:sc= -0.976! USER MOD Single : A 25 GLN : amide:sc= -0.258 K(o=-0.26,f=-3!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 91:sc= -0.0676 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.395 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -170:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot -90:sc= 0.126 USER MOD Single : A 53 GLN : amide:sc= -0.0104 K(o=-0.01,f=-0.67) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= -1.25 USER MOD Single : A 60 ASN : amide:sc= 1.17 K(o=1.2,f=-0.12) USER MOD Single : A 61 GLN : amide:sc= -0.308 X(o=-0.31,f=-0.53) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.387 X(o=-0.39,f=-0.059) USER MOD Single : A 70 TYR OH : rot 30:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 THR OG1 : rot -52:sc= 1.22 USER MOD Single : A 76 THR OG1 : rot -38:sc= 0.814 USER MOD Single : A 78 CYS SG : rot 50:sc= -0.935 USER MOD Single : A 83 GLN : amide:sc= -0.0265 X(o=-0.027,f=-0.38) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -150:sc= 0.97 (180deg=0.431) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 64:sc= 0.163 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc=-0.00789 X(o=-0.0079,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -2.97 K(o=-3,f=-8.9!) USER MOD Single : A 114 CYS SG : rot 22:sc= -0.82 USER MOD Single : A 115 HIS : no HD1:sc= -3.06! C(o=-3.1!,f=-5.9!) USER MOD Single : A 124 GLN : amide:sc= -0.062 K(o=-0.062,f=-1.8) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl -129:sc= 0 (180deg=-0.104) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 LYS NZ :NH3+ 164:sc= -0.952 (180deg=-1.03) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.880 -5.184 -18.004 1.00 0.00 N ATOM 2 CA GLY A 1 6.875 -6.080 -19.186 1.00 0.00 C ATOM 3 C GLY A 1 5.586 -6.910 -19.346 1.00 0.00 C ATOM 4 O GLY A 1 5.011 -6.993 -20.431 1.00 0.00 O ATOM 0 H1 GLY A 1 7.779 -4.662 -17.968 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.091 -4.510 -18.076 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.774 -5.751 -17.138 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.020 -5.479 -20.084 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.725 -6.759 -19.116 1.00 0.00 H new ATOM 9 N SER A 2 5.161 -7.493 -18.231 1.00 0.00 N ATOM 10 CA SER A 2 3.885 -8.225 -18.137 1.00 0.00 C ATOM 11 C SER A 2 3.032 -7.610 -17.017 1.00 0.00 C ATOM 12 O SER A 2 3.472 -6.661 -16.365 1.00 0.00 O ATOM 13 CB SER A 2 4.198 -9.698 -17.864 1.00 0.00 C ATOM 14 OG SER A 2 3.381 -10.496 -18.721 1.00 0.00 O ATOM 0 H SER A 2 5.688 -7.476 -17.358 1.00 0.00 H new ATOM 0 HA SER A 2 3.318 -8.153 -19.065 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.253 -9.902 -18.047 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.003 -9.940 -16.819 1.00 0.00 H new ATOM 0 HG SER A 2 3.569 -11.445 -18.562 1.00 0.00 H new ATOM 20 N HIS A 3 1.882 -8.236 -16.752 1.00 0.00 N ATOM 21 CA HIS A 3 0.906 -7.843 -15.706 1.00 0.00 C ATOM 22 C HIS A 3 0.203 -6.520 -16.082 1.00 0.00 C ATOM 23 O HIS A 3 0.849 -5.487 -16.235 1.00 0.00 O ATOM 24 CB HIS A 3 1.557 -7.707 -14.315 1.00 0.00 C ATOM 25 CG HIS A 3 2.510 -8.867 -13.954 1.00 0.00 C ATOM 26 ND1 HIS A 3 2.253 -10.157 -14.076 1.00 0.00 N ATOM 27 CD2 HIS A 3 3.806 -8.721 -13.708 1.00 0.00 C ATOM 28 CE1 HIS A 3 3.402 -10.823 -13.905 1.00 0.00 C ATOM 29 NE2 HIS A 3 4.364 -9.933 -13.704 1.00 0.00 N ATOM 0 H HIS A 3 1.585 -9.061 -17.273 1.00 0.00 H new ATOM 0 HA HIS A 3 0.169 -8.644 -15.651 1.00 0.00 H new ATOM 0 HB2 HIS A 3 2.111 -6.769 -14.274 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.772 -7.647 -13.561 1.00 0.00 H new ATOM 0 HD2 HIS A 3 4.319 -7.785 -13.540 1.00 0.00 H new ATOM 0 HE1 HIS A 3 3.524 -11.896 -13.927 1.00 0.00 H new ATOM 0 HE2 HIS A 3 5.354 -10.138 -13.570 1.00 0.00 H new ATOM 37 N MET A 4 -1.116 -6.604 -16.266 1.00 0.00 N ATOM 38 CA MET A 4 -1.983 -5.491 -16.709 1.00 0.00 C ATOM 39 C MET A 4 -3.462 -5.906 -16.623 1.00 0.00 C ATOM 40 O MET A 4 -3.796 -7.063 -16.878 1.00 0.00 O ATOM 41 CB MET A 4 -1.593 -5.088 -18.142 1.00 0.00 C ATOM 42 CG MET A 4 -2.413 -3.936 -18.726 1.00 0.00 C ATOM 43 SD MET A 4 -3.662 -4.556 -19.908 1.00 0.00 S ATOM 44 CE MET A 4 -4.836 -3.220 -19.856 1.00 0.00 C ATOM 0 H MET A 4 -1.633 -7.469 -16.109 1.00 0.00 H new ATOM 0 HA MET A 4 -1.845 -4.629 -16.056 1.00 0.00 H new ATOM 0 HB2 MET A 4 -0.540 -4.808 -18.153 1.00 0.00 H new ATOM 0 HB3 MET A 4 -1.699 -5.957 -18.791 1.00 0.00 H new ATOM 0 HG2 MET A 4 -2.907 -3.392 -17.921 1.00 0.00 H new ATOM 0 HG3 MET A 4 -1.750 -3.231 -19.228 1.00 0.00 H new ATOM 0 HE1 MET A 4 -5.667 -3.440 -20.526 1.00 0.00 H new ATOM 0 HE2 MET A 4 -5.210 -3.104 -18.839 1.00 0.00 H new ATOM 0 HE3 MET A 4 -4.350 -2.296 -20.171 1.00 0.00 H new ATOM 54 N GLY A 5 -4.277 -4.966 -16.126 1.00 0.00 N ATOM 55 CA GLY A 5 -5.743 -5.150 -16.030 1.00 0.00 C ATOM 56 C GLY A 5 -6.442 -4.038 -15.236 1.00 0.00 C ATOM 57 O GLY A 5 -7.367 -3.392 -15.724 1.00 0.00 O ATOM 0 H GLY A 5 -3.950 -4.064 -15.781 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -6.164 -5.190 -17.035 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -5.952 -6.110 -15.559 1.00 0.00 H new ATOM 61 N ALA A 6 -5.940 -3.812 -14.025 1.00 0.00 N ATOM 62 CA ALA A 6 -6.426 -2.744 -13.125 1.00 0.00 C ATOM 63 C ALA A 6 -5.435 -1.572 -13.117 1.00 0.00 C ATOM 64 O ALA A 6 -4.292 -1.751 -13.504 1.00 0.00 O ATOM 65 CB ALA A 6 -6.574 -3.298 -11.707 1.00 0.00 C ATOM 0 H ALA A 6 -5.179 -4.363 -13.628 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.393 -2.390 -13.482 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -6.932 -2.510 -11.044 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.288 -4.122 -11.711 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -5.607 -3.657 -11.354 1.00 0.00 H new ATOM 71 N ALA A 7 -5.881 -0.393 -12.692 1.00 0.00 N ATOM 72 CA ALA A 7 -5.060 0.840 -12.639 1.00 0.00 C ATOM 73 C ALA A 7 -5.878 1.973 -12.015 1.00 0.00 C ATOM 74 O ALA A 7 -6.902 2.386 -12.556 1.00 0.00 O ATOM 75 CB ALA A 7 -4.561 1.295 -14.020 1.00 0.00 C ATOM 0 H ALA A 7 -6.837 -0.252 -12.367 1.00 0.00 H new ATOM 0 HA ALA A 7 -4.184 0.605 -12.035 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -3.967 2.202 -13.911 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -3.947 0.510 -14.462 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -5.415 1.496 -14.667 1.00 0.00 H new ATOM 81 N CYS A 8 -5.552 2.241 -10.758 1.00 0.00 N ATOM 82 CA CYS A 8 -6.179 3.342 -9.999 1.00 0.00 C ATOM 83 C CYS A 8 -5.123 4.400 -9.615 1.00 0.00 C ATOM 84 O CYS A 8 -4.004 4.341 -10.110 1.00 0.00 O ATOM 85 CB CYS A 8 -6.898 2.745 -8.782 1.00 0.00 C ATOM 86 SG CYS A 8 -5.751 2.099 -7.514 1.00 0.00 S ATOM 0 H CYS A 8 -4.855 1.715 -10.231 1.00 0.00 H new ATOM 0 HA CYS A 8 -6.919 3.861 -10.609 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -7.533 3.508 -8.333 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.553 1.940 -9.114 1.00 0.00 H new ATOM 0 HG CYS A 8 -6.297 2.207 -6.339 1.00 0.00 H new ATOM 92 N ASN A 9 -5.408 5.182 -8.581 1.00 0.00 N ATOM 93 CA ASN A 9 -4.586 6.309 -8.097 1.00 0.00 C ATOM 94 C ASN A 9 -4.443 6.221 -6.577 1.00 0.00 C ATOM 95 O ASN A 9 -5.421 6.112 -5.844 1.00 0.00 O ATOM 96 CB ASN A 9 -5.300 7.625 -8.407 1.00 0.00 C ATOM 97 CG ASN A 9 -5.456 7.847 -9.906 1.00 0.00 C ATOM 98 OD1 ASN A 9 -6.253 7.220 -10.598 1.00 0.00 O ATOM 99 ND2 ASN A 9 -4.617 8.691 -10.441 1.00 0.00 N ATOM 0 H ASN A 9 -6.253 5.051 -8.025 1.00 0.00 H new ATOM 0 HA ASN A 9 -3.611 6.267 -8.583 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -6.283 7.625 -7.936 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -4.739 8.453 -7.974 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.616 8.839 -11.450 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -3.962 9.203 -9.850 1.00 0.00 H new ATOM 106 N VAL A 10 -3.206 6.149 -6.120 1.00 0.00 N ATOM 107 CA VAL A 10 -2.915 6.035 -4.679 1.00 0.00 C ATOM 108 C VAL A 10 -1.724 6.946 -4.338 1.00 0.00 C ATOM 109 O VAL A 10 -0.834 7.149 -5.162 1.00 0.00 O ATOM 110 CB VAL A 10 -2.727 4.556 -4.243 1.00 0.00 C ATOM 111 CG1 VAL A 10 -3.710 3.582 -4.910 1.00 0.00 C ATOM 112 CG2 VAL A 10 -1.310 3.994 -4.372 1.00 0.00 C ATOM 0 H VAL A 10 -2.378 6.166 -6.716 1.00 0.00 H new ATOM 0 HA VAL A 10 -3.770 6.381 -4.098 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.947 4.622 -3.178 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.516 2.570 -4.555 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.732 3.866 -4.657 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.581 3.618 -5.992 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.299 2.956 -4.040 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.992 4.045 -5.413 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.629 4.580 -3.755 1.00 0.00 H new ATOM 122 N LEU A 11 -1.750 7.529 -3.151 1.00 0.00 N ATOM 123 CA LEU A 11 -0.615 8.316 -2.640 1.00 0.00 C ATOM 124 C LEU A 11 0.407 7.410 -1.958 1.00 0.00 C ATOM 125 O LEU A 11 0.113 6.765 -0.955 1.00 0.00 O ATOM 126 CB LEU A 11 -1.041 9.427 -1.675 1.00 0.00 C ATOM 127 CG LEU A 11 -1.509 10.711 -2.363 1.00 0.00 C ATOM 128 CD1 LEU A 11 -2.038 11.680 -1.307 1.00 0.00 C ATOM 129 CD2 LEU A 11 -0.358 11.402 -3.091 1.00 0.00 C ATOM 0 H LEU A 11 -2.544 7.478 -2.513 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.163 8.795 -3.509 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -1.846 9.054 -1.042 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -0.203 9.664 -1.019 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.282 10.443 -3.083 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.373 12.598 -1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.874 11.222 -0.779 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.244 11.913 -0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.723 12.311 -3.569 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.424 11.657 -2.376 1.00 0.00 H new ATOM 0 HD23 LEU A 11 0.048 10.732 -3.848 1.00 0.00 H new ATOM 141 N PHE A 12 1.557 7.326 -2.607 1.00 0.00 N ATOM 142 CA PHE A 12 2.740 6.587 -2.148 1.00 0.00 C ATOM 143 C PHE A 12 3.264 7.260 -0.883 1.00 0.00 C ATOM 144 O PHE A 12 3.473 8.475 -0.868 1.00 0.00 O ATOM 145 CB PHE A 12 3.799 6.640 -3.255 1.00 0.00 C ATOM 146 CG PHE A 12 5.175 6.131 -2.822 1.00 0.00 C ATOM 147 CD1 PHE A 12 6.064 7.014 -2.219 1.00 0.00 C ATOM 148 CD2 PHE A 12 5.537 4.803 -3.011 1.00 0.00 C ATOM 149 CE1 PHE A 12 7.306 6.574 -1.787 1.00 0.00 C ATOM 150 CE2 PHE A 12 6.791 4.376 -2.606 1.00 0.00 C ATOM 151 CZ PHE A 12 7.672 5.250 -1.977 1.00 0.00 C ATOM 0 H PHE A 12 1.706 7.786 -3.505 1.00 0.00 H new ATOM 0 HA PHE A 12 2.497 5.547 -1.930 1.00 0.00 H new ATOM 0 HB2 PHE A 12 3.454 6.048 -4.103 1.00 0.00 H new ATOM 0 HB3 PHE A 12 3.896 7.669 -3.603 1.00 0.00 H new ATOM 0 HD1 PHE A 12 5.785 8.049 -2.086 1.00 0.00 H new ATOM 0 HD2 PHE A 12 4.847 4.110 -3.469 1.00 0.00 H new ATOM 0 HE1 PHE A 12 7.986 7.260 -1.304 1.00 0.00 H new ATOM 0 HE2 PHE A 12 7.088 3.353 -2.781 1.00 0.00 H new ATOM 0 HZ PHE A 12 8.636 4.899 -1.639 1.00 0.00 H new ATOM 161 N ILE A 13 3.476 6.429 0.124 1.00 0.00 N ATOM 162 CA ILE A 13 4.048 6.927 1.381 1.00 0.00 C ATOM 163 C ILE A 13 5.528 6.512 1.458 1.00 0.00 C ATOM 164 O ILE A 13 6.393 7.257 1.008 1.00 0.00 O ATOM 165 CB ILE A 13 3.201 6.494 2.595 1.00 0.00 C ATOM 166 CG1 ILE A 13 1.700 6.827 2.495 1.00 0.00 C ATOM 167 CG2 ILE A 13 3.791 7.101 3.862 1.00 0.00 C ATOM 168 CD1 ILE A 13 1.331 8.272 2.154 1.00 0.00 C ATOM 0 H ILE A 13 3.270 5.430 0.107 1.00 0.00 H new ATOM 0 HA ILE A 13 4.020 8.016 1.404 1.00 0.00 H new ATOM 0 HB ILE A 13 3.247 5.405 2.620 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.258 6.177 1.740 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.232 6.573 3.446 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.195 6.797 4.723 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.816 6.753 3.989 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.785 8.188 3.782 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.246 8.371 2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.729 8.939 2.919 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.755 8.537 1.185 1.00 0.00 H new ATOM 180 N ASN A 14 5.783 5.379 2.107 1.00 0.00 N ATOM 181 CA ASN A 14 7.132 4.827 2.296 1.00 0.00 C ATOM 182 C ASN A 14 7.043 3.380 2.772 1.00 0.00 C ATOM 183 O ASN A 14 6.040 2.944 3.349 1.00 0.00 O ATOM 184 CB ASN A 14 7.890 5.629 3.355 1.00 0.00 C ATOM 185 CG ASN A 14 9.275 6.067 2.874 1.00 0.00 C ATOM 186 OD1 ASN A 14 9.705 5.849 1.748 1.00 0.00 O ATOM 187 ND2 ASN A 14 10.037 6.648 3.770 1.00 0.00 N ATOM 0 H ASN A 14 5.050 4.806 2.525 1.00 0.00 H new ATOM 0 HA ASN A 14 7.656 4.880 1.342 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.307 6.509 3.626 1.00 0.00 H new ATOM 0 HB3 ASN A 14 7.995 5.026 4.257 1.00 0.00 H new ATOM 0 HD21 ASN A 14 10.990 6.920 3.530 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.676 6.828 4.707 1.00 0.00 H new ATOM 194 N SER A 15 8.137 2.681 2.512 1.00 0.00 N ATOM 195 CA SER A 15 8.272 1.269 2.884 1.00 0.00 C ATOM 196 C SER A 15 9.056 1.167 4.195 1.00 0.00 C ATOM 197 O SER A 15 10.127 1.745 4.371 1.00 0.00 O ATOM 198 CB SER A 15 8.941 0.484 1.750 1.00 0.00 C ATOM 199 OG SER A 15 10.365 0.603 1.719 1.00 0.00 O ATOM 0 H SER A 15 8.955 3.067 2.041 1.00 0.00 H new ATOM 0 HA SER A 15 7.288 0.828 3.042 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.677 -0.569 1.847 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.538 0.828 0.797 1.00 0.00 H new ATOM 0 HG SER A 15 10.721 0.076 0.973 1.00 0.00 H new ATOM 205 N VAL A 16 8.402 0.540 5.159 1.00 0.00 N ATOM 206 CA VAL A 16 8.998 0.342 6.492 1.00 0.00 C ATOM 207 C VAL A 16 9.253 -1.145 6.747 1.00 0.00 C ATOM 208 O VAL A 16 8.325 -1.957 6.821 1.00 0.00 O ATOM 209 CB VAL A 16 8.218 1.033 7.631 1.00 0.00 C ATOM 210 CG1 VAL A 16 8.342 2.556 7.540 1.00 0.00 C ATOM 211 CG2 VAL A 16 6.738 0.664 7.654 1.00 0.00 C ATOM 0 H VAL A 16 7.462 0.157 5.055 1.00 0.00 H new ATOM 0 HA VAL A 16 9.963 0.848 6.492 1.00 0.00 H new ATOM 0 HB VAL A 16 8.671 0.672 8.554 1.00 0.00 H new ATOM 0 HG11 VAL A 16 7.783 3.016 8.355 1.00 0.00 H new ATOM 0 HG12 VAL A 16 9.392 2.841 7.614 1.00 0.00 H new ATOM 0 HG13 VAL A 16 7.940 2.897 6.586 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.247 1.182 8.477 1.00 0.00 H new ATOM 0 HG22 VAL A 16 6.275 0.958 6.712 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.633 -0.413 7.789 1.00 0.00 H new ATOM 221 N GLU A 17 10.524 -1.496 6.556 1.00 0.00 N ATOM 222 CA GLU A 17 10.982 -2.882 6.763 1.00 0.00 C ATOM 223 C GLU A 17 10.751 -3.307 8.211 1.00 0.00 C ATOM 224 O GLU A 17 11.114 -2.611 9.154 1.00 0.00 O ATOM 225 CB GLU A 17 12.450 -3.124 6.391 1.00 0.00 C ATOM 226 CG GLU A 17 12.616 -3.356 4.887 1.00 0.00 C ATOM 227 CD GLU A 17 13.963 -3.955 4.475 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.998 -3.497 5.002 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.923 -4.831 3.581 1.00 0.00 O ATOM 0 H GLU A 17 11.256 -0.850 6.260 1.00 0.00 H new ATOM 0 HA GLU A 17 10.385 -3.489 6.082 1.00 0.00 H new ATOM 0 HB2 GLU A 17 13.050 -2.267 6.697 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.827 -3.988 6.938 1.00 0.00 H new ATOM 0 HG2 GLU A 17 11.820 -4.018 4.546 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.484 -2.406 4.370 1.00 0.00 H new ATOM 236 N MET A 18 10.028 -4.407 8.324 1.00 0.00 N ATOM 237 CA MET A 18 9.715 -5.000 9.635 1.00 0.00 C ATOM 238 C MET A 18 10.687 -6.119 10.030 1.00 0.00 C ATOM 239 O MET A 18 10.677 -6.564 11.172 1.00 0.00 O ATOM 240 CB MET A 18 8.259 -5.470 9.649 1.00 0.00 C ATOM 241 CG MET A 18 7.350 -4.648 10.565 1.00 0.00 C ATOM 242 SD MET A 18 7.258 -2.861 10.188 1.00 0.00 S ATOM 243 CE MET A 18 8.359 -2.251 11.446 1.00 0.00 C ATOM 0 H MET A 18 9.641 -4.917 7.530 1.00 0.00 H new ATOM 0 HA MET A 18 9.843 -4.228 10.394 1.00 0.00 H new ATOM 0 HB2 MET A 18 7.865 -5.431 8.633 1.00 0.00 H new ATOM 0 HB3 MET A 18 8.227 -6.513 9.963 1.00 0.00 H new ATOM 0 HG2 MET A 18 6.344 -5.064 10.517 1.00 0.00 H new ATOM 0 HG3 MET A 18 7.695 -4.767 11.592 1.00 0.00 H new ATOM 0 HE1 MET A 18 7.808 -1.605 12.130 1.00 0.00 H new ATOM 0 HE2 MET A 18 8.780 -3.090 12.000 1.00 0.00 H new ATOM 0 HE3 MET A 18 9.165 -1.683 10.980 1.00 0.00 H new ATOM 253 N GLU A 19 11.475 -6.575 9.047 1.00 0.00 N ATOM 254 CA GLU A 19 12.504 -7.631 9.190 1.00 0.00 C ATOM 255 C GLU A 19 11.876 -8.967 9.642 1.00 0.00 C ATOM 256 O GLU A 19 12.217 -9.499 10.693 1.00 0.00 O ATOM 257 CB GLU A 19 13.641 -7.229 10.156 1.00 0.00 C ATOM 258 CG GLU A 19 14.462 -5.989 9.783 1.00 0.00 C ATOM 259 CD GLU A 19 13.803 -4.651 10.142 1.00 0.00 C ATOM 260 OE1 GLU A 19 13.202 -4.551 11.235 1.00 0.00 O ATOM 261 OE2 GLU A 19 13.904 -3.753 9.281 1.00 0.00 O ATOM 0 H GLU A 19 11.417 -6.211 8.096 1.00 0.00 H new ATOM 0 HA GLU A 19 12.944 -7.761 8.201 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.206 -7.064 11.142 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.324 -8.074 10.246 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.429 -6.047 10.282 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.655 -6.007 8.710 1.00 0.00 H new ATOM 268 N SER A 20 10.800 -9.330 8.936 1.00 0.00 N ATOM 269 CA SER A 20 9.940 -10.509 9.203 1.00 0.00 C ATOM 270 C SER A 20 9.254 -10.393 10.577 1.00 0.00 C ATOM 271 O SER A 20 9.603 -11.019 11.576 1.00 0.00 O ATOM 272 CB SER A 20 10.650 -11.869 9.029 1.00 0.00 C ATOM 273 OG SER A 20 11.632 -12.103 10.043 1.00 0.00 O ATOM 0 H SER A 20 10.484 -8.794 8.128 1.00 0.00 H new ATOM 0 HA SER A 20 9.173 -10.495 8.429 1.00 0.00 H new ATOM 0 HB2 SER A 20 9.909 -12.668 9.052 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.127 -11.905 8.049 1.00 0.00 H new ATOM 0 HG SER A 20 11.873 -11.253 10.467 1.00 0.00 H new ATOM 279 N LEU A 21 8.193 -9.594 10.594 1.00 0.00 N ATOM 280 CA LEU A 21 7.426 -9.414 11.839 1.00 0.00 C ATOM 281 C LEU A 21 6.261 -10.416 11.859 1.00 0.00 C ATOM 282 O LEU A 21 6.396 -11.544 12.322 1.00 0.00 O ATOM 283 CB LEU A 21 6.987 -7.949 12.013 1.00 0.00 C ATOM 284 CG LEU A 21 6.251 -7.676 13.334 1.00 0.00 C ATOM 285 CD1 LEU A 21 7.221 -7.596 14.515 1.00 0.00 C ATOM 286 CD2 LEU A 21 5.394 -6.415 13.223 1.00 0.00 C ATOM 0 H LEU A 21 7.845 -9.071 9.790 1.00 0.00 H new ATOM 0 HA LEU A 21 8.055 -9.628 12.704 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.866 -7.307 11.958 1.00 0.00 H new ATOM 0 HB3 LEU A 21 6.338 -7.673 11.182 1.00 0.00 H new ATOM 0 HG LEU A 21 5.586 -8.518 13.527 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.663 -7.402 15.431 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.757 -8.540 14.610 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.934 -6.789 14.346 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.881 -6.239 14.169 1.00 0.00 H new ATOM 0 HD22 LEU A 21 6.031 -5.561 12.992 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.658 -6.544 12.430 1.00 0.00 H new ATOM 298 N THR A 22 5.136 -9.985 11.298 1.00 0.00 N ATOM 299 CA THR A 22 3.885 -10.774 11.263 1.00 0.00 C ATOM 300 C THR A 22 3.184 -10.643 9.891 1.00 0.00 C ATOM 301 O THR A 22 3.719 -11.073 8.874 1.00 0.00 O ATOM 302 CB THR A 22 2.982 -10.357 12.445 1.00 0.00 C ATOM 303 OG1 THR A 22 2.738 -8.948 12.330 1.00 0.00 O ATOM 304 CG2 THR A 22 3.549 -10.730 13.823 1.00 0.00 C ATOM 0 H THR A 22 5.054 -9.073 10.848 1.00 0.00 H new ATOM 0 HA THR A 22 4.114 -11.833 11.380 1.00 0.00 H new ATOM 0 HB THR A 22 2.048 -10.916 12.383 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.509 -8.453 12.677 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.858 -10.404 14.601 1.00 0.00 H new ATOM 0 HG22 THR A 22 3.679 -11.811 13.882 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.512 -10.240 13.965 1.00 0.00 H new ATOM 312 N GLY A 23 2.146 -9.796 9.859 1.00 0.00 N ATOM 313 CA GLY A 23 1.288 -9.524 8.689 1.00 0.00 C ATOM 314 C GLY A 23 0.129 -8.588 9.088 1.00 0.00 C ATOM 315 O GLY A 23 0.266 -7.375 8.905 1.00 0.00 O ATOM 0 H GLY A 23 1.867 -9.258 10.679 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.878 -9.067 7.894 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.891 -10.459 8.294 1.00 0.00 H new ATOM 319 N PRO A 24 -0.864 -9.095 9.842 1.00 0.00 N ATOM 320 CA PRO A 24 -1.990 -8.276 10.340 1.00 0.00 C ATOM 321 C PRO A 24 -1.603 -7.228 11.404 1.00 0.00 C ATOM 322 O PRO A 24 -2.409 -6.373 11.757 1.00 0.00 O ATOM 323 CB PRO A 24 -3.002 -9.297 10.862 1.00 0.00 C ATOM 324 CG PRO A 24 -2.122 -10.439 11.368 1.00 0.00 C ATOM 325 CD PRO A 24 -0.979 -10.480 10.354 1.00 0.00 C ATOM 0 HA PRO A 24 -2.393 -7.653 9.542 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.618 -8.881 11.659 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -3.680 -9.630 10.076 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -1.757 -10.249 12.377 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -2.666 -11.383 11.399 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -0.050 -10.805 10.821 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.193 -11.181 9.548 1.00 0.00 H new ATOM 333 N GLN A 25 -0.336 -7.248 11.825 1.00 0.00 N ATOM 334 CA GLN A 25 0.220 -6.269 12.772 1.00 0.00 C ATOM 335 C GLN A 25 1.124 -5.252 12.071 1.00 0.00 C ATOM 336 O GLN A 25 1.002 -4.066 12.352 1.00 0.00 O ATOM 337 CB GLN A 25 1.030 -6.982 13.853 1.00 0.00 C ATOM 338 CG GLN A 25 1.241 -6.112 15.093 1.00 0.00 C ATOM 339 CD GLN A 25 -0.010 -6.089 15.972 1.00 0.00 C ATOM 340 OE1 GLN A 25 -1.155 -6.055 15.538 1.00 0.00 O ATOM 341 NE2 GLN A 25 0.215 -6.087 17.262 1.00 0.00 N ATOM 0 H GLN A 25 0.340 -7.947 11.518 1.00 0.00 H new ATOM 0 HA GLN A 25 -0.622 -5.739 13.218 1.00 0.00 H new ATOM 0 HB2 GLN A 25 0.518 -7.901 14.140 1.00 0.00 H new ATOM 0 HB3 GLN A 25 1.999 -7.271 13.446 1.00 0.00 H new ATOM 0 HG2 GLN A 25 2.086 -6.492 15.668 1.00 0.00 H new ATOM 0 HG3 GLN A 25 1.494 -5.096 14.789 1.00 0.00 H new ATOM 0 HE21 GLN A 25 1.172 -6.116 17.613 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -0.567 -6.057 17.916 1.00 0.00 H new ATOM 350 N ALA A 26 1.878 -5.686 11.058 1.00 0.00 N ATOM 351 CA ALA A 26 2.765 -4.792 10.290 1.00 0.00 C ATOM 352 C ALA A 26 1.982 -3.668 9.597 1.00 0.00 C ATOM 353 O ALA A 26 2.398 -2.531 9.718 1.00 0.00 O ATOM 354 CB ALA A 26 3.619 -5.577 9.295 1.00 0.00 C ATOM 0 H ALA A 26 1.895 -6.657 10.745 1.00 0.00 H new ATOM 0 HA ALA A 26 3.441 -4.318 11.002 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.261 -4.889 8.745 1.00 0.00 H new ATOM 0 HB2 ALA A 26 4.235 -6.297 9.833 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.970 -6.105 8.596 1.00 0.00 H new ATOM 360 N ILE A 27 0.724 -3.921 9.234 1.00 0.00 N ATOM 361 CA ILE A 27 -0.189 -2.882 8.697 1.00 0.00 C ATOM 362 C ILE A 27 -0.368 -1.711 9.696 1.00 0.00 C ATOM 363 O ILE A 27 -0.286 -0.543 9.318 1.00 0.00 O ATOM 364 CB ILE A 27 -1.534 -3.528 8.313 1.00 0.00 C ATOM 365 CG1 ILE A 27 -1.321 -4.617 7.250 1.00 0.00 C ATOM 366 CG2 ILE A 27 -2.505 -2.468 7.775 1.00 0.00 C ATOM 367 CD1 ILE A 27 -2.515 -5.567 7.120 1.00 0.00 C ATOM 0 H ILE A 27 0.299 -4.846 9.299 1.00 0.00 H new ATOM 0 HA ILE A 27 0.253 -2.451 7.799 1.00 0.00 H new ATOM 0 HB ILE A 27 -1.962 -3.981 9.208 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -1.133 -4.144 6.286 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -0.431 -5.193 7.501 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.450 -2.942 7.509 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.681 -1.713 8.542 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.075 -1.995 6.892 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -2.304 -6.313 6.354 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.689 -6.065 8.074 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -3.402 -5.000 6.839 1.00 0.00 H new ATOM 379 N SER A 28 -0.424 -2.061 10.980 1.00 0.00 N ATOM 380 CA SER A 28 -0.526 -1.098 12.096 1.00 0.00 C ATOM 381 C SER A 28 0.859 -0.624 12.544 1.00 0.00 C ATOM 382 O SER A 28 1.103 0.570 12.501 1.00 0.00 O ATOM 383 CB SER A 28 -1.226 -1.703 13.312 1.00 0.00 C ATOM 384 OG SER A 28 -1.451 -0.674 14.281 1.00 0.00 O ATOM 0 H SER A 28 -0.400 -3.033 11.288 1.00 0.00 H new ATOM 0 HA SER A 28 -1.111 -0.260 11.718 1.00 0.00 H new ATOM 0 HB2 SER A 28 -2.173 -2.154 13.015 1.00 0.00 H new ATOM 0 HB3 SER A 28 -0.615 -2.497 13.741 1.00 0.00 H new ATOM 0 HG SER A 28 -1.901 -1.055 15.064 1.00 0.00 H new ATOM 390 N LYS A 29 1.800 -1.546 12.754 1.00 0.00 N ATOM 391 CA LYS A 29 3.206 -1.247 13.108 1.00 0.00 C ATOM 392 C LYS A 29 3.867 -0.303 12.082 1.00 0.00 C ATOM 393 O LYS A 29 4.829 0.383 12.391 1.00 0.00 O ATOM 394 CB LYS A 29 4.007 -2.554 13.211 1.00 0.00 C ATOM 395 CG LYS A 29 5.291 -2.400 14.040 1.00 0.00 C ATOM 396 CD LYS A 29 4.986 -2.381 15.543 1.00 0.00 C ATOM 397 CE LYS A 29 6.089 -1.732 16.389 1.00 0.00 C ATOM 398 NZ LYS A 29 7.337 -2.506 16.491 1.00 0.00 N ATOM 0 H LYS A 29 1.611 -2.546 12.683 1.00 0.00 H new ATOM 0 HA LYS A 29 3.206 -0.739 14.072 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.380 -3.325 13.660 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.265 -2.897 12.209 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.972 -3.221 13.815 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.800 -1.478 13.758 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.051 -1.845 15.708 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.832 -3.404 15.886 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.320 -0.754 15.967 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.702 -1.563 17.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.020 -1.988 17.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.138 -3.431 16.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.737 -2.647 15.541 1.00 0.00 H new ATOM 412 N ALA A 30 3.340 -0.304 10.862 1.00 0.00 N ATOM 413 CA ALA A 30 3.715 0.599 9.769 1.00 0.00 C ATOM 414 C ALA A 30 2.894 1.887 9.783 1.00 0.00 C ATOM 415 O ALA A 30 3.479 2.933 10.001 1.00 0.00 O ATOM 416 CB ALA A 30 3.484 -0.119 8.453 1.00 0.00 C ATOM 0 H ALA A 30 2.608 -0.961 10.592 1.00 0.00 H new ATOM 0 HA ALA A 30 4.763 0.872 9.894 1.00 0.00 H new ATOM 0 HB1 ALA A 30 3.758 0.538 7.627 1.00 0.00 H new ATOM 0 HB2 ALA A 30 4.096 -1.020 8.418 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.432 -0.391 8.367 1.00 0.00 H new ATOM 422 N VAL A 31 1.565 1.801 9.847 1.00 0.00 N ATOM 423 CA VAL A 31 0.703 3.000 9.952 1.00 0.00 C ATOM 424 C VAL A 31 1.039 3.860 11.190 1.00 0.00 C ATOM 425 O VAL A 31 1.214 5.069 11.089 1.00 0.00 O ATOM 426 CB VAL A 31 -0.768 2.558 9.843 1.00 0.00 C ATOM 427 CG1 VAL A 31 -1.720 3.065 10.936 1.00 0.00 C ATOM 428 CG2 VAL A 31 -1.274 3.019 8.479 1.00 0.00 C ATOM 0 H VAL A 31 1.053 0.919 9.829 1.00 0.00 H new ATOM 0 HA VAL A 31 0.899 3.679 9.122 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.772 1.476 9.974 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.725 2.686 10.748 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.376 2.715 11.909 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.736 4.155 10.928 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.317 2.725 8.359 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.192 4.104 8.408 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.675 2.558 7.694 1.00 0.00 H new ATOM 438 N ALA A 32 1.317 3.170 12.286 1.00 0.00 N ATOM 439 CA ALA A 32 1.689 3.750 13.587 1.00 0.00 C ATOM 440 C ALA A 32 3.137 4.265 13.608 1.00 0.00 C ATOM 441 O ALA A 32 3.495 5.039 14.485 1.00 0.00 O ATOM 442 CB ALA A 32 1.466 2.719 14.697 1.00 0.00 C ATOM 0 H ALA A 32 1.291 2.150 12.304 1.00 0.00 H new ATOM 0 HA ALA A 32 1.047 4.614 13.758 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.743 3.153 15.658 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.415 2.429 14.719 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.081 1.840 14.506 1.00 0.00 H new ATOM 448 N GLU A 33 3.947 3.820 12.647 1.00 0.00 N ATOM 449 CA GLU A 33 5.340 4.289 12.457 1.00 0.00 C ATOM 450 C GLU A 33 5.559 5.065 11.142 1.00 0.00 C ATOM 451 O GLU A 33 6.679 5.309 10.701 1.00 0.00 O ATOM 452 CB GLU A 33 6.267 3.072 12.510 1.00 0.00 C ATOM 453 CG GLU A 33 6.302 2.477 13.921 1.00 0.00 C ATOM 454 CD GLU A 33 7.636 2.751 14.607 1.00 0.00 C ATOM 455 OE1 GLU A 33 7.898 3.940 14.893 1.00 0.00 O ATOM 456 OE2 GLU A 33 8.366 1.759 14.819 1.00 0.00 O ATOM 0 H GLU A 33 3.661 3.116 11.966 1.00 0.00 H new ATOM 0 HA GLU A 33 5.563 4.995 13.257 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.926 2.318 11.801 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.273 3.362 12.208 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.492 2.899 14.516 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.132 1.402 13.868 1.00 0.00 H new ATOM 463 N THR A 34 4.449 5.404 10.500 1.00 0.00 N ATOM 464 CA THR A 34 4.433 6.145 9.228 1.00 0.00 C ATOM 465 C THR A 34 3.600 7.428 9.335 1.00 0.00 C ATOM 466 O THR A 34 3.966 8.452 8.769 1.00 0.00 O ATOM 467 CB THR A 34 3.948 5.177 8.142 1.00 0.00 C ATOM 468 OG1 THR A 34 5.017 4.285 7.819 1.00 0.00 O ATOM 469 CG2 THR A 34 3.395 5.846 6.893 1.00 0.00 C ATOM 0 H THR A 34 3.518 5.173 10.846 1.00 0.00 H new ATOM 0 HA THR A 34 5.431 6.495 8.963 1.00 0.00 H new ATOM 0 HB THR A 34 3.097 4.634 8.554 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.962 3.489 8.387 1.00 0.00 H new ATOM 0 HG21 THR A 34 3.077 5.083 6.182 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.542 6.470 7.161 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.169 6.465 6.439 1.00 0.00 H new ATOM 477 N LEU A 35 2.501 7.363 10.073 1.00 0.00 N ATOM 478 CA LEU A 35 1.675 8.556 10.338 1.00 0.00 C ATOM 479 C LEU A 35 2.362 9.567 11.247 1.00 0.00 C ATOM 480 O LEU A 35 2.336 10.765 10.986 1.00 0.00 O ATOM 481 CB LEU A 35 0.351 8.135 10.954 1.00 0.00 C ATOM 482 CG LEU A 35 -0.460 7.391 9.906 1.00 0.00 C ATOM 483 CD1 LEU A 35 -1.640 6.743 10.613 1.00 0.00 C ATOM 484 CD2 LEU A 35 -0.896 8.365 8.808 1.00 0.00 C ATOM 0 H LEU A 35 2.153 6.506 10.502 1.00 0.00 H new ATOM 0 HA LEU A 35 1.512 9.048 9.379 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.524 7.497 11.821 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.197 9.009 11.305 1.00 0.00 H new ATOM 0 HG LEU A 35 0.127 6.612 9.419 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.245 6.199 9.887 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.274 6.051 11.372 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -2.248 7.514 11.087 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.477 7.830 8.057 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.506 9.156 9.244 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.015 8.804 8.340 1.00 0.00 H new ATOM 496 N VAL A 36 3.105 8.998 12.189 1.00 0.00 N ATOM 497 CA VAL A 36 3.926 9.770 13.131 1.00 0.00 C ATOM 498 C VAL A 36 5.394 9.838 12.671 1.00 0.00 C ATOM 499 O VAL A 36 6.202 10.457 13.363 1.00 0.00 O ATOM 500 CB VAL A 36 3.757 9.188 14.548 1.00 0.00 C ATOM 501 CG1 VAL A 36 4.544 7.895 14.797 1.00 0.00 C ATOM 502 CG2 VAL A 36 4.050 10.247 15.613 1.00 0.00 C ATOM 0 H VAL A 36 3.159 7.989 12.326 1.00 0.00 H new ATOM 0 HA VAL A 36 3.583 10.804 13.156 1.00 0.00 H new ATOM 0 HB VAL A 36 2.710 8.896 14.627 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.369 7.553 15.817 1.00 0.00 H new ATOM 0 HG12 VAL A 36 4.215 7.128 14.096 1.00 0.00 H new ATOM 0 HG13 VAL A 36 5.608 8.084 14.655 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.924 9.811 16.604 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.074 10.602 15.501 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.361 11.083 15.494 1.00 0.00 H new ATOM 512 N ALA A 37 5.731 9.140 11.575 1.00 0.00 N ATOM 513 CA ALA A 37 7.094 9.108 11.010 1.00 0.00 C ATOM 514 C ALA A 37 7.712 10.510 11.055 1.00 0.00 C ATOM 515 O ALA A 37 7.056 11.501 10.749 1.00 0.00 O ATOM 516 CB ALA A 37 7.073 8.589 9.571 1.00 0.00 C ATOM 0 H ALA A 37 5.062 8.577 11.050 1.00 0.00 H new ATOM 0 HA ALA A 37 7.701 8.430 11.610 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.088 8.574 9.175 1.00 0.00 H new ATOM 0 HB2 ALA A 37 6.662 7.580 9.554 1.00 0.00 H new ATOM 0 HB3 ALA A 37 6.454 9.243 8.957 1.00 0.00 H new ATOM 522 N ASP A 38 8.727 10.566 11.905 1.00 0.00 N ATOM 523 CA ASP A 38 9.436 11.813 12.220 1.00 0.00 C ATOM 524 C ASP A 38 10.915 11.651 11.831 1.00 0.00 C ATOM 525 O ASP A 38 11.628 10.906 12.504 1.00 0.00 O ATOM 526 CB ASP A 38 9.253 12.189 13.698 1.00 0.00 C ATOM 527 CG ASP A 38 9.996 13.483 14.056 1.00 0.00 C ATOM 528 OD1 ASP A 38 11.237 13.401 14.177 1.00 0.00 O ATOM 529 OD2 ASP A 38 9.326 14.533 14.156 1.00 0.00 O ATOM 0 H ASP A 38 9.088 9.751 12.400 1.00 0.00 H new ATOM 0 HA ASP A 38 9.017 12.639 11.644 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.191 12.309 13.913 1.00 0.00 H new ATOM 0 HB3 ASP A 38 9.616 11.376 14.327 1.00 0.00 H new ATOM 534 N PRO A 39 11.295 12.277 10.713 1.00 0.00 N ATOM 535 CA PRO A 39 10.415 13.046 9.805 1.00 0.00 C ATOM 536 C PRO A 39 9.526 12.143 8.930 1.00 0.00 C ATOM 537 O PRO A 39 9.798 10.953 8.782 1.00 0.00 O ATOM 538 CB PRO A 39 11.373 13.910 8.986 1.00 0.00 C ATOM 539 CG PRO A 39 12.647 13.067 8.921 1.00 0.00 C ATOM 540 CD PRO A 39 12.703 12.365 10.279 1.00 0.00 C ATOM 0 HA PRO A 39 9.694 13.651 10.354 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.977 14.116 7.992 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.553 14.873 9.464 1.00 0.00 H new ATOM 0 HG2 PRO A 39 12.607 12.348 8.103 1.00 0.00 H new ATOM 0 HG3 PRO A 39 13.528 13.688 8.757 1.00 0.00 H new ATOM 0 HD2 PRO A 39 13.154 11.376 10.195 1.00 0.00 H new ATOM 0 HD3 PRO A 39 13.303 12.930 10.993 1.00 0.00 H new ATOM 548 N THR A 40 8.377 12.691 8.540 1.00 0.00 N ATOM 549 CA THR A 40 7.392 11.942 7.731 1.00 0.00 C ATOM 550 C THR A 40 7.763 11.957 6.237 1.00 0.00 C ATOM 551 O THR A 40 8.268 12.973 5.755 1.00 0.00 O ATOM 552 CB THR A 40 5.936 12.365 8.042 1.00 0.00 C ATOM 553 OG1 THR A 40 5.164 11.167 8.128 1.00 0.00 O ATOM 554 CG2 THR A 40 5.256 13.322 7.050 1.00 0.00 C ATOM 0 H THR A 40 8.097 13.646 8.765 1.00 0.00 H new ATOM 0 HA THR A 40 7.436 10.894 8.026 1.00 0.00 H new ATOM 0 HB THR A 40 5.986 12.941 8.966 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.231 11.393 8.326 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.242 13.536 7.388 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.823 14.251 6.994 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.220 12.859 6.064 1.00 0.00 H new ATOM 562 N PRO A 41 7.577 10.832 5.541 1.00 0.00 N ATOM 563 CA PRO A 41 7.793 10.768 4.087 1.00 0.00 C ATOM 564 C PRO A 41 6.704 11.545 3.345 1.00 0.00 C ATOM 565 O PRO A 41 5.593 11.746 3.838 1.00 0.00 O ATOM 566 CB PRO A 41 7.776 9.279 3.754 1.00 0.00 C ATOM 567 CG PRO A 41 6.856 8.691 4.821 1.00 0.00 C ATOM 568 CD PRO A 41 7.164 9.516 6.065 1.00 0.00 C ATOM 0 HA PRO A 41 8.733 11.227 3.779 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.395 9.096 2.749 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.775 8.845 3.800 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.808 8.775 4.535 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.058 7.632 4.984 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.290 9.602 6.711 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.955 9.059 6.659 1.00 0.00 H new ATOM 576 N THR A 42 7.092 12.023 2.175 1.00 0.00 N ATOM 577 CA THR A 42 6.212 12.823 1.305 1.00 0.00 C ATOM 578 C THR A 42 5.275 11.881 0.534 1.00 0.00 C ATOM 579 O THR A 42 5.637 10.763 0.174 1.00 0.00 O ATOM 580 CB THR A 42 7.072 13.699 0.376 1.00 0.00 C ATOM 581 OG1 THR A 42 7.981 14.449 1.190 1.00 0.00 O ATOM 582 CG2 THR A 42 6.246 14.678 -0.468 1.00 0.00 C ATOM 0 H THR A 42 8.025 11.873 1.791 1.00 0.00 H new ATOM 0 HA THR A 42 5.588 13.495 1.894 1.00 0.00 H new ATOM 0 HB THR A 42 7.589 13.037 -0.319 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.542 15.014 0.619 1.00 0.00 H new ATOM 0 HG21 THR A 42 6.912 15.265 -1.100 1.00 0.00 H new ATOM 0 HG22 THR A 42 5.549 14.121 -1.094 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.689 15.345 0.190 1.00 0.00 H new ATOM 590 N ALA A 43 4.052 12.361 0.341 1.00 0.00 N ATOM 591 CA ALA A 43 3.013 11.631 -0.405 1.00 0.00 C ATOM 592 C ALA A 43 3.118 11.928 -1.906 1.00 0.00 C ATOM 593 O ALA A 43 3.187 13.082 -2.332 1.00 0.00 O ATOM 594 CB ALA A 43 1.635 12.030 0.119 1.00 0.00 C ATOM 0 H ALA A 43 3.745 13.267 0.694 1.00 0.00 H new ATOM 0 HA ALA A 43 3.157 10.560 -0.260 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.866 11.490 -0.433 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.563 11.783 1.178 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.492 13.102 -0.014 1.00 0.00 H new ATOM 600 N THR A 44 3.252 10.858 -2.676 1.00 0.00 N ATOM 601 CA THR A 44 3.350 10.959 -4.148 1.00 0.00 C ATOM 602 C THR A 44 2.196 10.241 -4.861 1.00 0.00 C ATOM 603 O THR A 44 1.861 9.110 -4.532 1.00 0.00 O ATOM 604 CB THR A 44 4.729 10.438 -4.575 1.00 0.00 C ATOM 605 OG1 THR A 44 5.708 11.352 -4.075 1.00 0.00 O ATOM 606 CG2 THR A 44 4.874 10.244 -6.087 1.00 0.00 C ATOM 0 H THR A 44 3.297 9.904 -2.318 1.00 0.00 H new ATOM 0 HA THR A 44 3.254 12.002 -4.449 1.00 0.00 H new ATOM 0 HB THR A 44 4.868 9.442 -4.155 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.583 11.138 -4.461 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.874 9.874 -6.312 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.134 9.523 -6.434 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.717 11.197 -6.593 1.00 0.00 H new ATOM 614 N ILE A 45 1.690 10.862 -5.923 1.00 0.00 N ATOM 615 CA ILE A 45 0.568 10.291 -6.700 1.00 0.00 C ATOM 616 C ILE A 45 1.114 9.210 -7.646 1.00 0.00 C ATOM 617 O ILE A 45 2.011 9.457 -8.459 1.00 0.00 O ATOM 618 CB ILE A 45 -0.265 11.350 -7.450 1.00 0.00 C ATOM 619 CG1 ILE A 45 -0.693 12.482 -6.497 1.00 0.00 C ATOM 620 CG2 ILE A 45 -1.504 10.680 -8.072 1.00 0.00 C ATOM 621 CD1 ILE A 45 -1.352 13.704 -7.151 1.00 0.00 C ATOM 0 H ILE A 45 2.030 11.758 -6.273 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.132 9.840 -5.996 1.00 0.00 H new ATOM 0 HB ILE A 45 0.346 11.786 -8.240 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.387 12.069 -5.764 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.186 12.819 -5.949 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.094 11.427 -8.603 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.187 9.905 -8.770 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.110 10.232 -7.284 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -1.610 14.433 -6.383 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.659 14.155 -7.861 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -2.256 13.393 -7.674 1.00 0.00 H new ATOM 633 N VAL A 46 0.700 7.992 -7.325 1.00 0.00 N ATOM 634 CA VAL A 46 1.079 6.777 -8.069 1.00 0.00 C ATOM 635 C VAL A 46 -0.158 5.980 -8.513 1.00 0.00 C ATOM 636 O VAL A 46 -1.239 6.124 -7.945 1.00 0.00 O ATOM 637 CB VAL A 46 2.083 5.903 -7.283 1.00 0.00 C ATOM 638 CG1 VAL A 46 3.357 6.678 -6.953 1.00 0.00 C ATOM 639 CG2 VAL A 46 1.528 5.315 -5.987 1.00 0.00 C ATOM 0 H VAL A 46 0.084 7.807 -6.533 1.00 0.00 H new ATOM 0 HA VAL A 46 1.594 7.101 -8.973 1.00 0.00 H new ATOM 0 HB VAL A 46 2.299 5.072 -7.955 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.041 6.035 -6.400 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.833 7.006 -7.877 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.107 7.548 -6.346 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.298 4.716 -5.500 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.222 6.123 -5.322 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.667 4.685 -6.212 1.00 0.00 H new ATOM 649 N HIS A 47 0.016 5.173 -9.550 1.00 0.00 N ATOM 650 CA HIS A 47 -1.056 4.290 -10.042 1.00 0.00 C ATOM 651 C HIS A 47 -0.819 2.827 -9.647 1.00 0.00 C ATOM 652 O HIS A 47 0.236 2.260 -9.930 1.00 0.00 O ATOM 653 CB HIS A 47 -1.228 4.433 -11.556 1.00 0.00 C ATOM 654 CG HIS A 47 -2.055 5.674 -11.950 1.00 0.00 C ATOM 655 ND1 HIS A 47 -3.212 5.633 -12.589 1.00 0.00 N ATOM 656 CD2 HIS A 47 -1.693 6.945 -11.823 1.00 0.00 C ATOM 657 CE1 HIS A 47 -3.563 6.887 -12.886 1.00 0.00 C ATOM 658 NE2 HIS A 47 -2.622 7.697 -12.415 1.00 0.00 N ATOM 0 H HIS A 47 0.888 5.105 -10.074 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.983 4.605 -9.563 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.246 4.493 -12.024 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.714 3.539 -11.948 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -0.804 7.306 -11.328 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.455 7.189 -13.416 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.612 8.714 -12.492 1.00 0.00 H new ATOM 666 N PHE A 48 -1.824 2.275 -8.974 1.00 0.00 N ATOM 667 CA PHE A 48 -1.782 0.900 -8.438 1.00 0.00 C ATOM 668 C PHE A 48 -2.465 -0.061 -9.422 1.00 0.00 C ATOM 669 O PHE A 48 -3.682 -0.025 -9.618 1.00 0.00 O ATOM 670 CB PHE A 48 -2.474 0.870 -7.070 1.00 0.00 C ATOM 671 CG PHE A 48 -2.025 -0.289 -6.177 1.00 0.00 C ATOM 672 CD1 PHE A 48 -2.629 -1.531 -6.261 1.00 0.00 C ATOM 673 CD2 PHE A 48 -1.019 -0.088 -5.243 1.00 0.00 C ATOM 674 CE1 PHE A 48 -2.221 -2.571 -5.430 1.00 0.00 C ATOM 675 CE2 PHE A 48 -0.594 -1.122 -4.431 1.00 0.00 C ATOM 676 CZ PHE A 48 -1.201 -2.371 -4.511 1.00 0.00 C ATOM 0 H PHE A 48 -2.698 2.763 -8.779 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.748 0.580 -8.313 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.280 1.810 -6.554 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.552 0.805 -7.220 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -3.422 -1.695 -6.976 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.563 0.887 -5.150 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -2.700 -3.536 -5.501 1.00 0.00 H new ATOM 0 HE2 PHE A 48 0.213 -0.960 -3.731 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.882 -3.176 -3.865 1.00 0.00 H new ATOM 686 N LYS A 49 -1.615 -0.801 -10.125 1.00 0.00 N ATOM 687 CA LYS A 49 -2.036 -1.793 -11.133 1.00 0.00 C ATOM 688 C LYS A 49 -2.019 -3.197 -10.511 1.00 0.00 C ATOM 689 O LYS A 49 -0.965 -3.704 -10.127 1.00 0.00 O ATOM 690 CB LYS A 49 -1.149 -1.696 -12.388 1.00 0.00 C ATOM 691 CG LYS A 49 -1.473 -2.782 -13.428 1.00 0.00 C ATOM 692 CD LYS A 49 -1.736 -2.237 -14.834 1.00 0.00 C ATOM 693 CE LYS A 49 -0.541 -2.436 -15.759 1.00 0.00 C ATOM 694 NZ LYS A 49 0.183 -1.184 -15.979 1.00 0.00 N ATOM 0 H LYS A 49 -0.603 -0.736 -10.017 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.057 -1.584 -11.453 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.276 -0.714 -12.843 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.102 -1.779 -12.096 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.644 -3.488 -13.472 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.349 -3.340 -13.096 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.609 -2.734 -15.258 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.973 -1.175 -14.772 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.133 -3.176 -15.329 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.882 -2.833 -16.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.990 -1.356 -16.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.455 -0.486 -16.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.530 -0.819 -15.069 1.00 0.00 H new ATOM 708 N VAL A 50 -3.227 -3.704 -10.287 1.00 0.00 N ATOM 709 CA VAL A 50 -3.444 -5.057 -9.729 1.00 0.00 C ATOM 710 C VAL A 50 -3.806 -6.009 -10.874 1.00 0.00 C ATOM 711 O VAL A 50 -4.855 -5.904 -11.508 1.00 0.00 O ATOM 712 CB VAL A 50 -4.550 -5.110 -8.659 1.00 0.00 C ATOM 713 CG1 VAL A 50 -4.602 -6.465 -7.944 1.00 0.00 C ATOM 714 CG2 VAL A 50 -4.388 -4.028 -7.601 1.00 0.00 C ATOM 0 H VAL A 50 -4.090 -3.198 -10.483 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.518 -5.354 -9.237 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.478 -4.947 -9.207 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.398 -6.453 -7.199 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -4.798 -7.253 -8.671 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.648 -6.654 -7.453 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -5.193 -4.110 -6.871 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.429 -4.151 -7.099 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.426 -3.047 -8.075 1.00 0.00 H new ATOM 724 N SER A 51 -2.824 -6.831 -11.186 1.00 0.00 N ATOM 725 CA SER A 51 -2.935 -7.884 -12.210 1.00 0.00 C ATOM 726 C SER A 51 -2.692 -9.240 -11.542 1.00 0.00 C ATOM 727 O SER A 51 -2.167 -9.286 -10.427 1.00 0.00 O ATOM 728 CB SER A 51 -1.871 -7.625 -13.272 1.00 0.00 C ATOM 729 OG SER A 51 -1.930 -8.597 -14.323 1.00 0.00 O ATOM 0 H SER A 51 -1.909 -6.797 -10.737 1.00 0.00 H new ATOM 0 HA SER A 51 -3.923 -7.883 -12.671 1.00 0.00 H new ATOM 0 HB2 SER A 51 -2.008 -6.627 -13.690 1.00 0.00 H new ATOM 0 HB3 SER A 51 -0.883 -7.645 -12.811 1.00 0.00 H new ATOM 0 HG SER A 51 -1.349 -9.355 -14.101 1.00 0.00 H new ATOM 735 N ALA A 52 -3.054 -10.303 -12.262 1.00 0.00 N ATOM 736 CA ALA A 52 -2.884 -11.714 -11.853 1.00 0.00 C ATOM 737 C ALA A 52 -1.450 -11.970 -11.357 1.00 0.00 C ATOM 738 O ALA A 52 -0.495 -11.910 -12.133 1.00 0.00 O ATOM 739 CB ALA A 52 -3.201 -12.612 -13.054 1.00 0.00 C ATOM 0 H ALA A 52 -3.490 -10.211 -13.180 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.564 -11.939 -11.031 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -3.080 -13.657 -12.769 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -4.228 -12.440 -13.376 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.520 -12.378 -13.873 1.00 0.00 H new ATOM 745 N GLN A 53 -1.332 -11.907 -10.029 1.00 0.00 N ATOM 746 CA GLN A 53 -0.044 -11.919 -9.302 1.00 0.00 C ATOM 747 C GLN A 53 0.998 -10.931 -9.861 1.00 0.00 C ATOM 748 O GLN A 53 2.072 -11.314 -10.321 1.00 0.00 O ATOM 749 CB GLN A 53 0.494 -13.353 -9.221 1.00 0.00 C ATOM 750 CG GLN A 53 -0.137 -14.043 -8.014 1.00 0.00 C ATOM 751 CD GLN A 53 -0.201 -15.561 -8.111 1.00 0.00 C ATOM 752 OE1 GLN A 53 -0.385 -16.154 -9.165 1.00 0.00 O ATOM 753 NE2 GLN A 53 -0.167 -16.210 -6.972 1.00 0.00 N ATOM 0 H GLN A 53 -2.140 -11.845 -9.410 1.00 0.00 H new ATOM 0 HA GLN A 53 -0.241 -11.559 -8.292 1.00 0.00 H new ATOM 0 HB2 GLN A 53 0.257 -13.898 -10.135 1.00 0.00 H new ATOM 0 HB3 GLN A 53 1.580 -13.345 -9.127 1.00 0.00 H new ATOM 0 HG2 GLN A 53 0.428 -13.773 -7.122 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -1.148 -13.658 -7.880 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -0.013 -15.703 -6.101 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -0.295 -17.222 -6.958 1.00 0.00 H new ATOM 762 N GLY A 54 0.653 -9.640 -9.770 1.00 0.00 N ATOM 763 CA GLY A 54 1.532 -8.569 -10.277 1.00 0.00 C ATOM 764 C GLY A 54 1.001 -7.185 -9.908 1.00 0.00 C ATOM 765 O GLY A 54 -0.105 -6.811 -10.298 1.00 0.00 O ATOM 0 H GLY A 54 -0.219 -9.310 -9.355 1.00 0.00 H new ATOM 0 HA2 GLY A 54 2.534 -8.696 -9.868 1.00 0.00 H new ATOM 0 HA3 GLY A 54 1.617 -8.650 -11.361 1.00 0.00 H new ATOM 769 N ILE A 55 1.723 -6.570 -8.982 1.00 0.00 N ATOM 770 CA ILE A 55 1.406 -5.216 -8.492 1.00 0.00 C ATOM 771 C ILE A 55 2.471 -4.260 -9.043 1.00 0.00 C ATOM 772 O ILE A 55 3.669 -4.457 -8.845 1.00 0.00 O ATOM 773 CB ILE A 55 1.378 -5.192 -6.948 1.00 0.00 C ATOM 774 CG1 ILE A 55 0.445 -6.250 -6.327 1.00 0.00 C ATOM 775 CG2 ILE A 55 1.108 -3.787 -6.393 1.00 0.00 C ATOM 776 CD1 ILE A 55 -1.025 -6.212 -6.766 1.00 0.00 C ATOM 0 H ILE A 55 2.545 -6.986 -8.544 1.00 0.00 H new ATOM 0 HA ILE A 55 0.418 -4.906 -8.833 1.00 0.00 H new ATOM 0 HB ILE A 55 2.384 -5.474 -6.638 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.845 -7.237 -6.561 1.00 0.00 H new ATOM 0 HG13 ILE A 55 0.480 -6.141 -5.243 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.098 -3.822 -5.304 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.892 -3.107 -6.727 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.142 -3.433 -6.754 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.576 -7.004 -6.260 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.458 -5.246 -6.506 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -1.087 -6.359 -7.844 1.00 0.00 H new ATOM 788 N THR A 56 1.973 -3.176 -9.612 1.00 0.00 N ATOM 789 CA THR A 56 2.830 -2.159 -10.251 1.00 0.00 C ATOM 790 C THR A 56 2.420 -0.771 -9.750 1.00 0.00 C ATOM 791 O THR A 56 1.236 -0.496 -9.543 1.00 0.00 O ATOM 792 CB THR A 56 2.736 -2.269 -11.783 1.00 0.00 C ATOM 793 OG1 THR A 56 2.829 -3.648 -12.164 1.00 0.00 O ATOM 794 CG2 THR A 56 3.868 -1.501 -12.476 1.00 0.00 C ATOM 0 H THR A 56 0.976 -2.965 -9.651 1.00 0.00 H new ATOM 0 HA THR A 56 3.873 -2.326 -9.981 1.00 0.00 H new ATOM 0 HB THR A 56 1.782 -1.839 -12.090 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.768 -3.723 -13.139 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.768 -1.602 -13.557 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.813 -0.447 -12.204 1.00 0.00 H new ATOM 0 HG23 THR A 56 4.829 -1.907 -12.161 1.00 0.00 H new ATOM 802 N LEU A 57 3.453 -0.002 -9.425 1.00 0.00 N ATOM 803 CA LEU A 57 3.331 1.370 -8.901 1.00 0.00 C ATOM 804 C LEU A 57 4.170 2.365 -9.696 1.00 0.00 C ATOM 805 O LEU A 57 5.397 2.267 -9.733 1.00 0.00 O ATOM 806 CB LEU A 57 3.705 1.400 -7.418 1.00 0.00 C ATOM 807 CG LEU A 57 2.576 0.795 -6.586 1.00 0.00 C ATOM 808 CD1 LEU A 57 3.085 0.414 -5.199 1.00 0.00 C ATOM 809 CD2 LEU A 57 1.435 1.806 -6.478 1.00 0.00 C ATOM 0 H LEU A 57 4.420 -0.312 -9.517 1.00 0.00 H new ATOM 0 HA LEU A 57 2.291 1.677 -9.011 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.628 0.843 -7.255 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.892 2.426 -7.102 1.00 0.00 H new ATOM 0 HG LEU A 57 2.211 -0.109 -7.073 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.269 -0.016 -4.617 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.888 -0.317 -5.294 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.462 1.303 -4.693 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.626 1.380 -5.885 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.798 2.714 -5.997 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.066 2.046 -7.475 1.00 0.00 H new ATOM 821 N THR A 58 3.443 3.129 -10.497 1.00 0.00 N ATOM 822 CA THR A 58 4.024 4.144 -11.396 1.00 0.00 C ATOM 823 C THR A 58 3.935 5.533 -10.762 1.00 0.00 C ATOM 824 O THR A 58 2.884 5.960 -10.285 1.00 0.00 O ATOM 825 CB THR A 58 3.285 4.153 -12.740 1.00 0.00 C ATOM 826 OG1 THR A 58 1.884 4.348 -12.520 1.00 0.00 O ATOM 827 CG2 THR A 58 3.529 2.860 -13.523 1.00 0.00 C ATOM 0 H THR A 58 2.426 3.070 -10.550 1.00 0.00 H new ATOM 0 HA THR A 58 5.071 3.891 -11.562 1.00 0.00 H new ATOM 0 HB THR A 58 3.674 4.977 -13.338 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.416 4.355 -13.381 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.990 2.901 -14.470 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.596 2.748 -13.717 1.00 0.00 H new ATOM 0 HG23 THR A 58 3.175 2.010 -12.940 1.00 0.00 H new ATOM 835 N ASP A 59 5.076 6.202 -10.744 1.00 0.00 N ATOM 836 CA ASP A 59 5.171 7.557 -10.175 1.00 0.00 C ATOM 837 C ASP A 59 4.893 8.632 -11.222 1.00 0.00 C ATOM 838 O ASP A 59 5.661 8.820 -12.164 1.00 0.00 O ATOM 839 CB ASP A 59 6.546 7.758 -9.545 1.00 0.00 C ATOM 840 CG ASP A 59 6.753 6.935 -8.268 1.00 0.00 C ATOM 841 OD1 ASP A 59 6.119 5.876 -8.082 1.00 0.00 O ATOM 842 OD2 ASP A 59 7.591 7.390 -7.482 1.00 0.00 O ATOM 0 H ASP A 59 5.954 5.839 -11.114 1.00 0.00 H new ATOM 0 HA ASP A 59 4.406 7.655 -9.404 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.314 7.489 -10.271 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.682 8.815 -9.314 1.00 0.00 H new ATOM 847 N ASN A 60 3.810 9.356 -10.969 1.00 0.00 N ATOM 848 CA ASN A 60 3.398 10.472 -11.845 1.00 0.00 C ATOM 849 C ASN A 60 3.421 11.826 -11.108 1.00 0.00 C ATOM 850 O ASN A 60 3.081 12.875 -11.650 1.00 0.00 O ATOM 851 CB ASN A 60 2.007 10.158 -12.414 1.00 0.00 C ATOM 852 CG ASN A 60 1.799 10.748 -13.814 1.00 0.00 C ATOM 853 OD1 ASN A 60 1.472 10.051 -14.770 1.00 0.00 O ATOM 854 ND2 ASN A 60 2.040 12.025 -13.987 1.00 0.00 N ATOM 0 H ASN A 60 3.196 9.200 -10.170 1.00 0.00 H new ATOM 0 HA ASN A 60 4.113 10.567 -12.663 1.00 0.00 H new ATOM 0 HB2 ASN A 60 1.870 9.077 -12.454 1.00 0.00 H new ATOM 0 HB3 ASN A 60 1.245 10.551 -11.741 1.00 0.00 H new ATOM 0 HD21 ASN A 60 1.956 12.439 -14.916 1.00 0.00 H new ATOM 0 HD22 ASN A 60 2.312 12.605 -13.193 1.00 0.00 H new ATOM 861 N GLN A 61 3.977 11.802 -9.903 1.00 0.00 N ATOM 862 CA GLN A 61 4.125 12.989 -9.043 1.00 0.00 C ATOM 863 C GLN A 61 5.357 12.940 -8.129 1.00 0.00 C ATOM 864 O GLN A 61 5.409 13.594 -7.090 1.00 0.00 O ATOM 865 CB GLN A 61 2.840 13.202 -8.234 1.00 0.00 C ATOM 866 CG GLN A 61 1.855 14.118 -8.970 1.00 0.00 C ATOM 867 CD GLN A 61 2.450 15.513 -9.163 1.00 0.00 C ATOM 868 OE1 GLN A 61 2.944 15.885 -10.217 1.00 0.00 O ATOM 869 NE2 GLN A 61 2.458 16.294 -8.107 1.00 0.00 N ATOM 0 H GLN A 61 4.346 10.949 -9.482 1.00 0.00 H new ATOM 0 HA GLN A 61 4.291 13.842 -9.701 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.367 12.239 -8.041 1.00 0.00 H new ATOM 0 HB3 GLN A 61 3.087 13.636 -7.265 1.00 0.00 H new ATOM 0 HG2 GLN A 61 1.606 13.687 -9.940 1.00 0.00 H new ATOM 0 HG3 GLN A 61 0.926 14.189 -8.405 1.00 0.00 H new ATOM 0 HE21 GLN A 61 2.043 15.973 -7.232 1.00 0.00 H new ATOM 0 HE22 GLN A 61 2.879 17.221 -8.162 1.00 0.00 H new ATOM 878 N ARG A 62 6.340 12.157 -8.564 1.00 0.00 N ATOM 879 CA ARG A 62 7.630 12.054 -7.857 1.00 0.00 C ATOM 880 C ARG A 62 8.780 12.716 -8.622 1.00 0.00 C ATOM 881 O ARG A 62 9.916 12.721 -8.150 1.00 0.00 O ATOM 882 CB ARG A 62 7.975 10.588 -7.610 1.00 0.00 C ATOM 883 CG ARG A 62 8.717 10.520 -6.279 1.00 0.00 C ATOM 884 CD ARG A 62 8.369 9.243 -5.522 1.00 0.00 C ATOM 885 NE ARG A 62 8.530 9.441 -4.081 1.00 0.00 N ATOM 886 CZ ARG A 62 9.683 9.599 -3.434 1.00 0.00 C ATOM 887 NH1 ARG A 62 10.853 9.522 -4.059 1.00 0.00 N ATOM 888 NH2 ARG A 62 9.655 9.812 -2.133 1.00 0.00 N ATOM 0 H ARG A 62 6.276 11.581 -9.403 1.00 0.00 H new ATOM 0 HA ARG A 62 7.512 12.584 -6.912 1.00 0.00 H new ATOM 0 HB2 ARG A 62 7.071 9.980 -7.579 1.00 0.00 H new ATOM 0 HB3 ARG A 62 8.595 10.197 -8.417 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.792 10.560 -6.456 1.00 0.00 H new ATOM 0 HG3 ARG A 62 8.461 11.388 -5.671 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.342 8.951 -5.742 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.011 8.428 -5.857 1.00 0.00 H new ATOM 0 HE ARG A 62 7.679 9.460 -3.519 1.00 0.00 H new ATOM 0 HH11 ARG A 62 10.884 9.337 -5.062 1.00 0.00 H new ATOM 0 HH12 ARG A 62 11.720 9.648 -3.536 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.762 9.853 -1.642 1.00 0.00 H new ATOM 0 HH22 ARG A 62 10.526 9.936 -1.618 1.00 0.00 H new ATOM 902 N LYS A 63 8.445 13.284 -9.784 1.00 0.00 N ATOM 903 CA LYS A 63 9.409 13.857 -10.740 1.00 0.00 C ATOM 904 C LYS A 63 10.310 12.764 -11.315 1.00 0.00 C ATOM 905 O LYS A 63 10.551 11.734 -10.689 1.00 0.00 O ATOM 906 CB LYS A 63 10.303 14.945 -10.137 1.00 0.00 C ATOM 907 CG LYS A 63 9.717 16.343 -10.298 1.00 0.00 C ATOM 908 CD LYS A 63 10.886 17.322 -10.250 1.00 0.00 C ATOM 909 CE LYS A 63 10.913 18.172 -11.519 1.00 0.00 C ATOM 910 NZ LYS A 63 12.243 18.766 -11.708 1.00 0.00 N ATOM 0 H LYS A 63 7.477 13.362 -10.097 1.00 0.00 H new ATOM 0 HA LYS A 63 8.802 14.317 -11.520 1.00 0.00 H new ATOM 0 HB2 LYS A 63 10.455 14.739 -9.078 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.283 14.909 -10.613 1.00 0.00 H new ATOM 0 HG2 LYS A 63 9.179 16.430 -11.242 1.00 0.00 H new ATOM 0 HG3 LYS A 63 9.002 16.556 -9.503 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.796 17.965 -9.374 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.824 16.776 -10.149 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.656 17.557 -12.382 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.162 18.959 -11.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 12.246 19.341 -12.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 12.473 19.368 -10.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 12.952 18.010 -11.792 1.00 0.00 H new ATOM 924 N LEU A 64 10.733 13.012 -12.552 1.00 0.00 N ATOM 925 CA LEU A 64 11.552 12.088 -13.361 1.00 0.00 C ATOM 926 C LEU A 64 10.749 10.810 -13.669 1.00 0.00 C ATOM 927 O LEU A 64 10.052 10.766 -14.681 1.00 0.00 O ATOM 928 CB LEU A 64 12.910 11.858 -12.657 1.00 0.00 C ATOM 929 CG LEU A 64 14.084 11.297 -13.477 1.00 0.00 C ATOM 930 CD1 LEU A 64 13.919 9.818 -13.836 1.00 0.00 C ATOM 931 CD2 LEU A 64 14.350 12.149 -14.720 1.00 0.00 C ATOM 0 H LEU A 64 10.515 13.881 -13.040 1.00 0.00 H new ATOM 0 HA LEU A 64 11.792 12.515 -14.335 1.00 0.00 H new ATOM 0 HB2 LEU A 64 13.228 12.811 -12.234 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.738 11.180 -11.821 1.00 0.00 H new ATOM 0 HG LEU A 64 14.960 11.353 -12.831 1.00 0.00 H new ATOM 0 HD11 LEU A 64 14.781 9.486 -14.414 1.00 0.00 H new ATOM 0 HD12 LEU A 64 13.845 9.228 -12.923 1.00 0.00 H new ATOM 0 HD13 LEU A 64 13.013 9.686 -14.427 1.00 0.00 H new ATOM 0 HD21 LEU A 64 15.185 11.727 -15.279 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.461 12.160 -15.350 1.00 0.00 H new ATOM 0 HD23 LEU A 64 14.594 13.168 -14.418 1.00 0.00 H new ATOM 943 N PHE A 65 10.730 9.876 -12.720 1.00 0.00 N ATOM 944 CA PHE A 65 10.083 8.555 -12.827 1.00 0.00 C ATOM 945 C PHE A 65 10.345 7.755 -11.542 1.00 0.00 C ATOM 946 O PHE A 65 11.108 8.212 -10.698 1.00 0.00 O ATOM 947 CB PHE A 65 10.669 7.798 -14.026 1.00 0.00 C ATOM 948 CG PHE A 65 9.699 6.743 -14.540 1.00 0.00 C ATOM 949 CD1 PHE A 65 8.375 7.067 -14.820 1.00 0.00 C ATOM 950 CD2 PHE A 65 10.162 5.448 -14.739 1.00 0.00 C ATOM 951 CE1 PHE A 65 7.517 6.098 -15.311 1.00 0.00 C ATOM 952 CE2 PHE A 65 9.305 4.483 -15.234 1.00 0.00 C ATOM 953 CZ PHE A 65 7.981 4.804 -15.523 1.00 0.00 C ATOM 0 H PHE A 65 11.181 10.017 -11.816 1.00 0.00 H new ATOM 0 HA PHE A 65 9.009 8.683 -12.965 1.00 0.00 H new ATOM 0 HB2 PHE A 65 10.902 8.502 -14.825 1.00 0.00 H new ATOM 0 HB3 PHE A 65 11.607 7.323 -13.737 1.00 0.00 H new ATOM 0 HD1 PHE A 65 8.017 8.073 -14.655 1.00 0.00 H new ATOM 0 HD2 PHE A 65 11.187 5.197 -14.508 1.00 0.00 H new ATOM 0 HE1 PHE A 65 6.489 6.346 -15.529 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.663 3.477 -15.397 1.00 0.00 H new ATOM 0 HZ PHE A 65 7.315 4.048 -15.912 1.00 0.00 H new ATOM 963 N PHE A 66 9.735 6.568 -11.477 1.00 0.00 N ATOM 964 CA PHE A 66 9.828 5.567 -10.388 1.00 0.00 C ATOM 965 C PHE A 66 8.718 4.518 -10.503 1.00 0.00 C ATOM 966 O PHE A 66 7.543 4.799 -10.271 1.00 0.00 O ATOM 967 CB PHE A 66 9.761 6.134 -8.965 1.00 0.00 C ATOM 968 CG PHE A 66 11.084 6.589 -8.375 1.00 0.00 C ATOM 969 CD1 PHE A 66 12.111 5.656 -8.291 1.00 0.00 C ATOM 970 CD2 PHE A 66 11.230 7.852 -7.808 1.00 0.00 C ATOM 971 CE1 PHE A 66 13.282 5.980 -7.641 1.00 0.00 C ATOM 972 CE2 PHE A 66 12.408 8.179 -7.159 1.00 0.00 C ATOM 973 CZ PHE A 66 13.437 7.242 -7.072 1.00 0.00 C ATOM 0 H PHE A 66 9.121 6.252 -12.228 1.00 0.00 H new ATOM 0 HA PHE A 66 10.820 5.137 -10.529 1.00 0.00 H new ATOM 0 HB2 PHE A 66 9.073 6.979 -8.962 1.00 0.00 H new ATOM 0 HB3 PHE A 66 9.334 5.374 -8.310 1.00 0.00 H new ATOM 0 HD1 PHE A 66 11.991 4.679 -8.735 1.00 0.00 H new ATOM 0 HD2 PHE A 66 10.428 8.573 -7.874 1.00 0.00 H new ATOM 0 HE1 PHE A 66 14.080 5.255 -7.573 1.00 0.00 H new ATOM 0 HE2 PHE A 66 12.530 9.158 -6.721 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.355 7.495 -6.563 1.00 0.00 H new ATOM 983 N ARG A 67 9.105 3.376 -11.050 1.00 0.00 N ATOM 984 CA ARG A 67 8.186 2.238 -11.197 1.00 0.00 C ATOM 985 C ARG A 67 8.720 1.035 -10.410 1.00 0.00 C ATOM 986 O ARG A 67 9.927 0.801 -10.336 1.00 0.00 O ATOM 987 CB ARG A 67 7.965 1.914 -12.683 1.00 0.00 C ATOM 988 CG ARG A 67 9.211 1.356 -13.385 1.00 0.00 C ATOM 989 CD ARG A 67 9.034 -0.127 -13.714 1.00 0.00 C ATOM 990 NE ARG A 67 8.282 -0.234 -14.974 1.00 0.00 N ATOM 991 CZ ARG A 67 7.758 -1.339 -15.506 1.00 0.00 C ATOM 992 NH1 ARG A 67 7.769 -2.502 -14.867 1.00 0.00 N ATOM 993 NH2 ARG A 67 7.165 -1.274 -16.687 1.00 0.00 N ATOM 0 H ARG A 67 10.047 3.204 -11.402 1.00 0.00 H new ATOM 0 HA ARG A 67 7.212 2.498 -10.782 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.155 1.191 -12.771 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.643 2.818 -13.199 1.00 0.00 H new ATOM 0 HG2 ARG A 67 9.399 1.916 -14.301 1.00 0.00 H new ATOM 0 HG3 ARG A 67 10.084 1.489 -12.746 1.00 0.00 H new ATOM 0 HD2 ARG A 67 10.005 -0.613 -13.809 1.00 0.00 H new ATOM 0 HD3 ARG A 67 8.501 -0.633 -12.909 1.00 0.00 H new ATOM 0 HE ARG A 67 8.147 0.631 -15.498 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.187 -2.570 -13.939 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.359 -3.328 -15.304 1.00 0.00 H new ATOM 0 HH21 ARG A 67 7.112 -0.384 -17.183 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.761 -2.114 -17.102 1.00 0.00 H new ATOM 1007 N ARG A 68 7.785 0.360 -9.764 1.00 0.00 N ATOM 1008 CA ARG A 68 8.051 -0.875 -9.007 1.00 0.00 C ATOM 1009 C ARG A 68 7.078 -1.997 -9.368 1.00 0.00 C ATOM 1010 O ARG A 68 5.952 -1.743 -9.797 1.00 0.00 O ATOM 1011 CB ARG A 68 7.996 -0.572 -7.511 1.00 0.00 C ATOM 1012 CG ARG A 68 9.403 -0.315 -6.972 1.00 0.00 C ATOM 1013 CD ARG A 68 9.351 0.435 -5.639 1.00 0.00 C ATOM 1014 NE ARG A 68 9.270 1.889 -5.873 1.00 0.00 N ATOM 1015 CZ ARG A 68 10.298 2.701 -6.152 1.00 0.00 C ATOM 1016 NH1 ARG A 68 11.540 2.245 -6.258 1.00 0.00 N ATOM 1017 NH2 ARG A 68 10.095 3.995 -6.326 1.00 0.00 N ATOM 0 H ARG A 68 6.807 0.648 -9.743 1.00 0.00 H new ATOM 0 HA ARG A 68 9.047 -1.228 -9.275 1.00 0.00 H new ATOM 0 HB2 ARG A 68 7.365 0.299 -7.332 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.542 -1.409 -6.980 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.924 -1.263 -6.840 1.00 0.00 H new ATOM 0 HG3 ARG A 68 9.974 0.265 -7.697 1.00 0.00 H new ATOM 0 HD2 ARG A 68 8.488 0.104 -5.061 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.238 0.204 -5.049 1.00 0.00 H new ATOM 0 HE ARG A 68 8.345 2.316 -5.817 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.732 1.252 -6.126 1.00 0.00 H new ATOM 0 HH12 ARG A 68 12.303 2.888 -6.471 1.00 0.00 H new ATOM 0 HH21 ARG A 68 9.153 4.378 -6.248 1.00 0.00 H new ATOM 0 HH22 ARG A 68 10.880 4.610 -6.538 1.00 0.00 H new ATOM 1031 N HIS A 69 7.570 -3.213 -9.160 1.00 0.00 N ATOM 1032 CA HIS A 69 6.816 -4.456 -9.387 1.00 0.00 C ATOM 1033 C HIS A 69 6.918 -5.346 -8.140 1.00 0.00 C ATOM 1034 O HIS A 69 7.971 -5.890 -7.815 1.00 0.00 O ATOM 1035 CB HIS A 69 7.321 -5.142 -10.662 1.00 0.00 C ATOM 1036 CG HIS A 69 6.812 -6.579 -10.923 1.00 0.00 C ATOM 1037 ND1 HIS A 69 7.536 -7.504 -11.526 1.00 0.00 N ATOM 1038 CD2 HIS A 69 5.729 -7.166 -10.423 1.00 0.00 C ATOM 1039 CE1 HIS A 69 6.922 -8.682 -11.367 1.00 0.00 C ATOM 1040 NE2 HIS A 69 5.814 -8.472 -10.668 1.00 0.00 N ATOM 0 H HIS A 69 8.519 -3.373 -8.823 1.00 0.00 H new ATOM 0 HA HIS A 69 5.758 -4.244 -9.544 1.00 0.00 H new ATOM 0 HB2 HIS A 69 7.044 -4.522 -11.515 1.00 0.00 H new ATOM 0 HB3 HIS A 69 8.410 -5.167 -10.627 1.00 0.00 H new ATOM 0 HD2 HIS A 69 4.920 -6.670 -9.907 1.00 0.00 H new ATOM 0 HE1 HIS A 69 7.267 -9.635 -11.741 1.00 0.00 H new ATOM 0 HE2 HIS A 69 5.147 -9.184 -10.371 1.00 0.00 H new ATOM 1048 N TYR A 70 5.769 -5.477 -7.497 1.00 0.00 N ATOM 1049 CA TYR A 70 5.585 -6.297 -6.291 1.00 0.00 C ATOM 1050 C TYR A 70 4.685 -7.505 -6.605 1.00 0.00 C ATOM 1051 O TYR A 70 3.477 -7.343 -6.771 1.00 0.00 O ATOM 1052 CB TYR A 70 5.006 -5.461 -5.144 1.00 0.00 C ATOM 1053 CG TYR A 70 6.027 -4.456 -4.607 1.00 0.00 C ATOM 1054 CD1 TYR A 70 7.096 -4.911 -3.843 1.00 0.00 C ATOM 1055 CD2 TYR A 70 5.898 -3.101 -4.881 1.00 0.00 C ATOM 1056 CE1 TYR A 70 8.028 -4.016 -3.342 1.00 0.00 C ATOM 1057 CE2 TYR A 70 6.823 -2.200 -4.372 1.00 0.00 C ATOM 1058 CZ TYR A 70 7.877 -2.656 -3.587 1.00 0.00 C ATOM 1059 OH TYR A 70 8.642 -1.771 -2.901 1.00 0.00 O ATOM 0 H TYR A 70 4.914 -5.009 -7.799 1.00 0.00 H new ATOM 0 HA TYR A 70 6.559 -6.667 -5.970 1.00 0.00 H new ATOM 0 HB2 TYR A 70 4.120 -4.930 -5.492 1.00 0.00 H new ATOM 0 HB3 TYR A 70 4.686 -6.121 -4.338 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.200 -5.966 -3.639 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.079 -2.748 -5.490 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.867 -4.373 -2.764 1.00 0.00 H new ATOM 0 HE2 TYR A 70 6.725 -1.146 -4.585 1.00 0.00 H new ATOM 0 HH TYR A 70 9.501 -2.186 -2.676 1.00 0.00 H new ATOM 1069 N PRO A 71 5.280 -8.679 -6.840 1.00 0.00 N ATOM 1070 CA PRO A 71 4.498 -9.900 -7.096 1.00 0.00 C ATOM 1071 C PRO A 71 3.749 -10.320 -5.828 1.00 0.00 C ATOM 1072 O PRO A 71 4.225 -10.135 -4.710 1.00 0.00 O ATOM 1073 CB PRO A 71 5.522 -10.936 -7.560 1.00 0.00 C ATOM 1074 CG PRO A 71 6.832 -10.488 -6.911 1.00 0.00 C ATOM 1075 CD PRO A 71 6.729 -8.962 -6.852 1.00 0.00 C ATOM 0 HA PRO A 71 3.726 -9.767 -7.854 1.00 0.00 H new ATOM 0 HB2 PRO A 71 5.244 -11.941 -7.242 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.603 -10.957 -8.647 1.00 0.00 H new ATOM 0 HG2 PRO A 71 6.949 -10.917 -5.916 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.694 -10.805 -7.498 1.00 0.00 H new ATOM 0 HD2 PRO A 71 7.216 -8.567 -5.960 1.00 0.00 H new ATOM 0 HD3 PRO A 71 7.215 -8.500 -7.711 1.00 0.00 H new ATOM 1083 N LEU A 72 2.627 -10.997 -6.014 1.00 0.00 N ATOM 1084 CA LEU A 72 1.818 -11.478 -4.876 1.00 0.00 C ATOM 1085 C LEU A 72 2.522 -12.586 -4.061 1.00 0.00 C ATOM 1086 O LEU A 72 2.227 -12.793 -2.889 1.00 0.00 O ATOM 1087 CB LEU A 72 0.472 -11.895 -5.449 1.00 0.00 C ATOM 1088 CG LEU A 72 -0.695 -11.612 -4.512 1.00 0.00 C ATOM 1089 CD1 LEU A 72 -1.903 -11.179 -5.348 1.00 0.00 C ATOM 1090 CD2 LEU A 72 -1.017 -12.881 -3.721 1.00 0.00 C ATOM 0 H LEU A 72 2.247 -11.231 -6.931 1.00 0.00 H new ATOM 0 HA LEU A 72 1.677 -10.687 -4.139 1.00 0.00 H new ATOM 0 HB2 LEU A 72 0.308 -11.372 -6.391 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.496 -12.961 -5.677 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.442 -10.816 -3.812 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.746 -10.973 -4.689 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.653 -10.279 -5.910 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.170 -11.977 -6.041 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.852 -12.688 -3.047 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -1.285 -13.681 -4.411 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.144 -13.179 -3.141 1.00 0.00 H new ATOM 1102 N ASN A 73 3.612 -13.100 -4.634 1.00 0.00 N ATOM 1103 CA ASN A 73 4.555 -14.025 -3.975 1.00 0.00 C ATOM 1104 C ASN A 73 5.281 -13.366 -2.787 1.00 0.00 C ATOM 1105 O ASN A 73 5.884 -14.049 -1.964 1.00 0.00 O ATOM 1106 CB ASN A 73 5.581 -14.488 -5.011 1.00 0.00 C ATOM 1107 CG ASN A 73 5.636 -16.014 -5.052 1.00 0.00 C ATOM 1108 OD1 ASN A 73 4.822 -16.675 -5.683 1.00 0.00 O ATOM 1109 ND2 ASN A 73 6.563 -16.601 -4.332 1.00 0.00 N ATOM 0 H ASN A 73 3.876 -12.883 -5.595 1.00 0.00 H new ATOM 0 HA ASN A 73 3.990 -14.869 -3.579 1.00 0.00 H new ATOM 0 HB2 ASN A 73 5.316 -14.100 -5.995 1.00 0.00 H new ATOM 0 HB3 ASN A 73 6.564 -14.088 -4.764 1.00 0.00 H new ATOM 0 HD21 ASN A 73 6.611 -17.619 -4.294 1.00 0.00 H new ATOM 0 HD22 ASN A 73 7.236 -16.039 -3.811 1.00 0.00 H new ATOM 1116 N THR A 74 5.330 -12.035 -2.820 1.00 0.00 N ATOM 1117 CA THR A 74 5.959 -11.203 -1.776 1.00 0.00 C ATOM 1118 C THR A 74 4.904 -10.565 -0.860 1.00 0.00 C ATOM 1119 O THR A 74 5.051 -10.599 0.359 1.00 0.00 O ATOM 1120 CB THR A 74 6.875 -10.111 -2.360 1.00 0.00 C ATOM 1121 OG1 THR A 74 6.113 -9.100 -3.025 1.00 0.00 O ATOM 1122 CG2 THR A 74 7.926 -10.705 -3.302 1.00 0.00 C ATOM 0 H THR A 74 4.929 -11.488 -3.582 1.00 0.00 H new ATOM 0 HA THR A 74 6.582 -11.876 -1.187 1.00 0.00 H new ATOM 0 HB THR A 74 7.400 -9.647 -1.525 1.00 0.00 H new ATOM 0 HG1 THR A 74 5.510 -9.519 -3.674 1.00 0.00 H new ATOM 0 HG21 THR A 74 8.555 -9.906 -3.696 1.00 0.00 H new ATOM 0 HG22 THR A 74 8.544 -11.417 -2.755 1.00 0.00 H new ATOM 0 HG23 THR A 74 7.429 -11.215 -4.127 1.00 0.00 H new ATOM 1130 N VAL A 75 3.829 -10.053 -1.460 1.00 0.00 N ATOM 1131 CA VAL A 75 2.710 -9.405 -0.748 1.00 0.00 C ATOM 1132 C VAL A 75 1.881 -10.491 -0.039 1.00 0.00 C ATOM 1133 O VAL A 75 0.982 -11.102 -0.607 1.00 0.00 O ATOM 1134 CB VAL A 75 1.861 -8.539 -1.704 1.00 0.00 C ATOM 1135 CG1 VAL A 75 0.739 -7.808 -0.956 1.00 0.00 C ATOM 1136 CG2 VAL A 75 2.705 -7.495 -2.445 1.00 0.00 C ATOM 0 H VAL A 75 3.702 -10.074 -2.472 1.00 0.00 H new ATOM 0 HA VAL A 75 3.098 -8.719 0.005 1.00 0.00 H new ATOM 0 HB VAL A 75 1.433 -9.232 -2.428 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.162 -7.209 -1.661 1.00 0.00 H new ATOM 0 HG12 VAL A 75 0.084 -8.537 -0.479 1.00 0.00 H new ATOM 0 HG13 VAL A 75 1.172 -7.158 -0.196 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.064 -6.911 -3.105 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.181 -6.833 -1.722 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.471 -7.998 -3.035 1.00 0.00 H new ATOM 1146 N THR A 76 2.257 -10.695 1.215 1.00 0.00 N ATOM 1147 CA THR A 76 1.657 -11.684 2.136 1.00 0.00 C ATOM 1148 C THR A 76 0.250 -11.237 2.563 1.00 0.00 C ATOM 1149 O THR A 76 -0.695 -12.021 2.588 1.00 0.00 O ATOM 1150 CB THR A 76 2.545 -11.899 3.379 1.00 0.00 C ATOM 1151 OG1 THR A 76 2.692 -10.690 4.133 1.00 0.00 O ATOM 1152 CG2 THR A 76 3.931 -12.441 3.009 1.00 0.00 C ATOM 0 H THR A 76 3.014 -10.164 1.647 1.00 0.00 H new ATOM 0 HA THR A 76 1.581 -12.632 1.604 1.00 0.00 H new ATOM 0 HB THR A 76 2.037 -12.642 3.993 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.774 -9.930 3.520 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.522 -12.577 3.915 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.823 -13.398 2.499 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.434 -11.733 2.350 1.00 0.00 H new ATOM 1160 N PHE A 77 0.161 -9.962 2.925 1.00 0.00 N ATOM 1161 CA PHE A 77 -1.087 -9.310 3.356 1.00 0.00 C ATOM 1162 C PHE A 77 -1.230 -7.945 2.683 1.00 0.00 C ATOM 1163 O PHE A 77 -0.227 -7.276 2.458 1.00 0.00 O ATOM 1164 CB PHE A 77 -1.023 -9.141 4.872 1.00 0.00 C ATOM 1165 CG PHE A 77 -2.298 -9.684 5.506 1.00 0.00 C ATOM 1166 CD1 PHE A 77 -2.454 -11.053 5.685 1.00 0.00 C ATOM 1167 CD2 PHE A 77 -3.299 -8.809 5.907 1.00 0.00 C ATOM 1168 CE1 PHE A 77 -3.603 -11.545 6.284 1.00 0.00 C ATOM 1169 CE2 PHE A 77 -4.439 -9.302 6.522 1.00 0.00 C ATOM 1170 CZ PHE A 77 -4.597 -10.669 6.706 1.00 0.00 C ATOM 0 H PHE A 77 0.965 -9.334 2.930 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.948 -9.917 3.075 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.155 -9.668 5.270 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.900 -8.088 5.125 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.681 -11.733 5.358 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.189 -7.748 5.740 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -3.726 -12.609 6.423 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -5.206 -8.621 6.859 1.00 0.00 H new ATOM 0 HZ PHE A 77 -5.491 -11.052 7.176 1.00 0.00 H new ATOM 1180 N CYS A 78 -2.470 -7.520 2.475 1.00 0.00 N ATOM 1181 CA CYS A 78 -2.790 -6.225 1.841 1.00 0.00 C ATOM 1182 C CYS A 78 -4.143 -5.690 2.322 1.00 0.00 C ATOM 1183 O CYS A 78 -5.197 -6.004 1.774 1.00 0.00 O ATOM 1184 CB CYS A 78 -2.716 -6.348 0.310 1.00 0.00 C ATOM 1185 SG CYS A 78 -3.462 -7.871 -0.383 1.00 0.00 S ATOM 0 H CYS A 78 -3.294 -8.059 2.739 1.00 0.00 H new ATOM 0 HA CYS A 78 -2.044 -5.491 2.146 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -3.212 -5.485 -0.133 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -1.670 -6.304 0.007 1.00 0.00 H new ATOM 0 HG CYS A 78 -4.658 -8.027 0.101 1.00 0.00 H new ATOM 1191 N ASP A 79 -4.068 -4.987 3.450 1.00 0.00 N ATOM 1192 CA ASP A 79 -5.252 -4.454 4.152 1.00 0.00 C ATOM 1193 C ASP A 79 -5.025 -3.042 4.710 1.00 0.00 C ATOM 1194 O ASP A 79 -3.897 -2.594 4.897 1.00 0.00 O ATOM 1195 CB ASP A 79 -5.761 -5.392 5.257 1.00 0.00 C ATOM 1196 CG ASP A 79 -6.576 -6.606 4.779 1.00 0.00 C ATOM 1197 OD1 ASP A 79 -7.070 -6.599 3.634 1.00 0.00 O ATOM 1198 OD2 ASP A 79 -6.774 -7.495 5.631 1.00 0.00 O ATOM 0 H ASP A 79 -3.185 -4.766 3.911 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.029 -4.389 3.390 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.903 -5.754 5.824 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -6.377 -4.812 5.945 1.00 0.00 H new ATOM 1203 N LEU A 80 -6.123 -2.333 4.950 1.00 0.00 N ATOM 1204 CA LEU A 80 -6.053 -1.007 5.598 1.00 0.00 C ATOM 1205 C LEU A 80 -5.620 -1.148 7.055 1.00 0.00 C ATOM 1206 O LEU A 80 -5.665 -2.235 7.633 1.00 0.00 O ATOM 1207 CB LEU A 80 -7.391 -0.267 5.580 1.00 0.00 C ATOM 1208 CG LEU A 80 -7.487 0.687 4.395 1.00 0.00 C ATOM 1209 CD1 LEU A 80 -7.819 -0.092 3.137 1.00 0.00 C ATOM 1210 CD2 LEU A 80 -8.517 1.781 4.659 1.00 0.00 C ATOM 0 H LEU A 80 -7.066 -2.640 4.713 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.326 -0.432 5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.206 -0.989 5.534 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.512 0.291 6.508 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.523 1.177 4.255 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.887 0.593 2.292 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.036 -0.826 2.947 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.773 -0.603 3.267 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.567 2.449 3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.495 1.328 4.824 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.226 2.349 5.543 1.00 0.00 H new ATOM 1222 N ASP A 81 -5.206 -0.027 7.629 1.00 0.00 N ATOM 1223 CA ASP A 81 -4.836 -0.014 9.052 1.00 0.00 C ATOM 1224 C ASP A 81 -6.027 -0.377 9.967 1.00 0.00 C ATOM 1225 O ASP A 81 -7.131 0.114 9.735 1.00 0.00 O ATOM 1226 CB ASP A 81 -4.258 1.340 9.448 1.00 0.00 C ATOM 1227 CG ASP A 81 -5.253 2.463 9.749 1.00 0.00 C ATOM 1228 OD1 ASP A 81 -6.290 2.546 9.059 1.00 0.00 O ATOM 1229 OD2 ASP A 81 -4.950 3.229 10.684 1.00 0.00 O ATOM 0 H ASP A 81 -5.116 0.870 7.151 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.072 -0.779 9.190 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.634 1.196 10.330 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.602 1.676 8.645 1.00 0.00 H new ATOM 1234 N PRO A 82 -5.760 -1.053 11.088 1.00 0.00 N ATOM 1235 CA PRO A 82 -6.789 -1.318 12.111 1.00 0.00 C ATOM 1236 C PRO A 82 -7.181 -0.065 12.912 1.00 0.00 C ATOM 1237 O PRO A 82 -8.340 0.082 13.282 1.00 0.00 O ATOM 1238 CB PRO A 82 -6.197 -2.427 12.976 1.00 0.00 C ATOM 1239 CG PRO A 82 -4.693 -2.182 12.885 1.00 0.00 C ATOM 1240 CD PRO A 82 -4.480 -1.692 11.451 1.00 0.00 C ATOM 0 HA PRO A 82 -7.735 -1.623 11.662 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -6.552 -2.367 14.005 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -6.466 -3.415 12.603 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.365 -1.439 13.613 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -4.128 -3.093 13.083 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.652 -0.986 11.391 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -4.244 -2.518 10.780 1.00 0.00 H new ATOM 1248 N GLN A 83 -6.235 0.865 13.072 1.00 0.00 N ATOM 1249 CA GLN A 83 -6.469 2.172 13.721 1.00 0.00 C ATOM 1250 C GLN A 83 -7.502 3.057 13.001 1.00 0.00 C ATOM 1251 O GLN A 83 -7.984 4.034 13.569 1.00 0.00 O ATOM 1252 CB GLN A 83 -5.141 2.927 13.863 1.00 0.00 C ATOM 1253 CG GLN A 83 -4.214 2.343 14.937 1.00 0.00 C ATOM 1254 CD GLN A 83 -4.731 2.527 16.370 1.00 0.00 C ATOM 1255 OE1 GLN A 83 -5.512 3.407 16.704 1.00 0.00 O ATOM 1256 NE2 GLN A 83 -4.275 1.691 17.275 1.00 0.00 N ATOM 0 H GLN A 83 -5.274 0.737 12.754 1.00 0.00 H new ATOM 0 HA GLN A 83 -6.893 1.952 14.701 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -4.623 2.918 12.904 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -5.349 3.970 14.103 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -4.076 1.279 14.745 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -3.234 2.812 14.852 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -3.623 0.954 17.006 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -4.573 1.779 18.247 1.00 0.00 H new ATOM 1265 N GLU A 84 -7.748 2.756 11.720 1.00 0.00 N ATOM 1266 CA GLU A 84 -8.685 3.493 10.848 1.00 0.00 C ATOM 1267 C GLU A 84 -8.330 4.986 10.745 1.00 0.00 C ATOM 1268 O GLU A 84 -9.179 5.865 10.843 1.00 0.00 O ATOM 1269 CB GLU A 84 -10.126 3.268 11.326 1.00 0.00 C ATOM 1270 CG GLU A 84 -10.717 1.961 10.795 1.00 0.00 C ATOM 1271 CD GLU A 84 -11.737 2.221 9.681 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -12.569 3.142 9.843 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -11.712 1.443 8.701 1.00 0.00 O ATOM 0 H GLU A 84 -7.293 1.976 11.245 1.00 0.00 H new ATOM 0 HA GLU A 84 -8.596 3.099 9.836 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -10.147 3.257 12.416 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -10.748 4.103 11.003 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -9.917 1.325 10.417 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.196 1.419 11.610 1.00 0.00 H new ATOM 1280 N ARG A 85 -7.026 5.225 10.672 1.00 0.00 N ATOM 1281 CA ARG A 85 -6.459 6.570 10.526 1.00 0.00 C ATOM 1282 C ARG A 85 -6.440 6.992 9.054 1.00 0.00 C ATOM 1283 O ARG A 85 -6.834 6.249 8.151 1.00 0.00 O ATOM 1284 CB ARG A 85 -5.062 6.626 11.146 1.00 0.00 C ATOM 1285 CG ARG A 85 -5.124 6.537 12.671 1.00 0.00 C ATOM 1286 CD ARG A 85 -4.069 7.436 13.320 1.00 0.00 C ATOM 1287 NE ARG A 85 -2.909 6.674 13.819 1.00 0.00 N ATOM 1288 CZ ARG A 85 -1.878 7.194 14.494 1.00 0.00 C ATOM 1289 NH1 ARG A 85 -1.771 8.501 14.702 1.00 0.00 N ATOM 1290 NH2 ARG A 85 -0.917 6.414 14.962 1.00 0.00 N ATOM 0 H ARG A 85 -6.322 4.488 10.712 1.00 0.00 H new ATOM 0 HA ARG A 85 -7.091 7.279 11.061 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -4.457 5.807 10.757 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.570 7.554 10.854 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -6.116 6.829 13.015 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -4.969 5.505 12.985 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -3.730 8.175 12.594 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -4.522 7.985 14.146 1.00 0.00 H new ATOM 0 HE ARG A 85 -2.892 5.671 13.635 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -2.486 9.135 14.344 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -0.974 8.871 15.220 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -0.958 5.406 14.809 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -0.135 6.820 15.475 1.00 0.00 H new ATOM 1304 N LYS A 86 -6.025 8.232 8.853 1.00 0.00 N ATOM 1305 CA LYS A 86 -5.986 8.844 7.521 1.00 0.00 C ATOM 1306 C LYS A 86 -4.667 9.603 7.379 1.00 0.00 C ATOM 1307 O LYS A 86 -4.130 10.114 8.363 1.00 0.00 O ATOM 1308 CB LYS A 86 -7.187 9.777 7.380 1.00 0.00 C ATOM 1309 CG LYS A 86 -8.519 9.010 7.368 1.00 0.00 C ATOM 1310 CD LYS A 86 -9.483 9.484 8.464 1.00 0.00 C ATOM 1311 CE LYS A 86 -9.440 8.665 9.751 1.00 0.00 C ATOM 1312 NZ LYS A 86 -9.018 9.440 10.927 1.00 0.00 N ATOM 0 H LYS A 86 -5.705 8.847 9.601 1.00 0.00 H new ATOM 0 HA LYS A 86 -6.041 8.092 6.733 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.188 10.492 8.203 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -7.092 10.352 6.459 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -8.994 9.130 6.394 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.322 7.946 7.498 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.256 10.523 8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -10.499 9.462 8.069 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.428 8.245 9.938 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.758 7.826 9.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -9.011 8.824 11.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -8.063 9.819 10.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.681 10.226 11.081 1.00 0.00 H new ATOM 1326 N TRP A 87 -4.096 9.506 6.186 1.00 0.00 N ATOM 1327 CA TRP A 87 -2.851 10.229 5.878 1.00 0.00 C ATOM 1328 C TRP A 87 -3.099 11.740 5.981 1.00 0.00 C ATOM 1329 O TRP A 87 -4.223 12.218 5.812 1.00 0.00 O ATOM 1330 CB TRP A 87 -2.348 9.850 4.485 1.00 0.00 C ATOM 1331 CG TRP A 87 -0.978 10.460 4.152 1.00 0.00 C ATOM 1332 CD1 TRP A 87 -0.715 11.335 3.182 1.00 0.00 C ATOM 1333 CD2 TRP A 87 0.217 10.168 4.781 1.00 0.00 C ATOM 1334 NE1 TRP A 87 0.591 11.609 3.184 1.00 0.00 N ATOM 1335 CE2 TRP A 87 1.194 10.930 4.148 1.00 0.00 C ATOM 1336 CE3 TRP A 87 0.572 9.252 5.759 1.00 0.00 C ATOM 1337 CZ2 TRP A 87 2.528 10.779 4.504 1.00 0.00 C ATOM 1338 CZ3 TRP A 87 1.900 9.146 6.153 1.00 0.00 C ATOM 1339 CH2 TRP A 87 2.878 9.904 5.526 1.00 0.00 C ATOM 0 H TRP A 87 -4.463 8.943 5.418 1.00 0.00 H new ATOM 0 HA TRP A 87 -2.082 9.950 6.598 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -2.283 8.764 4.412 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -3.075 10.177 3.741 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -1.442 11.755 2.503 1.00 0.00 H new ATOM 0 HE1 TRP A 87 1.056 12.247 2.538 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -0.180 8.624 6.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 3.292 11.341 3.988 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 2.172 8.471 6.951 1.00 0.00 H new ATOM 0 HH2 TRP A 87 3.910 9.815 5.831 1.00 0.00 H new ATOM 1350 N THR A 88 -1.999 12.441 6.218 1.00 0.00 N ATOM 1351 CA THR A 88 -1.959 13.915 6.332 1.00 0.00 C ATOM 1352 C THR A 88 -2.654 14.609 5.159 1.00 0.00 C ATOM 1353 O THR A 88 -3.428 15.541 5.376 1.00 0.00 O ATOM 1354 CB THR A 88 -0.506 14.402 6.402 1.00 0.00 C ATOM 1355 OG1 THR A 88 0.270 13.776 5.370 1.00 0.00 O ATOM 1356 CG2 THR A 88 0.097 14.152 7.785 1.00 0.00 C ATOM 0 H THR A 88 -1.085 12.004 6.341 1.00 0.00 H new ATOM 0 HA THR A 88 -2.493 14.173 7.247 1.00 0.00 H new ATOM 0 HB THR A 88 -0.492 15.480 6.238 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.196 14.092 5.420 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.127 14.508 7.803 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.484 14.686 8.537 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.078 13.084 8.002 1.00 0.00 H new ATOM 1364 N LYS A 89 -2.417 14.060 3.960 1.00 0.00 N ATOM 1365 CA LYS A 89 -2.975 14.492 2.662 1.00 0.00 C ATOM 1366 C LYS A 89 -2.801 16.010 2.434 1.00 0.00 C ATOM 1367 O LYS A 89 -2.140 16.686 3.218 1.00 0.00 O ATOM 1368 CB LYS A 89 -4.431 14.017 2.488 1.00 0.00 C ATOM 1369 CG LYS A 89 -5.457 14.766 3.352 1.00 0.00 C ATOM 1370 CD LYS A 89 -6.878 14.730 2.798 1.00 0.00 C ATOM 1371 CE LYS A 89 -6.968 15.302 1.379 1.00 0.00 C ATOM 1372 NZ LYS A 89 -8.165 16.132 1.219 1.00 0.00 N ATOM 0 H LYS A 89 -1.796 13.257 3.859 1.00 0.00 H new ATOM 0 HA LYS A 89 -2.397 14.006 1.876 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.711 14.124 1.440 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -4.483 12.954 2.725 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -5.457 14.335 4.353 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -5.143 15.805 3.452 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -7.238 13.701 2.795 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -7.536 15.296 3.457 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -6.079 15.896 1.166 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -6.988 14.487 0.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -8.488 16.088 0.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -8.917 15.781 1.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -7.940 17.117 1.466 1.00 0.00 H new ATOM 1386 N THR A 90 -3.328 16.528 1.326 1.00 0.00 N ATOM 1387 CA THR A 90 -3.278 17.989 1.082 1.00 0.00 C ATOM 1388 C THR A 90 -4.134 18.802 2.073 1.00 0.00 C ATOM 1389 O THR A 90 -3.771 19.913 2.448 1.00 0.00 O ATOM 1390 CB THR A 90 -3.563 18.331 -0.392 1.00 0.00 C ATOM 1391 OG1 THR A 90 -2.769 19.472 -0.708 1.00 0.00 O ATOM 1392 CG2 THR A 90 -5.037 18.568 -0.764 1.00 0.00 C ATOM 0 H THR A 90 -3.785 15.985 0.594 1.00 0.00 H new ATOM 0 HA THR A 90 -2.253 18.302 1.280 1.00 0.00 H new ATOM 0 HB THR A 90 -3.304 17.453 -0.984 1.00 0.00 H new ATOM 0 HG1 THR A 90 -2.918 19.726 -1.643 1.00 0.00 H new ATOM 0 HG21 THR A 90 -5.111 18.800 -1.826 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.616 17.670 -0.548 1.00 0.00 H new ATOM 0 HG23 THR A 90 -5.430 19.402 -0.182 1.00 0.00 H new ATOM 1400 N ASP A 91 -5.225 18.171 2.528 1.00 0.00 N ATOM 1401 CA ASP A 91 -6.261 18.748 3.409 1.00 0.00 C ATOM 1402 C ASP A 91 -7.052 19.863 2.690 1.00 0.00 C ATOM 1403 O ASP A 91 -6.595 20.443 1.707 1.00 0.00 O ATOM 1404 CB ASP A 91 -5.602 19.212 4.724 1.00 0.00 C ATOM 1405 CG ASP A 91 -6.550 19.421 5.906 1.00 0.00 C ATOM 1406 OD1 ASP A 91 -7.658 18.835 5.865 1.00 0.00 O ATOM 1407 OD2 ASP A 91 -6.150 20.158 6.832 1.00 0.00 O ATOM 0 H ASP A 91 -5.422 17.201 2.284 1.00 0.00 H new ATOM 0 HA ASP A 91 -7.002 17.989 3.660 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -4.850 18.477 5.011 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.076 20.148 4.534 1.00 0.00 H new ATOM 1412 N GLY A 92 -8.321 19.989 3.098 1.00 0.00 N ATOM 1413 CA GLY A 92 -9.250 20.983 2.514 1.00 0.00 C ATOM 1414 C GLY A 92 -10.536 20.388 1.918 1.00 0.00 C ATOM 1415 O GLY A 92 -10.873 20.690 0.776 1.00 0.00 O ATOM 0 H GLY A 92 -8.736 19.416 3.833 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.523 21.703 3.286 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -8.726 21.535 1.734 1.00 0.00 H new ATOM 1419 N SER A 93 -11.121 19.453 2.672 1.00 0.00 N ATOM 1420 CA SER A 93 -12.415 18.769 2.418 1.00 0.00 C ATOM 1421 C SER A 93 -12.647 17.623 3.409 1.00 0.00 C ATOM 1422 O SER A 93 -13.342 17.783 4.410 1.00 0.00 O ATOM 1423 CB SER A 93 -12.608 18.213 0.997 1.00 0.00 C ATOM 1424 OG SER A 93 -13.342 19.146 0.209 1.00 0.00 O ATOM 0 H SER A 93 -10.685 19.125 3.534 1.00 0.00 H new ATOM 0 HA SER A 93 -13.146 19.567 2.549 1.00 0.00 H new ATOM 0 HB2 SER A 93 -11.639 18.019 0.538 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.138 17.261 1.038 1.00 0.00 H new ATOM 0 HG SER A 93 -12.822 19.970 0.109 1.00 0.00 H new ATOM 1430 N GLY A 94 -11.869 16.555 3.209 1.00 0.00 N ATOM 1431 CA GLY A 94 -12.029 15.299 3.952 1.00 0.00 C ATOM 1432 C GLY A 94 -10.695 14.541 3.959 1.00 0.00 C ATOM 1433 O GLY A 94 -9.885 14.779 3.065 1.00 0.00 O ATOM 0 H GLY A 94 -11.110 16.536 2.528 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.349 15.505 4.973 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.806 14.688 3.492 1.00 0.00 H new ATOM 1437 N PRO A 95 -10.444 13.717 4.977 1.00 0.00 N ATOM 1438 CA PRO A 95 -9.183 12.963 5.086 1.00 0.00 C ATOM 1439 C PRO A 95 -9.094 11.831 4.050 1.00 0.00 C ATOM 1440 O PRO A 95 -10.104 11.340 3.543 1.00 0.00 O ATOM 1441 CB PRO A 95 -9.186 12.506 6.541 1.00 0.00 C ATOM 1442 CG PRO A 95 -10.666 12.287 6.854 1.00 0.00 C ATOM 1443 CD PRO A 95 -11.351 13.422 6.106 1.00 0.00 C ATOM 0 HA PRO A 95 -8.292 13.547 4.856 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -8.610 11.590 6.673 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.746 13.257 7.197 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -11.010 11.312 6.509 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.862 12.334 7.925 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -12.340 13.127 5.755 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -11.487 14.294 6.745 1.00 0.00 H new ATOM 1451 N ALA A 96 -7.863 11.438 3.740 1.00 0.00 N ATOM 1452 CA ALA A 96 -7.601 10.415 2.713 1.00 0.00 C ATOM 1453 C ALA A 96 -7.165 9.124 3.404 1.00 0.00 C ATOM 1454 O ALA A 96 -6.095 9.056 4.013 1.00 0.00 O ATOM 1455 CB ALA A 96 -6.530 10.898 1.728 1.00 0.00 C ATOM 0 H ALA A 96 -7.023 11.809 4.183 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.510 10.229 2.141 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.352 10.128 0.978 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.871 11.810 1.238 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.605 11.101 2.267 1.00 0.00 H new ATOM 1461 N LYS A 97 -8.132 8.207 3.499 1.00 0.00 N ATOM 1462 CA LYS A 97 -7.911 6.865 4.073 1.00 0.00 C ATOM 1463 C LYS A 97 -6.572 6.270 3.630 1.00 0.00 C ATOM 1464 O LYS A 97 -6.121 6.479 2.508 1.00 0.00 O ATOM 1465 CB LYS A 97 -9.013 5.881 3.675 1.00 0.00 C ATOM 1466 CG LYS A 97 -10.209 5.907 4.627 1.00 0.00 C ATOM 1467 CD LYS A 97 -11.097 4.678 4.401 1.00 0.00 C ATOM 1468 CE LYS A 97 -12.020 4.790 3.183 1.00 0.00 C ATOM 1469 NZ LYS A 97 -13.340 5.291 3.586 1.00 0.00 N ATOM 0 H LYS A 97 -9.089 8.367 3.183 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.917 7.006 5.154 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.354 6.114 2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.600 4.873 3.647 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.860 5.927 5.659 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -10.788 6.817 4.469 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -10.461 3.800 4.283 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -11.705 4.514 5.291 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -11.579 5.460 2.445 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -12.124 3.815 2.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -13.955 5.362 2.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -13.765 4.636 4.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -13.237 6.230 4.020 1.00 0.00 H new ATOM 1483 N LEU A 98 -5.989 5.502 4.526 1.00 0.00 N ATOM 1484 CA LEU A 98 -4.659 4.922 4.301 1.00 0.00 C ATOM 1485 C LEU A 98 -4.710 3.396 4.336 1.00 0.00 C ATOM 1486 O LEU A 98 -5.480 2.780 5.072 1.00 0.00 O ATOM 1487 CB LEU A 98 -3.649 5.502 5.297 1.00 0.00 C ATOM 1488 CG LEU A 98 -4.216 5.630 6.710 1.00 0.00 C ATOM 1489 CD1 LEU A 98 -4.424 4.296 7.394 1.00 0.00 C ATOM 1490 CD2 LEU A 98 -3.249 6.407 7.560 1.00 0.00 C ATOM 0 H LEU A 98 -6.408 5.258 5.423 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.320 5.195 3.302 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.764 4.866 5.322 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.326 6.484 4.950 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.182 6.124 6.608 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.828 4.459 8.393 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.123 3.694 6.813 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.471 3.773 7.469 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.648 6.502 8.570 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -2.293 5.884 7.595 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.104 7.399 7.132 1.00 0.00 H new ATOM 1502 N PHE A 99 -3.892 2.823 3.481 1.00 0.00 N ATOM 1503 CA PHE A 99 -3.822 1.377 3.280 1.00 0.00 C ATOM 1504 C PHE A 99 -2.378 0.951 3.035 1.00 0.00 C ATOM 1505 O PHE A 99 -1.610 1.654 2.381 1.00 0.00 O ATOM 1506 CB PHE A 99 -4.714 0.994 2.096 1.00 0.00 C ATOM 1507 CG PHE A 99 -4.222 1.481 0.741 1.00 0.00 C ATOM 1508 CD1 PHE A 99 -4.580 2.725 0.231 1.00 0.00 C ATOM 1509 CD2 PHE A 99 -3.441 0.598 -0.002 1.00 0.00 C ATOM 1510 CE1 PHE A 99 -4.168 3.078 -1.043 1.00 0.00 C ATOM 1511 CE2 PHE A 99 -3.028 0.948 -1.263 1.00 0.00 C ATOM 1512 CZ PHE A 99 -3.401 2.182 -1.780 1.00 0.00 C ATOM 0 H PHE A 99 -3.244 3.348 2.894 1.00 0.00 H new ATOM 0 HA PHE A 99 -4.176 0.862 4.173 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.805 -0.092 2.065 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.714 1.393 2.269 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -5.173 3.408 0.822 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.162 -0.359 0.413 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.439 4.037 -1.459 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.420 0.272 -1.846 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.088 2.452 -2.778 1.00 0.00 H new ATOM 1522 N GLY A 100 -2.070 -0.215 3.591 1.00 0.00 N ATOM 1523 CA GLY A 100 -0.736 -0.800 3.460 1.00 0.00 C ATOM 1524 C GLY A 100 -0.779 -2.309 3.258 1.00 0.00 C ATOM 1525 O GLY A 100 -1.743 -2.999 3.582 1.00 0.00 O ATOM 0 H GLY A 100 -2.724 -0.776 4.137 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -0.221 -0.338 2.617 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -0.154 -0.572 4.353 1.00 0.00 H new ATOM 1529 N PHE A 101 0.318 -2.797 2.718 1.00 0.00 N ATOM 1530 CA PHE A 101 0.508 -4.244 2.560 1.00 0.00 C ATOM 1531 C PHE A 101 1.843 -4.687 3.155 1.00 0.00 C ATOM 1532 O PHE A 101 2.799 -3.918 3.251 1.00 0.00 O ATOM 1533 CB PHE A 101 0.357 -4.654 1.092 1.00 0.00 C ATOM 1534 CG PHE A 101 1.276 -3.903 0.142 1.00 0.00 C ATOM 1535 CD1 PHE A 101 2.633 -4.192 0.123 1.00 0.00 C ATOM 1536 CD2 PHE A 101 0.751 -2.890 -0.646 1.00 0.00 C ATOM 1537 CE1 PHE A 101 3.483 -3.458 -0.684 1.00 0.00 C ATOM 1538 CE2 PHE A 101 1.602 -2.170 -1.463 1.00 0.00 C ATOM 1539 CZ PHE A 101 2.965 -2.445 -1.484 1.00 0.00 C ATOM 0 H PHE A 101 1.093 -2.227 2.380 1.00 0.00 H new ATOM 0 HA PHE A 101 -0.273 -4.761 3.117 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.553 -5.722 1.002 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.676 -4.493 0.785 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.025 -4.989 0.738 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.306 -2.667 -0.622 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.542 -3.670 -0.693 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.205 -1.386 -2.091 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.622 -1.872 -2.122 1.00 0.00 H new ATOM 1549 N VAL A 102 1.861 -5.953 3.534 1.00 0.00 N ATOM 1550 CA VAL A 102 3.047 -6.628 4.084 1.00 0.00 C ATOM 1551 C VAL A 102 3.624 -7.470 2.941 1.00 0.00 C ATOM 1552 O VAL A 102 2.983 -8.399 2.466 1.00 0.00 O ATOM 1553 CB VAL A 102 2.656 -7.505 5.286 1.00 0.00 C ATOM 1554 CG1 VAL A 102 3.868 -8.197 5.918 1.00 0.00 C ATOM 1555 CG2 VAL A 102 1.952 -6.664 6.352 1.00 0.00 C ATOM 0 H VAL A 102 1.044 -6.560 3.471 1.00 0.00 H new ATOM 0 HA VAL A 102 3.785 -5.914 4.449 1.00 0.00 H new ATOM 0 HB VAL A 102 1.983 -8.274 4.908 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.541 -8.804 6.762 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.350 -8.835 5.177 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.576 -7.445 6.265 1.00 0.00 H new ATOM 0 HG21 VAL A 102 1.682 -7.299 7.196 1.00 0.00 H new ATOM 0 HG22 VAL A 102 2.621 -5.873 6.692 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.051 -6.220 5.929 1.00 0.00 H new ATOM 1565 N ALA A 103 4.737 -6.999 2.409 1.00 0.00 N ATOM 1566 CA ALA A 103 5.443 -7.708 1.326 1.00 0.00 C ATOM 1567 C ALA A 103 6.773 -8.196 1.891 1.00 0.00 C ATOM 1568 O ALA A 103 7.476 -7.376 2.463 1.00 0.00 O ATOM 1569 CB ALA A 103 5.688 -6.752 0.154 1.00 0.00 C ATOM 0 H ALA A 103 5.182 -6.129 2.701 1.00 0.00 H new ATOM 0 HA ALA A 103 4.851 -8.548 0.962 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.210 -7.281 -0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.733 -6.382 -0.220 1.00 0.00 H new ATOM 0 HB3 ALA A 103 6.296 -5.912 0.491 1.00 0.00 H new ATOM 1575 N ARG A 104 6.939 -9.513 1.984 1.00 0.00 N ATOM 1576 CA ARG A 104 8.183 -10.179 2.438 1.00 0.00 C ATOM 1577 C ARG A 104 9.412 -9.661 1.649 1.00 0.00 C ATOM 1578 O ARG A 104 9.582 -8.457 1.462 1.00 0.00 O ATOM 1579 CB ARG A 104 7.995 -11.712 2.378 1.00 0.00 C ATOM 1580 CG ARG A 104 7.710 -12.212 0.957 1.00 0.00 C ATOM 1581 CD ARG A 104 8.451 -13.503 0.620 1.00 0.00 C ATOM 1582 NE ARG A 104 8.720 -13.549 -0.829 1.00 0.00 N ATOM 1583 CZ ARG A 104 9.281 -14.564 -1.493 1.00 0.00 C ATOM 1584 NH1 ARG A 104 9.596 -15.693 -0.875 1.00 0.00 N ATOM 1585 NH2 ARG A 104 9.520 -14.475 -2.794 1.00 0.00 N ATOM 0 H ARG A 104 6.201 -10.174 1.742 1.00 0.00 H new ATOM 0 HA ARG A 104 8.387 -9.925 3.478 1.00 0.00 H new ATOM 0 HB2 ARG A 104 8.892 -12.200 2.759 1.00 0.00 H new ATOM 0 HB3 ARG A 104 7.173 -12.000 3.033 1.00 0.00 H new ATOM 0 HG2 ARG A 104 6.638 -12.374 0.843 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.993 -11.440 0.242 1.00 0.00 H new ATOM 0 HD2 ARG A 104 9.387 -13.554 1.177 1.00 0.00 H new ATOM 0 HD3 ARG A 104 7.855 -14.366 0.918 1.00 0.00 H new ATOM 0 HE ARG A 104 8.453 -12.730 -1.375 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.411 -15.797 0.123 1.00 0.00 H new ATOM 0 HH12 ARG A 104 10.024 -16.458 -1.397 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.275 -13.624 -3.300 1.00 0.00 H new ATOM 0 HH22 ARG A 104 9.949 -15.257 -3.288 1.00 0.00 H new ATOM 1599 N LYS A 105 10.300 -10.543 1.204 1.00 0.00 N ATOM 1600 CA LYS A 105 11.417 -10.134 0.346 1.00 0.00 C ATOM 1601 C LYS A 105 11.396 -10.994 -0.910 1.00 0.00 C ATOM 1602 O LYS A 105 11.287 -12.213 -0.804 1.00 0.00 O ATOM 1603 CB LYS A 105 12.730 -10.366 1.077 1.00 0.00 C ATOM 1604 CG LYS A 105 13.652 -9.162 0.993 1.00 0.00 C ATOM 1605 CD LYS A 105 14.955 -9.519 1.703 1.00 0.00 C ATOM 1606 CE LYS A 105 15.893 -8.315 1.769 1.00 0.00 C ATOM 1607 NZ LYS A 105 16.459 -8.023 0.448 1.00 0.00 N ATOM 0 H LYS A 105 10.273 -11.540 1.419 1.00 0.00 H new ATOM 0 HA LYS A 105 11.324 -9.078 0.091 1.00 0.00 H new ATOM 0 HB2 LYS A 105 12.526 -10.594 2.123 1.00 0.00 H new ATOM 0 HB3 LYS A 105 13.231 -11.236 0.653 1.00 0.00 H new ATOM 0 HG2 LYS A 105 13.844 -8.900 -0.048 1.00 0.00 H new ATOM 0 HG3 LYS A 105 13.189 -8.293 1.460 1.00 0.00 H new ATOM 0 HD2 LYS A 105 14.739 -9.871 2.712 1.00 0.00 H new ATOM 0 HD3 LYS A 105 15.446 -10.338 1.178 1.00 0.00 H new ATOM 0 HE2 LYS A 105 15.350 -7.445 2.137 1.00 0.00 H new ATOM 0 HE3 LYS A 105 16.697 -8.513 2.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 17.093 -7.202 0.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 16.995 -8.847 0.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 15.690 -7.813 -0.220 1.00 0.00 H new ATOM 1621 N GLN A 106 11.734 -10.358 -2.024 1.00 0.00 N ATOM 1622 CA GLN A 106 11.753 -11.006 -3.350 1.00 0.00 C ATOM 1623 C GLN A 106 13.024 -11.864 -3.552 1.00 0.00 C ATOM 1624 O GLN A 106 13.813 -11.670 -4.476 1.00 0.00 O ATOM 1625 CB GLN A 106 11.608 -9.918 -4.416 1.00 0.00 C ATOM 1626 CG GLN A 106 10.898 -10.493 -5.642 1.00 0.00 C ATOM 1627 CD GLN A 106 11.150 -9.653 -6.889 1.00 0.00 C ATOM 1628 OE1 GLN A 106 10.803 -8.485 -6.999 1.00 0.00 O ATOM 1629 NE2 GLN A 106 11.783 -10.271 -7.858 1.00 0.00 N ATOM 0 H GLN A 106 12.005 -9.375 -2.045 1.00 0.00 H new ATOM 0 HA GLN A 106 10.918 -11.702 -3.433 1.00 0.00 H new ATOM 0 HB2 GLN A 106 11.042 -9.077 -4.017 1.00 0.00 H new ATOM 0 HB3 GLN A 106 12.590 -9.537 -4.697 1.00 0.00 H new ATOM 0 HG2 GLN A 106 11.241 -11.513 -5.816 1.00 0.00 H new ATOM 0 HG3 GLN A 106 9.826 -10.546 -5.450 1.00 0.00 H new ATOM 0 HE21 GLN A 106 12.063 -11.245 -7.744 1.00 0.00 H new ATOM 0 HE22 GLN A 106 11.995 -9.777 -8.725 1.00 0.00 H new ATOM 1638 N GLY A 107 13.200 -12.789 -2.603 1.00 0.00 N ATOM 1639 CA GLY A 107 14.349 -13.711 -2.535 1.00 0.00 C ATOM 1640 C GLY A 107 14.307 -14.632 -1.305 1.00 0.00 C ATOM 1641 O GLY A 107 14.554 -15.829 -1.420 1.00 0.00 O ATOM 0 H GLY A 107 12.535 -12.924 -1.841 1.00 0.00 H new ATOM 0 HA2 GLY A 107 14.373 -14.321 -3.438 1.00 0.00 H new ATOM 0 HA3 GLY A 107 15.272 -13.132 -2.517 1.00 0.00 H new ATOM 1645 N SER A 108 13.916 -14.070 -0.162 1.00 0.00 N ATOM 1646 CA SER A 108 13.844 -14.812 1.112 1.00 0.00 C ATOM 1647 C SER A 108 12.850 -14.134 2.056 1.00 0.00 C ATOM 1648 O SER A 108 12.980 -12.949 2.353 1.00 0.00 O ATOM 1649 CB SER A 108 15.222 -14.855 1.785 1.00 0.00 C ATOM 1650 OG SER A 108 15.144 -15.672 2.954 1.00 0.00 O ATOM 0 H SER A 108 13.639 -13.091 -0.085 1.00 0.00 H new ATOM 0 HA SER A 108 13.515 -15.829 0.898 1.00 0.00 H new ATOM 0 HB2 SER A 108 15.965 -15.255 1.095 1.00 0.00 H new ATOM 0 HB3 SER A 108 15.543 -13.848 2.051 1.00 0.00 H new ATOM 0 HG SER A 108 16.022 -15.706 3.389 1.00 0.00 H new ATOM 1656 N THR A 109 11.916 -14.926 2.572 1.00 0.00 N ATOM 1657 CA THR A 109 10.862 -14.478 3.516 1.00 0.00 C ATOM 1658 C THR A 109 11.398 -14.196 4.940 1.00 0.00 C ATOM 1659 O THR A 109 11.063 -14.836 5.933 1.00 0.00 O ATOM 1660 CB THR A 109 9.661 -15.445 3.495 1.00 0.00 C ATOM 1661 OG1 THR A 109 8.619 -14.929 4.328 1.00 0.00 O ATOM 1662 CG2 THR A 109 10.012 -16.901 3.835 1.00 0.00 C ATOM 0 H THR A 109 11.857 -15.920 2.350 1.00 0.00 H new ATOM 0 HA THR A 109 10.502 -13.511 3.165 1.00 0.00 H new ATOM 0 HB THR A 109 9.309 -15.495 2.464 1.00 0.00 H new ATOM 0 HG1 THR A 109 7.855 -15.542 4.314 1.00 0.00 H new ATOM 0 HG21 THR A 109 9.110 -17.511 3.797 1.00 0.00 H new ATOM 0 HG22 THR A 109 10.736 -17.279 3.113 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.440 -16.948 4.837 1.00 0.00 H new ATOM 1670 N THR A 110 12.443 -13.385 4.961 1.00 0.00 N ATOM 1671 CA THR A 110 13.165 -13.002 6.194 1.00 0.00 C ATOM 1672 C THR A 110 13.163 -11.480 6.417 1.00 0.00 C ATOM 1673 O THR A 110 13.462 -10.993 7.503 1.00 0.00 O ATOM 1674 CB THR A 110 14.574 -13.620 6.146 1.00 0.00 C ATOM 1675 OG1 THR A 110 14.408 -15.022 5.914 1.00 0.00 O ATOM 1676 CG2 THR A 110 15.385 -13.432 7.434 1.00 0.00 C ATOM 0 H THR A 110 12.830 -12.961 4.118 1.00 0.00 H new ATOM 0 HA THR A 110 12.648 -13.401 7.067 1.00 0.00 H new ATOM 0 HB THR A 110 15.132 -13.114 5.359 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.652 -15.232 4.988 1.00 0.00 H new ATOM 0 HG21 THR A 110 16.365 -13.896 7.318 1.00 0.00 H new ATOM 0 HG22 THR A 110 15.509 -12.368 7.634 1.00 0.00 H new ATOM 0 HG23 THR A 110 14.859 -13.899 8.267 1.00 0.00 H new ATOM 1684 N ASP A 111 12.797 -10.728 5.383 1.00 0.00 N ATOM 1685 CA ASP A 111 12.688 -9.269 5.496 1.00 0.00 C ATOM 1686 C ASP A 111 11.473 -8.774 4.711 1.00 0.00 C ATOM 1687 O ASP A 111 11.435 -8.907 3.496 1.00 0.00 O ATOM 1688 CB ASP A 111 13.983 -8.653 4.967 1.00 0.00 C ATOM 1689 CG ASP A 111 14.196 -7.201 5.391 1.00 0.00 C ATOM 1690 OD1 ASP A 111 13.183 -6.526 5.696 1.00 0.00 O ATOM 1691 OD2 ASP A 111 15.378 -6.810 5.451 1.00 0.00 O ATOM 0 H ASP A 111 12.571 -11.098 4.460 1.00 0.00 H new ATOM 0 HA ASP A 111 12.547 -8.972 6.535 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.826 -9.250 5.314 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.981 -8.707 3.878 1.00 0.00 H new ATOM 1696 N ASN A 112 10.452 -8.360 5.446 1.00 0.00 N ATOM 1697 CA ASN A 112 9.247 -7.766 4.845 1.00 0.00 C ATOM 1698 C ASN A 112 9.312 -6.233 4.929 1.00 0.00 C ATOM 1699 O ASN A 112 9.961 -5.669 5.811 1.00 0.00 O ATOM 1700 CB ASN A 112 7.975 -8.312 5.519 1.00 0.00 C ATOM 1701 CG ASN A 112 7.660 -7.596 6.829 1.00 0.00 C ATOM 1702 OD1 ASN A 112 8.351 -7.772 7.821 1.00 0.00 O ATOM 1703 ND2 ASN A 112 6.739 -6.654 6.757 1.00 0.00 N ATOM 0 H ASN A 112 10.425 -8.421 6.464 1.00 0.00 H new ATOM 0 HA ASN A 112 9.206 -8.046 3.792 1.00 0.00 H new ATOM 0 HB2 ASN A 112 7.131 -8.205 4.837 1.00 0.00 H new ATOM 0 HB3 ASN A 112 8.097 -9.378 5.711 1.00 0.00 H new ATOM 0 HD21 ASN A 112 6.580 -6.035 7.552 1.00 0.00 H new ATOM 0 HD22 ASN A 112 6.186 -6.545 5.907 1.00 0.00 H new ATOM 1710 N VAL A 113 8.507 -5.618 4.080 1.00 0.00 N ATOM 1711 CA VAL A 113 8.292 -4.173 4.022 1.00 0.00 C ATOM 1712 C VAL A 113 6.786 -3.864 3.992 1.00 0.00 C ATOM 1713 O VAL A 113 6.029 -4.455 3.217 1.00 0.00 O ATOM 1714 CB VAL A 113 9.110 -3.637 2.834 1.00 0.00 C ATOM 1715 CG1 VAL A 113 8.410 -3.519 1.472 1.00 0.00 C ATOM 1716 CG2 VAL A 113 9.763 -2.341 3.274 1.00 0.00 C ATOM 0 H VAL A 113 7.962 -6.126 3.383 1.00 0.00 H new ATOM 0 HA VAL A 113 8.648 -3.653 4.912 1.00 0.00 H new ATOM 0 HB VAL A 113 9.846 -4.407 2.602 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.111 -3.128 0.735 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.062 -4.502 1.155 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.559 -2.843 1.558 1.00 0.00 H new ATOM 0 HG21 VAL A 113 10.352 -1.933 2.453 1.00 0.00 H new ATOM 0 HG22 VAL A 113 8.993 -1.624 3.559 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.414 -2.533 4.127 1.00 0.00 H new ATOM 1726 N CYS A 114 6.357 -3.102 4.986 1.00 0.00 N ATOM 1727 CA CYS A 114 4.959 -2.654 5.016 1.00 0.00 C ATOM 1728 C CYS A 114 4.865 -1.233 4.451 1.00 0.00 C ATOM 1729 O CYS A 114 5.434 -0.290 4.995 1.00 0.00 O ATOM 1730 CB CYS A 114 4.373 -2.792 6.417 1.00 0.00 C ATOM 1731 SG CYS A 114 2.547 -2.688 6.385 1.00 0.00 S ATOM 0 H CYS A 114 6.932 -2.784 5.766 1.00 0.00 H new ATOM 0 HA CYS A 114 4.349 -3.294 4.379 1.00 0.00 H new ATOM 0 HB2 CYS A 114 4.678 -3.745 6.849 1.00 0.00 H new ATOM 0 HB3 CYS A 114 4.773 -2.008 7.060 1.00 0.00 H new ATOM 0 HG CYS A 114 2.116 -2.982 5.194 1.00 0.00 H new ATOM 1737 N HIS A 115 4.492 -1.217 3.178 1.00 0.00 N ATOM 1738 CA HIS A 115 4.347 0.039 2.423 1.00 0.00 C ATOM 1739 C HIS A 115 2.991 0.667 2.739 1.00 0.00 C ATOM 1740 O HIS A 115 1.994 -0.047 2.822 1.00 0.00 O ATOM 1741 CB HIS A 115 4.413 -0.255 0.930 1.00 0.00 C ATOM 1742 CG HIS A 115 5.320 0.746 0.202 1.00 0.00 C ATOM 1743 ND1 HIS A 115 6.397 0.401 -0.479 1.00 0.00 N ATOM 1744 CD2 HIS A 115 5.249 2.071 0.256 1.00 0.00 C ATOM 1745 CE1 HIS A 115 7.022 1.521 -0.846 1.00 0.00 C ATOM 1746 NE2 HIS A 115 6.321 2.542 -0.373 1.00 0.00 N ATOM 0 H HIS A 115 4.282 -2.057 2.638 1.00 0.00 H new ATOM 0 HA HIS A 115 5.149 0.722 2.703 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.786 -1.267 0.773 1.00 0.00 H new ATOM 0 HB3 HIS A 115 3.410 -0.215 0.505 1.00 0.00 H new ATOM 0 HD2 HIS A 115 4.469 2.655 0.722 1.00 0.00 H new ATOM 0 HE1 HIS A 115 7.933 1.584 -1.423 1.00 0.00 H new ATOM 0 HE2 HIS A 115 6.564 3.527 -0.475 1.00 0.00 H new ATOM 1754 N LEU A 116 3.001 1.977 2.925 1.00 0.00 N ATOM 1755 CA LEU A 116 1.764 2.728 3.197 1.00 0.00 C ATOM 1756 C LEU A 116 1.362 3.579 1.998 1.00 0.00 C ATOM 1757 O LEU A 116 2.190 3.941 1.160 1.00 0.00 O ATOM 1758 CB LEU A 116 1.873 3.604 4.453 1.00 0.00 C ATOM 1759 CG LEU A 116 1.966 2.848 5.787 1.00 0.00 C ATOM 1760 CD1 LEU A 116 0.834 1.835 5.959 1.00 0.00 C ATOM 1761 CD2 LEU A 116 3.343 2.210 5.963 1.00 0.00 C ATOM 0 H LEU A 116 3.844 2.550 2.895 1.00 0.00 H new ATOM 0 HA LEU A 116 0.987 1.986 3.381 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.753 4.240 4.355 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.006 4.263 4.490 1.00 0.00 H new ATOM 0 HG LEU A 116 1.841 3.580 6.585 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.943 1.326 6.917 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.125 2.353 5.930 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.875 1.103 5.153 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.380 1.682 6.916 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.525 1.506 5.151 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.108 2.986 5.949 1.00 0.00 H new ATOM 1773 N PHE A 117 0.056 3.777 1.917 1.00 0.00 N ATOM 1774 CA PHE A 117 -0.580 4.508 0.816 1.00 0.00 C ATOM 1775 C PHE A 117 -1.868 5.194 1.266 1.00 0.00 C ATOM 1776 O PHE A 117 -2.645 4.633 2.029 1.00 0.00 O ATOM 1777 CB PHE A 117 -0.925 3.519 -0.296 1.00 0.00 C ATOM 1778 CG PHE A 117 0.296 2.905 -0.965 1.00 0.00 C ATOM 1779 CD1 PHE A 117 0.979 3.678 -1.894 1.00 0.00 C ATOM 1780 CD2 PHE A 117 0.744 1.626 -0.656 1.00 0.00 C ATOM 1781 CE1 PHE A 117 2.110 3.192 -2.514 1.00 0.00 C ATOM 1782 CE2 PHE A 117 1.890 1.148 -1.270 1.00 0.00 C ATOM 1783 CZ PHE A 117 2.576 1.924 -2.197 1.00 0.00 C ATOM 0 H PHE A 117 -0.604 3.435 2.616 1.00 0.00 H new ATOM 0 HA PHE A 117 0.116 5.271 0.468 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.542 2.721 0.117 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.525 4.028 -1.050 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.621 4.669 -2.133 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.206 1.014 0.053 1.00 0.00 H new ATOM 0 HE1 PHE A 117 2.631 3.795 -3.243 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.255 0.161 -1.026 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.469 1.541 -2.669 1.00 0.00 H new ATOM 1793 N ALA A 118 -2.100 6.381 0.732 1.00 0.00 N ATOM 1794 CA ALA A 118 -3.347 7.127 0.979 1.00 0.00 C ATOM 1795 C ALA A 118 -4.231 7.105 -0.268 1.00 0.00 C ATOM 1796 O ALA A 118 -3.751 7.219 -1.394 1.00 0.00 O ATOM 1797 CB ALA A 118 -3.021 8.574 1.340 1.00 0.00 C ATOM 0 H ALA A 118 -1.442 6.862 0.118 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.879 6.655 1.805 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.946 9.121 1.522 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.405 8.595 2.239 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.479 9.041 0.518 1.00 0.00 H new ATOM 1803 N GLU A 119 -5.525 6.915 -0.049 1.00 0.00 N ATOM 1804 CA GLU A 119 -6.535 6.940 -1.124 1.00 0.00 C ATOM 1805 C GLU A 119 -6.462 8.292 -1.855 1.00 0.00 C ATOM 1806 O GLU A 119 -6.371 9.339 -1.219 1.00 0.00 O ATOM 1807 CB GLU A 119 -7.940 6.647 -0.562 1.00 0.00 C ATOM 1808 CG GLU A 119 -8.662 7.776 0.198 1.00 0.00 C ATOM 1809 CD GLU A 119 -9.267 8.834 -0.738 1.00 0.00 C ATOM 1810 OE1 GLU A 119 -9.985 8.416 -1.674 1.00 0.00 O ATOM 1811 OE2 GLU A 119 -9.007 10.031 -0.501 1.00 0.00 O ATOM 0 H GLU A 119 -5.915 6.738 0.877 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.325 6.153 -1.848 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.576 6.343 -1.393 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -7.860 5.791 0.108 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.453 7.346 0.812 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.959 8.258 0.877 1.00 0.00 H new ATOM 1818 N LEU A 120 -6.348 8.222 -3.172 1.00 0.00 N ATOM 1819 CA LEU A 120 -6.358 9.440 -4.006 1.00 0.00 C ATOM 1820 C LEU A 120 -7.260 9.252 -5.236 1.00 0.00 C ATOM 1821 O LEU A 120 -6.922 9.571 -6.372 1.00 0.00 O ATOM 1822 CB LEU A 120 -4.900 9.828 -4.319 1.00 0.00 C ATOM 1823 CG LEU A 120 -4.592 11.334 -4.454 1.00 0.00 C ATOM 1824 CD1 LEU A 120 -5.040 11.918 -5.796 1.00 0.00 C ATOM 1825 CD2 LEU A 120 -5.172 12.158 -3.297 1.00 0.00 C ATOM 0 H LEU A 120 -6.248 7.351 -3.693 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.801 10.282 -3.475 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.264 9.421 -3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.611 9.338 -5.249 1.00 0.00 H new ATOM 0 HG LEU A 120 -3.505 11.406 -4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.796 12.980 -5.830 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.527 11.401 -6.607 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -6.117 11.789 -5.908 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.927 13.210 -3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -6.255 12.038 -3.272 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.747 11.812 -2.355 1.00 0.00 H new ATOM 1837 N ASP A 121 -8.415 8.646 -4.981 1.00 0.00 N ATOM 1838 CA ASP A 121 -9.384 8.319 -6.040 1.00 0.00 C ATOM 1839 C ASP A 121 -10.765 8.806 -5.587 1.00 0.00 C ATOM 1840 O ASP A 121 -11.322 8.216 -4.655 1.00 0.00 O ATOM 1841 CB ASP A 121 -9.506 6.815 -6.302 1.00 0.00 C ATOM 1842 CG ASP A 121 -8.230 5.998 -6.139 1.00 0.00 C ATOM 1843 OD1 ASP A 121 -7.848 5.776 -4.966 1.00 0.00 O ATOM 1844 OD2 ASP A 121 -7.720 5.559 -7.189 1.00 0.00 O ATOM 0 H ASP A 121 -8.711 8.367 -4.046 1.00 0.00 H new ATOM 0 HA ASP A 121 -9.035 8.798 -6.955 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -10.261 6.410 -5.628 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -9.876 6.673 -7.317 1.00 0.00 H new ATOM 1849 N PRO A 122 -11.314 9.837 -6.239 1.00 0.00 N ATOM 1850 CA PRO A 122 -12.668 10.344 -5.939 1.00 0.00 C ATOM 1851 C PRO A 122 -13.781 9.414 -6.467 1.00 0.00 C ATOM 1852 O PRO A 122 -14.722 9.840 -7.130 1.00 0.00 O ATOM 1853 CB PRO A 122 -12.669 11.748 -6.551 1.00 0.00 C ATOM 1854 CG PRO A 122 -11.745 11.614 -7.762 1.00 0.00 C ATOM 1855 CD PRO A 122 -10.658 10.653 -7.281 1.00 0.00 C ATOM 0 HA PRO A 122 -12.888 10.377 -4.872 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -13.672 12.056 -6.845 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.300 12.493 -5.846 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -12.275 11.218 -8.629 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -11.327 12.577 -8.056 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -10.289 10.032 -8.097 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -9.801 11.193 -6.880 1.00 0.00 H new ATOM 1863 N ASP A 123 -13.624 8.123 -6.158 1.00 0.00 N ATOM 1864 CA ASP A 123 -14.512 7.012 -6.566 1.00 0.00 C ATOM 1865 C ASP A 123 -14.055 5.660 -5.984 1.00 0.00 C ATOM 1866 O ASP A 123 -14.889 4.863 -5.566 1.00 0.00 O ATOM 1867 CB ASP A 123 -14.576 6.885 -8.095 1.00 0.00 C ATOM 1868 CG ASP A 123 -15.746 6.008 -8.552 1.00 0.00 C ATOM 1869 OD1 ASP A 123 -15.541 4.776 -8.608 1.00 0.00 O ATOM 1870 OD2 ASP A 123 -16.814 6.589 -8.838 1.00 0.00 O ATOM 0 H ASP A 123 -12.840 7.801 -5.590 1.00 0.00 H new ATOM 0 HA ASP A 123 -15.499 7.253 -6.171 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -14.673 7.877 -8.537 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -13.641 6.462 -8.463 1.00 0.00 H new ATOM 1875 N GLN A 124 -12.740 5.443 -5.932 1.00 0.00 N ATOM 1876 CA GLN A 124 -12.154 4.191 -5.420 1.00 0.00 C ATOM 1877 C GLN A 124 -11.499 4.424 -4.048 1.00 0.00 C ATOM 1878 O GLN A 124 -10.416 5.007 -3.969 1.00 0.00 O ATOM 1879 CB GLN A 124 -11.144 3.549 -6.382 1.00 0.00 C ATOM 1880 CG GLN A 124 -11.771 2.914 -7.630 1.00 0.00 C ATOM 1881 CD GLN A 124 -12.057 3.882 -8.783 1.00 0.00 C ATOM 1882 OE1 GLN A 124 -11.636 5.034 -8.826 1.00 0.00 O ATOM 1883 NE2 GLN A 124 -12.812 3.407 -9.746 1.00 0.00 N ATOM 0 H GLN A 124 -12.048 6.125 -6.242 1.00 0.00 H new ATOM 0 HA GLN A 124 -12.981 3.488 -5.321 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.428 4.308 -6.697 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.583 2.785 -5.844 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.106 2.130 -7.992 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -12.705 2.432 -7.342 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -13.156 2.448 -9.699 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -13.055 3.997 -10.542 1.00 0.00 H new ATOM 1892 N PRO A 125 -12.237 4.130 -2.971 1.00 0.00 N ATOM 1893 CA PRO A 125 -11.716 4.263 -1.601 1.00 0.00 C ATOM 1894 C PRO A 125 -10.646 3.205 -1.318 1.00 0.00 C ATOM 1895 O PRO A 125 -10.574 2.163 -1.971 1.00 0.00 O ATOM 1896 CB PRO A 125 -12.942 4.138 -0.695 1.00 0.00 C ATOM 1897 CG PRO A 125 -13.925 3.289 -1.497 1.00 0.00 C ATOM 1898 CD PRO A 125 -13.631 3.645 -2.955 1.00 0.00 C ATOM 0 HA PRO A 125 -11.212 5.215 -1.432 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -12.688 3.663 0.253 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -13.362 5.116 -0.459 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.777 2.225 -1.310 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.957 3.519 -1.232 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.751 2.777 -3.603 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -14.317 4.411 -3.318 1.00 0.00 H new ATOM 1906 N ALA A 126 -9.907 3.449 -0.242 1.00 0.00 N ATOM 1907 CA ALA A 126 -8.811 2.559 0.176 1.00 0.00 C ATOM 1908 C ALA A 126 -9.341 1.179 0.602 1.00 0.00 C ATOM 1909 O ALA A 126 -8.894 0.166 0.078 1.00 0.00 O ATOM 1910 CB ALA A 126 -8.001 3.231 1.284 1.00 0.00 C ATOM 0 H ALA A 126 -10.042 4.258 0.365 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.150 2.385 -0.673 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -7.190 2.572 1.593 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.586 4.168 0.914 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.649 3.433 2.137 1.00 0.00 H new ATOM 1916 N ALA A 127 -10.370 1.158 1.454 1.00 0.00 N ATOM 1917 CA ALA A 127 -11.058 -0.088 1.863 1.00 0.00 C ATOM 1918 C ALA A 127 -11.525 -0.955 0.682 1.00 0.00 C ATOM 1919 O ALA A 127 -11.112 -2.105 0.590 1.00 0.00 O ATOM 1920 CB ALA A 127 -12.229 0.237 2.793 1.00 0.00 C ATOM 0 H ALA A 127 -10.756 1.999 1.884 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.320 -0.687 2.396 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.727 -0.687 3.087 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.857 0.748 3.681 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -12.938 0.882 2.274 1.00 0.00 H new ATOM 1926 N ALA A 128 -12.141 -0.329 -0.322 1.00 0.00 N ATOM 1927 CA ALA A 128 -12.520 -1.012 -1.580 1.00 0.00 C ATOM 1928 C ALA A 128 -11.310 -1.517 -2.390 1.00 0.00 C ATOM 1929 O ALA A 128 -11.314 -2.654 -2.858 1.00 0.00 O ATOM 1930 CB ALA A 128 -13.395 -0.109 -2.449 1.00 0.00 C ATOM 0 H ALA A 128 -12.394 0.659 -0.296 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.090 -1.893 -1.283 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.660 -0.633 -3.367 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -14.303 0.151 -1.905 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.847 0.800 -2.696 1.00 0.00 H new ATOM 1936 N ILE A 129 -10.206 -0.774 -2.312 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.895 -1.163 -2.872 1.00 0.00 C ATOM 1938 C ILE A 129 -8.301 -2.396 -2.158 1.00 0.00 C ATOM 1939 O ILE A 129 -7.690 -3.251 -2.794 1.00 0.00 O ATOM 1940 CB ILE A 129 -7.997 0.098 -2.933 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -8.027 0.712 -4.343 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -6.571 -0.011 -2.359 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -7.470 -0.190 -5.456 1.00 0.00 C ATOM 0 H ILE A 129 -10.189 0.135 -1.850 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.994 -1.519 -3.897 1.00 0.00 H new ATOM 0 HB ILE A 129 -8.457 0.783 -2.221 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -9.057 0.972 -4.588 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.458 1.642 -4.330 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -6.060 0.945 -2.470 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -6.623 -0.274 -1.303 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -6.020 -0.781 -2.898 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -7.534 0.330 -6.412 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.428 -0.430 -5.242 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -8.052 -1.110 -5.504 1.00 0.00 H new ATOM 1955 N VAL A 130 -8.618 -2.518 -0.874 1.00 0.00 N ATOM 1956 CA VAL A 130 -8.262 -3.662 -0.015 1.00 0.00 C ATOM 1957 C VAL A 130 -9.226 -4.856 -0.133 1.00 0.00 C ATOM 1958 O VAL A 130 -8.831 -6.004 0.049 1.00 0.00 O ATOM 1959 CB VAL A 130 -7.999 -3.100 1.388 1.00 0.00 C ATOM 1960 CG1 VAL A 130 -8.460 -3.943 2.584 1.00 0.00 C ATOM 1961 CG2 VAL A 130 -6.491 -2.852 1.444 1.00 0.00 C ATOM 0 H VAL A 130 -9.149 -1.803 -0.377 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.345 -4.145 -0.351 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.610 -2.205 1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.211 -3.426 3.511 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.538 -4.092 2.530 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.959 -4.911 2.562 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.225 -2.448 2.421 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.962 -3.791 1.283 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.210 -2.140 0.668 1.00 0.00 H new ATOM 1971 N ASN A 131 -10.452 -4.558 -0.540 1.00 0.00 N ATOM 1972 CA ASN A 131 -11.478 -5.572 -0.825 1.00 0.00 C ATOM 1973 C ASN A 131 -11.206 -6.272 -2.165 1.00 0.00 C ATOM 1974 O ASN A 131 -11.277 -7.490 -2.234 1.00 0.00 O ATOM 1975 CB ASN A 131 -12.868 -4.932 -0.796 1.00 0.00 C ATOM 1976 CG ASN A 131 -13.938 -6.004 -1.001 1.00 0.00 C ATOM 1977 OD1 ASN A 131 -14.363 -6.292 -2.111 1.00 0.00 O ATOM 1978 ND2 ASN A 131 -14.312 -6.673 0.065 1.00 0.00 N ATOM 0 H ASN A 131 -10.773 -3.601 -0.685 1.00 0.00 H new ATOM 0 HA ASN A 131 -11.439 -6.338 -0.050 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -13.025 -4.426 0.157 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.946 -4.174 -1.576 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.968 -7.449 -0.024 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -13.946 -6.417 0.982 1.00 0.00 H new ATOM 1985 N PHE A 132 -10.665 -5.518 -3.115 1.00 0.00 N ATOM 1986 CA PHE A 132 -10.325 -6.010 -4.460 1.00 0.00 C ATOM 1987 C PHE A 132 -8.970 -6.736 -4.493 1.00 0.00 C ATOM 1988 O PHE A 132 -8.879 -7.852 -5.004 1.00 0.00 O ATOM 1989 CB PHE A 132 -10.385 -4.805 -5.406 1.00 0.00 C ATOM 1990 CG PHE A 132 -9.596 -4.984 -6.700 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -9.851 -6.031 -7.579 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -8.524 -4.129 -6.928 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -9.039 -6.213 -8.688 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -7.729 -4.310 -8.042 1.00 0.00 C ATOM 1995 CZ PHE A 132 -7.967 -5.362 -8.919 1.00 0.00 C ATOM 0 H PHE A 132 -10.444 -4.532 -2.978 1.00 0.00 H new ATOM 0 HA PHE A 132 -11.039 -6.768 -4.782 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -11.427 -4.604 -5.654 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -10.007 -3.927 -4.882 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.679 -6.700 -7.398 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.314 -3.326 -6.237 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -9.242 -7.021 -9.376 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -6.914 -3.628 -8.234 1.00 0.00 H new ATOM 0 HZ PHE A 132 -7.323 -5.516 -9.773 1.00 0.00 H new ATOM 2005 N VAL A 133 -7.989 -6.159 -3.799 1.00 0.00 N ATOM 2006 CA VAL A 133 -6.629 -6.729 -3.710 1.00 0.00 C ATOM 2007 C VAL A 133 -6.627 -8.087 -2.971 1.00 0.00 C ATOM 2008 O VAL A 133 -5.815 -8.960 -3.263 1.00 0.00 O ATOM 2009 CB VAL A 133 -5.665 -5.680 -3.121 1.00 0.00 C ATOM 2010 CG1 VAL A 133 -5.787 -5.481 -1.606 1.00 0.00 C ATOM 2011 CG2 VAL A 133 -4.221 -5.950 -3.548 1.00 0.00 C ATOM 0 H VAL A 133 -8.105 -5.287 -3.282 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.262 -6.964 -4.709 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.978 -4.728 -3.549 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.072 -4.726 -1.279 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.798 -5.153 -1.362 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.578 -6.422 -1.097 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.566 -5.193 -3.116 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.916 -6.936 -3.197 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -4.150 -5.914 -4.635 1.00 0.00 H new ATOM 2021 N SER A 134 -7.606 -8.245 -2.079 1.00 0.00 N ATOM 2022 CA SER A 134 -7.834 -9.489 -1.318 1.00 0.00 C ATOM 2023 C SER A 134 -8.841 -10.430 -2.009 1.00 0.00 C ATOM 2024 O SER A 134 -8.681 -11.649 -1.973 1.00 0.00 O ATOM 2025 CB SER A 134 -8.306 -9.120 0.090 1.00 0.00 C ATOM 2026 OG SER A 134 -7.943 -10.150 1.009 1.00 0.00 O ATOM 0 H SER A 134 -8.275 -7.508 -1.857 1.00 0.00 H new ATOM 0 HA SER A 134 -6.895 -10.040 -1.267 1.00 0.00 H new ATOM 0 HB2 SER A 134 -7.860 -8.174 0.396 1.00 0.00 H new ATOM 0 HB3 SER A 134 -9.387 -8.980 0.096 1.00 0.00 H new ATOM 0 HG SER A 134 -8.246 -9.907 1.909 1.00 0.00 H new ATOM 2032 N ARG A 135 -9.772 -9.865 -2.784 1.00 0.00 N ATOM 2033 CA ARG A 135 -10.742 -10.643 -3.587 1.00 0.00 C ATOM 2034 C ARG A 135 -10.081 -11.396 -4.745 1.00 0.00 C ATOM 2035 O ARG A 135 -10.229 -12.607 -4.862 1.00 0.00 O ATOM 2036 CB ARG A 135 -11.866 -9.768 -4.145 1.00 0.00 C ATOM 2037 CG ARG A 135 -13.109 -9.883 -3.262 1.00 0.00 C ATOM 2038 CD ARG A 135 -14.303 -10.393 -4.071 1.00 0.00 C ATOM 2039 NE ARG A 135 -14.841 -9.331 -4.941 1.00 0.00 N ATOM 2040 CZ ARG A 135 -15.823 -9.474 -5.836 1.00 0.00 C ATOM 2041 NH1 ARG A 135 -16.368 -10.658 -6.086 1.00 0.00 N ATOM 2042 NH2 ARG A 135 -16.259 -8.431 -6.524 1.00 0.00 N ATOM 0 H ARG A 135 -9.881 -8.855 -2.878 1.00 0.00 H new ATOM 0 HA ARG A 135 -11.165 -11.370 -2.893 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -11.539 -8.729 -4.193 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -12.104 -10.074 -5.164 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -12.910 -10.561 -2.432 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -13.345 -8.911 -2.830 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -13.999 -11.246 -4.677 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -15.082 -10.744 -3.395 1.00 0.00 H new ATOM 0 HE ARG A 135 -14.426 -8.403 -4.852 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -16.038 -11.486 -5.590 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -17.116 -10.740 -6.774 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -15.845 -7.511 -6.373 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -17.009 -8.547 -7.206 1.00 0.00 H new ATOM 2056 N VAL A 136 -9.183 -10.700 -5.439 1.00 0.00 N ATOM 2057 CA VAL A 136 -8.383 -11.288 -6.537 1.00 0.00 C ATOM 2058 C VAL A 136 -7.341 -12.277 -5.989 1.00 0.00 C ATOM 2059 O VAL A 136 -6.987 -13.250 -6.650 1.00 0.00 O ATOM 2060 CB VAL A 136 -7.764 -10.170 -7.398 1.00 0.00 C ATOM 2061 CG1 VAL A 136 -6.818 -10.673 -8.497 1.00 0.00 C ATOM 2062 CG2 VAL A 136 -8.901 -9.430 -8.095 1.00 0.00 C ATOM 0 H VAL A 136 -8.982 -9.715 -5.265 1.00 0.00 H new ATOM 0 HA VAL A 136 -9.035 -11.868 -7.190 1.00 0.00 H new ATOM 0 HB VAL A 136 -7.180 -9.545 -6.722 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.426 -9.824 -9.056 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -5.992 -11.221 -8.043 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.363 -11.332 -9.173 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -8.491 -8.631 -8.713 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -9.457 -10.126 -8.724 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -9.570 -9.003 -7.347 1.00 0.00 H new ATOM 2072 N MET A 137 -6.953 -12.049 -4.737 1.00 0.00 N ATOM 2073 CA MET A 137 -5.998 -12.906 -4.020 1.00 0.00 C ATOM 2074 C MET A 137 -6.531 -14.334 -3.809 1.00 0.00 C ATOM 2075 O MET A 137 -5.725 -15.244 -3.628 1.00 0.00 O ATOM 2076 CB MET A 137 -5.673 -12.275 -2.669 1.00 0.00 C ATOM 2077 CG MET A 137 -4.170 -12.368 -2.437 1.00 0.00 C ATOM 2078 SD MET A 137 -3.648 -12.370 -0.687 1.00 0.00 S ATOM 2079 CE MET A 137 -4.147 -14.020 -0.243 1.00 0.00 C ATOM 0 H MET A 137 -7.291 -11.262 -4.184 1.00 0.00 H new ATOM 0 HA MET A 137 -5.100 -12.985 -4.633 1.00 0.00 H new ATOM 0 HB2 MET A 137 -5.995 -11.234 -2.651 1.00 0.00 H new ATOM 0 HB3 MET A 137 -6.211 -12.789 -1.872 1.00 0.00 H new ATOM 0 HG2 MET A 137 -3.802 -13.279 -2.910 1.00 0.00 H new ATOM 0 HG3 MET A 137 -3.689 -11.530 -2.941 1.00 0.00 H new ATOM 0 HE1 MET A 137 -4.751 -13.986 0.664 1.00 0.00 H new ATOM 0 HE2 MET A 137 -4.733 -14.453 -1.053 1.00 0.00 H new ATOM 0 HE3 MET A 137 -3.263 -14.633 -0.067 1.00 0.00 H new ATOM 2089 N LEU A 138 -7.864 -14.468 -3.800 1.00 0.00 N ATOM 2090 CA LEU A 138 -8.646 -15.712 -3.627 1.00 0.00 C ATOM 2091 C LEU A 138 -10.156 -15.416 -3.674 1.00 0.00 C ATOM 2092 O LEU A 138 -10.851 -15.857 -4.586 1.00 0.00 O ATOM 2093 CB LEU A 138 -8.291 -16.458 -2.330 1.00 0.00 C ATOM 2094 CG LEU A 138 -7.272 -17.572 -2.590 1.00 0.00 C ATOM 2095 CD1 LEU A 138 -6.224 -17.605 -1.478 1.00 0.00 C ATOM 2096 CD2 LEU A 138 -7.986 -18.922 -2.678 1.00 0.00 C ATOM 0 H LEU A 138 -8.472 -13.658 -3.921 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.382 -16.366 -4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.886 -15.755 -1.602 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -9.195 -16.883 -1.894 1.00 0.00 H new ATOM 0 HG LEU A 138 -6.769 -17.373 -3.536 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -5.507 -18.402 -1.677 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.702 -16.649 -1.441 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.714 -17.788 -0.522 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.255 -19.709 -2.863 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.504 -19.121 -1.740 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.708 -18.899 -3.494 1.00 0.00 H new ATOM 2108 N GLY A 139 -10.616 -14.681 -2.651 1.00 0.00 N ATOM 2109 CA GLY A 139 -12.026 -14.268 -2.521 1.00 0.00 C ATOM 2110 C GLY A 139 -12.723 -15.160 -1.492 1.00 0.00 C ATOM 2111 O GLY A 139 -13.300 -16.192 -1.826 1.00 0.00 O ATOM 0 H GLY A 139 -10.022 -14.355 -1.888 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -12.084 -13.224 -2.213 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -12.529 -14.344 -3.485 1.00 0.00 H new ATOM 2115 N SER A 140 -12.525 -14.792 -0.231 1.00 0.00 N ATOM 2116 CA SER A 140 -13.067 -15.536 0.922 1.00 0.00 C ATOM 2117 C SER A 140 -13.140 -14.612 2.142 1.00 0.00 C ATOM 2118 O SER A 140 -12.567 -13.519 2.140 1.00 0.00 O ATOM 2119 CB SER A 140 -12.174 -16.741 1.230 1.00 0.00 C ATOM 2120 OG SER A 140 -12.940 -17.740 1.909 1.00 0.00 O ATOM 0 H SER A 140 -11.984 -13.968 0.031 1.00 0.00 H new ATOM 0 HA SER A 140 -14.069 -15.892 0.682 1.00 0.00 H new ATOM 0 HB2 SER A 140 -11.763 -17.148 0.306 1.00 0.00 H new ATOM 0 HB3 SER A 140 -11.329 -16.433 1.847 1.00 0.00 H new ATOM 0 HG SER A 140 -12.370 -18.512 2.105 1.00 0.00 H new ATOM 2126 N GLY A 141 -13.876 -15.080 3.158 1.00 0.00 N ATOM 2127 CA GLY A 141 -14.195 -14.279 4.357 1.00 0.00 C ATOM 2128 C GLY A 141 -14.886 -12.959 3.976 1.00 0.00 C ATOM 2129 O GLY A 141 -15.293 -12.752 2.834 1.00 0.00 O ATOM 0 H GLY A 141 -14.268 -16.021 3.177 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.842 -14.853 5.020 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.280 -14.067 4.910 1.00 0.00 H new ATOM 2133 N GLN A 142 -14.930 -12.059 4.957 1.00 0.00 N ATOM 2134 CA GLN A 142 -15.608 -10.738 4.866 1.00 0.00 C ATOM 2135 C GLN A 142 -15.660 -9.979 6.200 1.00 0.00 C ATOM 2136 O GLN A 142 -15.452 -8.769 6.247 1.00 0.00 O ATOM 2137 CB GLN A 142 -17.033 -10.833 4.285 1.00 0.00 C ATOM 2138 CG GLN A 142 -17.917 -11.879 4.977 1.00 0.00 C ATOM 2139 CD GLN A 142 -18.775 -12.626 3.959 1.00 0.00 C ATOM 2140 OE1 GLN A 142 -18.481 -13.733 3.528 1.00 0.00 O ATOM 2141 NE2 GLN A 142 -19.897 -12.042 3.615 1.00 0.00 N ATOM 0 H GLN A 142 -14.490 -12.218 5.863 1.00 0.00 H new ATOM 0 HA GLN A 142 -14.982 -10.171 4.177 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -17.513 -9.857 4.363 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -16.967 -11.072 3.224 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -17.292 -12.587 5.521 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -18.558 -11.391 5.711 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -20.126 -11.119 3.984 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -20.541 -12.511 2.978 1.00 0.00 H new ATOM 2150 N LYS A 143 -15.900 -10.727 7.273 1.00 0.00 N ATOM 2151 CA LYS A 143 -16.040 -10.166 8.626 1.00 0.00 C ATOM 2152 C LYS A 143 -15.155 -10.965 9.585 1.00 0.00 C ATOM 2153 O LYS A 143 -15.507 -12.065 10.003 1.00 0.00 O ATOM 2154 CB LYS A 143 -17.516 -10.246 9.027 1.00 0.00 C ATOM 2155 CG LYS A 143 -18.042 -8.925 9.597 1.00 0.00 C ATOM 2156 CD LYS A 143 -18.149 -8.890 11.126 1.00 0.00 C ATOM 2157 CE LYS A 143 -16.905 -8.339 11.830 1.00 0.00 C ATOM 2158 NZ LYS A 143 -16.082 -9.400 12.426 1.00 0.00 N ATOM 0 H LYS A 143 -16.004 -11.741 7.236 1.00 0.00 H new ATOM 0 HA LYS A 143 -15.723 -9.124 8.660 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -18.111 -10.525 8.157 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -17.646 -11.035 9.768 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -17.386 -8.117 9.273 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -19.026 -8.727 9.172 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -19.010 -8.282 11.405 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -18.341 -9.900 11.489 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -16.305 -7.777 11.114 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -17.211 -7.640 12.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -15.138 -9.024 12.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -16.533 -9.740 13.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -15.992 -10.188 11.754 1.00 0.00 H new ATOM 2172 N ARG A 144 -13.911 -10.501 9.693 1.00 0.00 N ATOM 2173 CA ARG A 144 -12.862 -11.117 10.543 1.00 0.00 C ATOM 2174 C ARG A 144 -12.626 -12.614 10.220 1.00 0.00 C ATOM 2175 O ARG A 144 -11.900 -12.841 9.229 1.00 0.00 O ATOM 2176 CB ARG A 144 -13.224 -10.875 12.016 1.00 0.00 C ATOM 2177 CG ARG A 144 -12.147 -11.296 13.016 1.00 0.00 C ATOM 2178 CD ARG A 144 -11.580 -10.055 13.694 1.00 0.00 C ATOM 2179 NE ARG A 144 -11.451 -10.335 15.131 1.00 0.00 N ATOM 2180 CZ ARG A 144 -11.279 -9.426 16.094 1.00 0.00 C ATOM 2181 NH1 ARG A 144 -11.230 -8.128 15.826 1.00 0.00 N ATOM 2182 NH2 ARG A 144 -11.188 -9.811 17.356 1.00 0.00 N ATOM 2183 OXT ARG A 144 -13.232 -13.487 10.882 1.00 99.99 O ATOM 0 H ARG A 144 -13.587 -9.675 9.190 1.00 0.00 H new ATOM 0 HA ARG A 144 -11.905 -10.641 10.328 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -13.435 -9.815 12.155 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -14.143 -11.415 12.244 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -12.569 -11.971 13.761 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -11.353 -11.841 12.506 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -10.610 -9.799 13.268 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -12.236 -9.200 13.531 1.00 0.00 H new ATOM 0 HE ARG A 144 -11.497 -11.312 15.419 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -11.325 -7.802 14.864 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -11.098 -7.456 16.582 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -11.249 -10.801 17.593 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -11.057 -9.118 18.093 1.00 0.00 H new TER 2197 ARG A 144