USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 886 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 92 GLN :FLIP amide:sc= -0.0883 F(o=-2.9,f=-0.26) USER MOD Set 1.2: A 95 GLN : amide:sc= -0.17 K(o=-0.26,f=-2!) USER MOD Set 2.1: A 52 ASN : amide:sc= -0.113 K(o=-0.029,f=-1.8!) USER MOD Set 2.2: A 55 HIS : no HD1:sc= 0.0841 K(o=-0.029,f=-1.8) USER MOD Set 3.1: A 42 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 44 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 17 THR OG1 : rot -160:sc= 0 USER MOD Set 4.2: A 103 HIS : no HD1:sc= -0.0824 X(o=-0.082,f=-0.22) 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 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 31:sc= 0.481 USER MOD Single : A 6 SER OG : rot -7:sc= 0.42 USER MOD Single : A 9 GLN : amide:sc= -0.963 K(o=-0.96,f=-2.9!) USER MOD Single : A 11 GLN : amide:sc= -0.279 K(o=-0.28,f=-2.8!) USER MOD Single : A 14 TYR OH : rot -97:sc= 0.0185 USER MOD Single : A 15 SER OG : rot 52:sc= 1.21 USER MOD Single : A 20 SER OG : rot 180:sc= -0.397 USER MOD Single : A 21 MET CE :methyl -162:sc= -1.98 (180deg=-3.55!) USER MOD Single : A 24 THR OG1 : rot -140:sc= -0.032 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.0258 USER MOD Single : A 27 CYS SG : rot -31:sc= -0.156 USER MOD Single : A 32 SER OG : rot 180:sc= -0.495 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0.0689 USER MOD Single : A 41 ASN : amide:sc=-0.00531 K(o=-0.0053,f=-1.2) USER MOD Single : A 45 THR OG1 : rot 180:sc= -1.45 USER MOD Single : A 47 GLN : amide:sc= -0.096 K(o=-0.096,f=-1.4) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 MET CE :methyl 147:sc= -0.233 (180deg=-1.04) USER MOD Single : A 57 SER OG : rot 76:sc= 1.08 USER MOD Single : A 59 ASN : amide:sc= -0.388 K(o=-0.39,f=-1.3!) USER MOD Single : A 60 ASN : amide:sc= -1.76! C(o=-1.8!,f=-3!) USER MOD Single : A 62 ASN : amide:sc= -0.675 K(o=-0.68,f=-2.4!) USER MOD Single : A 65 HIS : no HD1:sc= -2.61 K(o=-2.6,f=-4.3!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 THR OG1 : rot 50:sc= 1.07 USER MOD Single : A 80 THR OG1 : rot -37:sc= -0.174 USER MOD Single : A 91 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.0278) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.127 USER MOD Single : A 98 GLN :FLIP amide:sc= -6.06! C(o=-7.7!,f=-6.1!) USER MOD Single : A 108 GLN : amide:sc= -4.24! C(o=-4.2!,f=-4.4!) USER MOD Single : A 112 GLN : amide:sc= -1.46 K(o=-1.5,f=-4.2!) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0.00923 USER MOD Single : A 117 SER OG : rot 180:sc= -0.0443 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.096 -8.956 -19.993 1.00 0.00 N ATOM 2 CA GLY A 1 -9.789 -7.555 -20.220 1.00 0.00 C ATOM 3 C GLY A 1 -9.972 -6.713 -18.973 1.00 0.00 C ATOM 4 O GLY A 1 -9.016 -6.465 -18.237 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.956 -9.489 -20.875 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.467 -9.334 -19.256 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.085 -9.049 -19.686 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.760 -7.463 -20.569 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.430 -7.169 -21.013 1.00 0.00 H new ATOM 8 N SER A 2 -11.202 -6.270 -18.735 1.00 0.00 N ATOM 9 CA SER A 2 -11.506 -5.445 -17.571 1.00 0.00 C ATOM 10 C SER A 2 -10.818 -5.991 -16.324 1.00 0.00 C ATOM 11 O SER A 2 -9.749 -5.522 -15.935 1.00 0.00 O ATOM 12 CB SER A 2 -13.018 -5.380 -17.347 1.00 0.00 C ATOM 13 OG SER A 2 -13.537 -4.120 -17.737 1.00 0.00 O ATOM 0 H SER A 2 -12.005 -6.468 -19.332 1.00 0.00 H new ATOM 0 HA SER A 2 -11.131 -4.439 -17.761 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.508 -6.170 -17.916 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.241 -5.559 -16.295 1.00 0.00 H new ATOM 0 HG SER A 2 -14.505 -4.104 -17.586 1.00 0.00 H new ATOM 19 N SER A 3 -11.441 -6.987 -15.701 1.00 0.00 N ATOM 20 CA SER A 3 -10.892 -7.596 -14.495 1.00 0.00 C ATOM 21 C SER A 3 -10.332 -8.983 -14.793 1.00 0.00 C ATOM 22 O SER A 3 -10.508 -9.514 -15.889 1.00 0.00 O ATOM 23 CB SER A 3 -11.967 -7.690 -13.410 1.00 0.00 C ATOM 24 OG SER A 3 -13.111 -8.378 -13.885 1.00 0.00 O ATOM 0 H SER A 3 -12.326 -7.389 -16.011 1.00 0.00 H new ATOM 0 HA SER A 3 -10.079 -6.964 -14.137 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.564 -8.206 -12.538 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.250 -6.688 -13.086 1.00 0.00 H new ATOM 0 HG SER A 3 -13.783 -8.426 -13.173 1.00 0.00 H new ATOM 30 N GLY A 4 -9.656 -9.566 -13.808 1.00 0.00 N ATOM 31 CA GLY A 4 -9.079 -10.887 -13.984 1.00 0.00 C ATOM 32 C GLY A 4 -8.069 -11.227 -12.906 1.00 0.00 C ATOM 33 O GLY A 4 -7.124 -10.474 -12.672 1.00 0.00 O ATOM 0 H GLY A 4 -9.497 -9.148 -12.891 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.875 -11.631 -13.979 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.597 -10.942 -14.960 1.00 0.00 H new ATOM 37 N SER A 5 -8.270 -12.363 -12.246 1.00 0.00 N ATOM 38 CA SER A 5 -7.372 -12.799 -11.183 1.00 0.00 C ATOM 39 C SER A 5 -7.456 -14.309 -10.986 1.00 0.00 C ATOM 40 O SER A 5 -8.133 -14.791 -10.077 1.00 0.00 O ATOM 41 CB SER A 5 -7.711 -12.082 -9.875 1.00 0.00 C ATOM 42 OG SER A 5 -7.016 -10.852 -9.772 1.00 0.00 O ATOM 0 H SER A 5 -9.047 -12.998 -12.429 1.00 0.00 H new ATOM 0 HA SER A 5 -6.353 -12.545 -11.475 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.785 -11.902 -9.823 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.454 -12.720 -9.030 1.00 0.00 H new ATOM 0 HG SER A 5 -6.884 -10.475 -10.667 1.00 0.00 H new ATOM 48 N SER A 6 -6.763 -15.051 -11.844 1.00 0.00 N ATOM 49 CA SER A 6 -6.762 -16.507 -11.767 1.00 0.00 C ATOM 50 C SER A 6 -8.164 -17.038 -11.484 1.00 0.00 C ATOM 51 O SER A 6 -8.357 -17.875 -10.604 1.00 0.00 O ATOM 52 CB SER A 6 -5.796 -16.981 -10.680 1.00 0.00 C ATOM 53 OG SER A 6 -6.267 -16.629 -9.390 1.00 0.00 O ATOM 0 H SER A 6 -6.195 -14.668 -12.600 1.00 0.00 H new ATOM 0 HA SER A 6 -6.433 -16.896 -12.731 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.674 -18.062 -10.744 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.813 -16.539 -10.845 1.00 0.00 H new ATOM 0 HG SER A 6 -7.061 -16.061 -9.475 1.00 0.00 H new ATOM 59 N GLY A 7 -9.141 -16.543 -12.239 1.00 0.00 N ATOM 60 CA GLY A 7 -10.513 -16.978 -12.054 1.00 0.00 C ATOM 61 C GLY A 7 -11.514 -15.996 -12.629 1.00 0.00 C ATOM 62 O GLY A 7 -11.892 -15.026 -11.971 1.00 0.00 O ATOM 0 H GLY A 7 -9.007 -15.849 -12.975 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.650 -17.950 -12.527 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.709 -17.111 -10.990 1.00 0.00 H new ATOM 66 N VAL A 8 -11.945 -16.246 -13.862 1.00 0.00 N ATOM 67 CA VAL A 8 -12.909 -15.376 -14.526 1.00 0.00 C ATOM 68 C VAL A 8 -14.337 -15.735 -14.132 1.00 0.00 C ATOM 69 O VAL A 8 -15.196 -14.862 -14.014 1.00 0.00 O ATOM 70 CB VAL A 8 -12.775 -15.456 -16.058 1.00 0.00 C ATOM 71 CG1 VAL A 8 -11.702 -14.497 -16.552 1.00 0.00 C ATOM 72 CG2 VAL A 8 -12.467 -16.882 -16.491 1.00 0.00 C ATOM 0 H VAL A 8 -11.642 -17.044 -14.421 1.00 0.00 H new ATOM 0 HA VAL A 8 -12.692 -14.358 -14.202 1.00 0.00 H new ATOM 0 HB VAL A 8 -13.725 -15.161 -16.504 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -11.622 -14.568 -17.637 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.969 -13.478 -16.274 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.745 -14.758 -16.100 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.376 -16.921 -17.576 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.531 -17.206 -16.036 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -13.274 -17.542 -16.171 1.00 0.00 H new ATOM 82 N GLN A 9 -14.582 -17.025 -13.928 1.00 0.00 N ATOM 83 CA GLN A 9 -15.907 -17.500 -13.547 1.00 0.00 C ATOM 84 C GLN A 9 -16.373 -16.835 -12.256 1.00 0.00 C ATOM 85 O GLN A 9 -15.607 -16.130 -11.598 1.00 0.00 O ATOM 86 CB GLN A 9 -15.897 -19.020 -13.377 1.00 0.00 C ATOM 87 CG GLN A 9 -15.095 -19.747 -14.444 1.00 0.00 C ATOM 88 CD GLN A 9 -13.695 -20.102 -13.981 1.00 0.00 C ATOM 89 OE1 GLN A 9 -13.250 -19.663 -12.921 1.00 0.00 O ATOM 90 NE2 GLN A 9 -12.993 -20.900 -14.777 1.00 0.00 N ATOM 0 H GLN A 9 -13.881 -17.760 -14.020 1.00 0.00 H new ATOM 0 HA GLN A 9 -16.603 -17.235 -14.342 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -15.488 -19.265 -12.397 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -16.924 -19.386 -13.394 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -15.621 -20.658 -14.731 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -15.032 -19.122 -15.335 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -13.402 -21.241 -15.647 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -12.045 -21.172 -14.518 1.00 0.00 H new ATOM 99 N ASP A 10 -17.632 -17.063 -11.901 1.00 0.00 N ATOM 100 CA ASP A 10 -18.200 -16.486 -10.688 1.00 0.00 C ATOM 101 C ASP A 10 -18.435 -17.562 -9.632 1.00 0.00 C ATOM 102 O ASP A 10 -19.172 -18.520 -9.863 1.00 0.00 O ATOM 103 CB ASP A 10 -19.514 -15.770 -11.005 1.00 0.00 C ATOM 104 CG ASP A 10 -20.451 -16.622 -11.840 1.00 0.00 C ATOM 105 OD1 ASP A 10 -20.119 -17.800 -12.087 1.00 0.00 O ATOM 106 OD2 ASP A 10 -21.515 -16.110 -12.247 1.00 0.00 O ATOM 0 H ASP A 10 -18.279 -17.643 -12.435 1.00 0.00 H new ATOM 0 HA ASP A 10 -17.487 -15.763 -10.292 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -20.009 -15.497 -10.073 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -19.300 -14.843 -11.536 1.00 0.00 H new ATOM 111 N GLN A 11 -17.802 -17.397 -8.475 1.00 0.00 N ATOM 112 CA GLN A 11 -17.941 -18.356 -7.386 1.00 0.00 C ATOM 113 C GLN A 11 -17.779 -17.670 -6.033 1.00 0.00 C ATOM 114 O GLN A 11 -16.803 -16.955 -5.801 1.00 0.00 O ATOM 115 CB GLN A 11 -16.910 -19.477 -7.529 1.00 0.00 C ATOM 116 CG GLN A 11 -15.504 -18.977 -7.819 1.00 0.00 C ATOM 117 CD GLN A 11 -14.436 -19.813 -7.143 1.00 0.00 C ATOM 118 OE1 GLN A 11 -14.740 -20.714 -6.360 1.00 0.00 O ATOM 119 NE2 GLN A 11 -13.176 -19.520 -7.442 1.00 0.00 N ATOM 0 H GLN A 11 -17.188 -16.609 -8.268 1.00 0.00 H new ATOM 0 HA GLN A 11 -18.942 -18.784 -7.439 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -16.895 -20.065 -6.611 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -17.222 -20.146 -8.331 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -15.336 -18.982 -8.896 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -15.415 -17.943 -7.487 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -12.969 -18.765 -8.096 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -12.415 -20.050 -7.018 1.00 0.00 H new ATOM 128 N LEU A 12 -18.740 -17.892 -5.144 1.00 0.00 N ATOM 129 CA LEU A 12 -18.704 -17.295 -3.813 1.00 0.00 C ATOM 130 C LEU A 12 -18.719 -15.772 -3.899 1.00 0.00 C ATOM 131 O LEU A 12 -18.208 -15.174 -4.846 1.00 0.00 O ATOM 132 CB LEU A 12 -17.460 -17.762 -3.056 1.00 0.00 C ATOM 133 CG LEU A 12 -17.554 -19.136 -2.393 1.00 0.00 C ATOM 134 CD1 LEU A 12 -16.425 -20.037 -2.868 1.00 0.00 C ATOM 135 CD2 LEU A 12 -17.528 -19.000 -0.877 1.00 0.00 C ATOM 0 H LEU A 12 -19.554 -18.481 -5.320 1.00 0.00 H new ATOM 0 HA LEU A 12 -19.593 -17.619 -3.272 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -16.620 -17.772 -3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -17.229 -17.025 -2.287 1.00 0.00 H new ATOM 0 HG LEU A 12 -18.501 -19.592 -2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -16.509 -21.011 -2.385 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -16.489 -20.161 -3.949 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -15.467 -19.586 -2.611 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -17.596 -19.988 -0.422 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -16.597 -18.522 -0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -18.372 -18.392 -0.552 1.00 0.00 H new ATOM 147 N PRO A 13 -19.318 -15.128 -2.886 1.00 0.00 N ATOM 148 CA PRO A 13 -19.411 -13.666 -2.823 1.00 0.00 C ATOM 149 C PRO A 13 -18.058 -13.009 -2.571 1.00 0.00 C ATOM 150 O PRO A 13 -17.084 -13.682 -2.235 1.00 0.00 O ATOM 151 CB PRO A 13 -20.353 -13.422 -1.641 1.00 0.00 C ATOM 152 CG PRO A 13 -20.207 -14.632 -0.784 1.00 0.00 C ATOM 153 CD PRO A 13 -19.948 -15.776 -1.724 1.00 0.00 C ATOM 0 HA PRO A 13 -19.763 -13.239 -3.762 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -20.081 -12.517 -1.098 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -21.383 -13.295 -1.975 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -19.385 -14.513 -0.078 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -21.109 -14.806 -0.197 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -19.293 -16.523 -1.276 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -20.871 -16.286 -2.000 1.00 0.00 H new ATOM 161 N TYR A 14 -18.006 -11.692 -2.735 1.00 0.00 N ATOM 162 CA TYR A 14 -16.772 -10.944 -2.527 1.00 0.00 C ATOM 163 C TYR A 14 -16.994 -9.452 -2.753 1.00 0.00 C ATOM 164 O TYR A 14 -17.811 -9.053 -3.583 1.00 0.00 O ATOM 165 CB TYR A 14 -15.677 -11.456 -3.465 1.00 0.00 C ATOM 166 CG TYR A 14 -14.387 -11.803 -2.757 1.00 0.00 C ATOM 167 CD1 TYR A 14 -14.396 -12.524 -1.569 1.00 0.00 C ATOM 168 CD2 TYR A 14 -13.159 -11.409 -3.275 1.00 0.00 C ATOM 169 CE1 TYR A 14 -13.220 -12.843 -0.918 1.00 0.00 C ATOM 170 CE2 TYR A 14 -11.978 -11.725 -2.632 1.00 0.00 C ATOM 171 CZ TYR A 14 -12.014 -12.442 -1.454 1.00 0.00 C ATOM 172 OH TYR A 14 -10.839 -12.757 -0.809 1.00 0.00 O ATOM 0 H TYR A 14 -18.804 -11.120 -3.011 1.00 0.00 H new ATOM 0 HA TYR A 14 -16.456 -11.093 -1.494 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -16.043 -12.339 -3.989 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -15.474 -10.698 -4.221 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -15.339 -12.840 -1.147 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -13.128 -10.846 -4.196 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -13.245 -13.403 0.005 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -11.032 -11.413 -3.049 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.555 -11.998 -0.258 1.00 0.00 H new ATOM 182 N SER A 15 -16.261 -8.631 -2.008 1.00 0.00 N ATOM 183 CA SER A 15 -16.379 -7.182 -2.123 1.00 0.00 C ATOM 184 C SER A 15 -15.003 -6.533 -2.244 1.00 0.00 C ATOM 185 O SER A 15 -14.247 -6.469 -1.276 1.00 0.00 O ATOM 186 CB SER A 15 -17.120 -6.612 -0.912 1.00 0.00 C ATOM 187 OG SER A 15 -17.041 -7.493 0.195 1.00 0.00 O ATOM 0 H SER A 15 -15.579 -8.945 -1.318 1.00 0.00 H new ATOM 0 HA SER A 15 -16.947 -6.959 -3.026 1.00 0.00 H new ATOM 0 HB2 SER A 15 -16.694 -5.646 -0.643 1.00 0.00 H new ATOM 0 HB3 SER A 15 -18.165 -6.439 -1.169 1.00 0.00 H new ATOM 0 HG SER A 15 -16.105 -7.736 0.353 1.00 0.00 H new ATOM 193 N VAL A 16 -14.686 -6.052 -3.442 1.00 0.00 N ATOM 194 CA VAL A 16 -13.403 -5.407 -3.692 1.00 0.00 C ATOM 195 C VAL A 16 -13.494 -3.901 -3.474 1.00 0.00 C ATOM 196 O VAL A 16 -14.526 -3.284 -3.742 1.00 0.00 O ATOM 197 CB VAL A 16 -12.908 -5.678 -5.125 1.00 0.00 C ATOM 198 CG1 VAL A 16 -11.815 -4.692 -5.508 1.00 0.00 C ATOM 199 CG2 VAL A 16 -12.414 -7.111 -5.255 1.00 0.00 C ATOM 0 H VAL A 16 -15.301 -6.097 -4.255 1.00 0.00 H new ATOM 0 HA VAL A 16 -12.692 -5.832 -2.984 1.00 0.00 H new ATOM 0 HB VAL A 16 -13.744 -5.542 -5.812 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.478 -4.899 -6.524 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -12.207 -3.676 -5.456 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -10.976 -4.793 -4.819 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -12.068 -7.286 -6.274 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -11.592 -7.277 -4.559 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -13.228 -7.799 -5.026 1.00 0.00 H new ATOM 209 N THR A 17 -12.407 -3.312 -2.986 1.00 0.00 N ATOM 210 CA THR A 17 -12.363 -1.878 -2.731 1.00 0.00 C ATOM 211 C THR A 17 -11.189 -1.226 -3.453 1.00 0.00 C ATOM 212 O THR A 17 -10.115 -1.818 -3.573 1.00 0.00 O ATOM 213 CB THR A 17 -12.255 -1.578 -1.224 1.00 0.00 C ATOM 214 OG1 THR A 17 -13.323 -2.220 -0.519 1.00 0.00 O ATOM 215 CG2 THR A 17 -12.300 -0.079 -0.966 1.00 0.00 C ATOM 0 H THR A 17 -11.544 -3.807 -2.759 1.00 0.00 H new ATOM 0 HA THR A 17 -13.296 -1.461 -3.111 1.00 0.00 H new ATOM 0 HB THR A 17 -11.300 -1.964 -0.867 1.00 0.00 H new ATOM 0 HG1 THR A 17 -13.445 -1.789 0.353 1.00 0.00 H new ATOM 0 HG21 THR A 17 -12.222 0.108 0.105 1.00 0.00 H new ATOM 0 HG22 THR A 17 -11.469 0.404 -1.480 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.241 0.326 -1.338 1.00 0.00 H new ATOM 223 N LEU A 18 -11.398 -0.005 -3.932 1.00 0.00 N ATOM 224 CA LEU A 18 -10.356 0.728 -4.642 1.00 0.00 C ATOM 225 C LEU A 18 -10.278 2.171 -4.156 1.00 0.00 C ATOM 226 O LEU A 18 -11.290 2.869 -4.087 1.00 0.00 O ATOM 227 CB LEU A 18 -10.620 0.698 -6.148 1.00 0.00 C ATOM 228 CG LEU A 18 -9.430 1.041 -7.045 1.00 0.00 C ATOM 229 CD1 LEU A 18 -9.110 2.525 -6.964 1.00 0.00 C ATOM 230 CD2 LEU A 18 -8.215 0.209 -6.660 1.00 0.00 C ATOM 0 H LEU A 18 -12.280 0.499 -3.842 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.401 0.243 -4.437 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -10.975 -0.297 -6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.429 1.395 -6.369 1.00 0.00 H new ATOM 0 HG LEU A 18 -9.696 0.804 -8.075 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.261 2.750 -7.609 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -9.975 3.102 -7.290 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.864 2.789 -5.935 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.378 0.466 -7.309 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.947 0.414 -5.623 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.449 -0.850 -6.772 1.00 0.00 H new ATOM 242 N ILE A 19 -9.070 2.613 -3.821 1.00 0.00 N ATOM 243 CA ILE A 19 -8.860 3.974 -3.345 1.00 0.00 C ATOM 244 C ILE A 19 -7.813 4.696 -4.187 1.00 0.00 C ATOM 245 O ILE A 19 -6.674 4.244 -4.301 1.00 0.00 O ATOM 246 CB ILE A 19 -8.417 3.993 -1.870 1.00 0.00 C ATOM 247 CG1 ILE A 19 -7.334 2.940 -1.627 1.00 0.00 C ATOM 248 CG2 ILE A 19 -9.610 3.755 -0.956 1.00 0.00 C ATOM 249 CD1 ILE A 19 -7.839 1.711 -0.903 1.00 0.00 C ATOM 0 H ILE A 19 -8.222 2.048 -3.871 1.00 0.00 H new ATOM 0 HA ILE A 19 -9.816 4.490 -3.436 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.000 4.974 -1.643 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.910 2.639 -2.585 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.527 3.388 -1.047 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -9.281 3.771 0.083 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -10.352 4.538 -1.114 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -10.053 2.785 -1.181 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.018 1.007 -0.765 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.237 2.000 0.070 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.626 1.240 -1.492 1.00 0.00 H new ATOM 261 N SER A 20 -8.207 5.821 -4.775 1.00 0.00 N ATOM 262 CA SER A 20 -7.304 6.605 -5.609 1.00 0.00 C ATOM 263 C SER A 20 -7.165 8.026 -5.072 1.00 0.00 C ATOM 264 O SER A 20 -7.998 8.890 -5.348 1.00 0.00 O ATOM 265 CB SER A 20 -7.809 6.640 -7.052 1.00 0.00 C ATOM 266 OG SER A 20 -8.102 5.336 -7.522 1.00 0.00 O ATOM 0 H SER A 20 -9.146 6.210 -4.689 1.00 0.00 H new ATOM 0 HA SER A 20 -6.324 6.129 -5.587 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.703 7.261 -7.113 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.057 7.100 -7.693 1.00 0.00 H new ATOM 0 HG SER A 20 -8.425 5.386 -8.446 1.00 0.00 H new ATOM 272 N MET A 21 -6.106 8.261 -4.303 1.00 0.00 N ATOM 273 CA MET A 21 -5.857 9.578 -3.728 1.00 0.00 C ATOM 274 C MET A 21 -4.573 10.181 -4.288 1.00 0.00 C ATOM 275 O MET A 21 -3.591 9.484 -4.545 1.00 0.00 O ATOM 276 CB MET A 21 -5.767 9.483 -2.204 1.00 0.00 C ATOM 277 CG MET A 21 -6.067 8.095 -1.662 1.00 0.00 C ATOM 278 SD MET A 21 -4.660 6.975 -1.803 1.00 0.00 S ATOM 279 CE MET A 21 -4.861 5.992 -0.319 1.00 0.00 C ATOM 0 H MET A 21 -5.407 7.557 -4.064 1.00 0.00 H new ATOM 0 HA MET A 21 -6.690 10.228 -3.996 1.00 0.00 H new ATOM 0 HB2 MET A 21 -4.766 9.779 -1.888 1.00 0.00 H new ATOM 0 HB3 MET A 21 -6.464 10.195 -1.762 1.00 0.00 H new ATOM 0 HG2 MET A 21 -6.360 8.174 -0.615 1.00 0.00 H new ATOM 0 HG3 MET A 21 -6.916 7.675 -2.200 1.00 0.00 H new ATOM 0 HE1 MET A 21 -3.924 5.484 -0.090 1.00 0.00 H new ATOM 0 HE2 MET A 21 -5.135 6.641 0.513 1.00 0.00 H new ATOM 0 HE3 MET A 21 -5.646 5.253 -0.476 1.00 0.00 H new ATOM 289 N PRO A 22 -4.577 11.508 -4.483 1.00 0.00 N ATOM 290 CA PRO A 22 -3.420 12.234 -5.014 1.00 0.00 C ATOM 291 C PRO A 22 -2.262 12.285 -4.023 1.00 0.00 C ATOM 292 O PRO A 22 -2.446 12.633 -2.857 1.00 0.00 O ATOM 293 CB PRO A 22 -3.969 13.640 -5.268 1.00 0.00 C ATOM 294 CG PRO A 22 -5.113 13.776 -4.323 1.00 0.00 C ATOM 295 CD PRO A 22 -5.712 12.402 -4.199 1.00 0.00 C ATOM 0 HA PRO A 22 -3.011 11.754 -5.903 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -3.210 14.401 -5.083 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -4.293 13.758 -6.302 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -4.777 14.144 -3.354 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.847 14.489 -4.698 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -6.120 12.230 -3.203 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -6.527 12.254 -4.907 1.00 0.00 H new ATOM 303 N ALA A 23 -1.070 11.936 -4.495 1.00 0.00 N ATOM 304 CA ALA A 23 0.118 11.945 -3.650 1.00 0.00 C ATOM 305 C ALA A 23 -0.224 11.550 -2.217 1.00 0.00 C ATOM 306 O ALA A 23 -1.153 10.777 -1.980 1.00 0.00 O ATOM 307 CB ALA A 23 0.776 13.316 -3.679 1.00 0.00 C ATOM 0 H ALA A 23 -0.901 11.644 -5.457 1.00 0.00 H new ATOM 0 HA ALA A 23 0.819 11.209 -4.044 1.00 0.00 H new ATOM 0 HB1 ALA A 23 1.662 13.308 -3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.065 13.559 -4.701 1.00 0.00 H new ATOM 0 HB3 ALA A 23 0.073 14.065 -3.313 1.00 0.00 H new ATOM 313 N THR A 24 0.532 12.085 -1.264 1.00 0.00 N ATOM 314 CA THR A 24 0.310 11.787 0.145 1.00 0.00 C ATOM 315 C THR A 24 0.437 13.044 0.999 1.00 0.00 C ATOM 316 O THR A 24 0.747 12.971 2.189 1.00 0.00 O ATOM 317 CB THR A 24 1.304 10.729 0.659 1.00 0.00 C ATOM 318 OG1 THR A 24 2.555 11.347 0.983 1.00 0.00 O ATOM 319 CG2 THR A 24 1.524 9.642 -0.382 1.00 0.00 C ATOM 0 H THR A 24 1.304 12.727 -1.443 1.00 0.00 H new ATOM 0 HA THR A 24 -0.703 11.394 0.229 1.00 0.00 H new ATOM 0 HB THR A 24 0.883 10.272 1.555 1.00 0.00 H new ATOM 0 HG1 THR A 24 3.291 10.766 0.696 1.00 0.00 H new ATOM 0 HG21 THR A 24 2.230 8.906 0.004 1.00 0.00 H new ATOM 0 HG22 THR A 24 0.575 9.153 -0.604 1.00 0.00 H new ATOM 0 HG23 THR A 24 1.925 10.086 -1.293 1.00 0.00 H new ATOM 327 N THR A 25 0.194 14.198 0.386 1.00 0.00 N ATOM 328 CA THR A 25 0.281 15.471 1.090 1.00 0.00 C ATOM 329 C THR A 25 1.733 15.859 1.347 1.00 0.00 C ATOM 330 O THR A 25 2.070 16.360 2.419 1.00 0.00 O ATOM 331 CB THR A 25 -0.471 15.423 2.433 1.00 0.00 C ATOM 332 OG1 THR A 25 -1.726 14.753 2.268 1.00 0.00 O ATOM 333 CG2 THR A 25 -0.706 16.826 2.972 1.00 0.00 C ATOM 0 H THR A 25 -0.065 14.277 -0.597 1.00 0.00 H new ATOM 0 HA THR A 25 -0.184 16.219 0.448 1.00 0.00 H new ATOM 0 HB THR A 25 0.142 14.874 3.148 1.00 0.00 H new ATOM 0 HG1 THR A 25 -2.197 14.725 3.127 1.00 0.00 H new ATOM 0 HG21 THR A 25 -1.239 16.767 3.921 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.252 17.323 3.124 1.00 0.00 H new ATOM 0 HG23 THR A 25 -1.300 17.395 2.257 1.00 0.00 H new ATOM 341 N GLU A 26 2.588 15.624 0.356 1.00 0.00 N ATOM 342 CA GLU A 26 4.004 15.949 0.477 1.00 0.00 C ATOM 343 C GLU A 26 4.675 15.077 1.534 1.00 0.00 C ATOM 344 O GLU A 26 4.086 14.110 2.021 1.00 0.00 O ATOM 345 CB GLU A 26 4.182 17.427 0.832 1.00 0.00 C ATOM 346 CG GLU A 26 3.243 18.352 0.077 1.00 0.00 C ATOM 347 CD GLU A 26 3.004 19.661 0.803 1.00 0.00 C ATOM 348 OE1 GLU A 26 3.956 20.462 0.909 1.00 0.00 O ATOM 349 OE2 GLU A 26 1.866 19.884 1.266 1.00 0.00 O ATOM 0 H GLU A 26 2.325 15.210 -0.538 1.00 0.00 H new ATOM 0 HA GLU A 26 4.478 15.753 -0.485 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.023 17.556 1.903 1.00 0.00 H new ATOM 0 HB3 GLU A 26 5.211 17.720 0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.658 18.559 -0.909 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.289 17.848 -0.078 1.00 0.00 H new ATOM 356 N CYS A 27 5.908 15.424 1.884 1.00 0.00 N ATOM 357 CA CYS A 27 6.660 14.672 2.882 1.00 0.00 C ATOM 358 C CYS A 27 6.512 13.171 2.658 1.00 0.00 C ATOM 359 O CYS A 27 6.083 12.732 1.591 1.00 0.00 O ATOM 360 CB CYS A 27 6.188 15.039 4.290 1.00 0.00 C ATOM 361 SG CYS A 27 4.745 14.105 4.851 1.00 0.00 S ATOM 0 H CYS A 27 6.409 16.221 1.492 1.00 0.00 H new ATOM 0 HA CYS A 27 7.713 14.934 2.780 1.00 0.00 H new ATOM 0 HB2 CYS A 27 7.007 14.877 4.990 1.00 0.00 H new ATOM 0 HB3 CYS A 27 5.952 16.103 4.317 1.00 0.00 H new ATOM 0 HG CYS A 27 3.998 13.806 3.830 1.00 0.00 H new ATOM 367 N ARG A 28 6.871 12.388 3.670 1.00 0.00 N ATOM 368 CA ARG A 28 6.780 10.936 3.583 1.00 0.00 C ATOM 369 C ARG A 28 5.324 10.483 3.543 1.00 0.00 C ATOM 370 O ARG A 28 4.420 11.234 3.912 1.00 0.00 O ATOM 371 CB ARG A 28 7.495 10.286 4.769 1.00 0.00 C ATOM 372 CG ARG A 28 6.952 10.723 6.120 1.00 0.00 C ATOM 373 CD ARG A 28 7.810 11.815 6.739 1.00 0.00 C ATOM 374 NE ARG A 28 7.854 11.717 8.195 1.00 0.00 N ATOM 375 CZ ARG A 28 8.385 10.688 8.847 1.00 0.00 C ATOM 376 NH1 ARG A 28 8.915 9.675 8.175 1.00 0.00 N ATOM 377 NH2 ARG A 28 8.388 10.672 10.174 1.00 0.00 N ATOM 0 H ARG A 28 7.228 12.735 4.560 1.00 0.00 H new ATOM 0 HA ARG A 28 7.265 10.622 2.659 1.00 0.00 H new ATOM 0 HB2 ARG A 28 7.409 9.203 4.685 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.557 10.526 4.719 1.00 0.00 H new ATOM 0 HG2 ARG A 28 5.930 11.084 6.003 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.912 9.866 6.792 1.00 0.00 H new ATOM 0 HD2 ARG A 28 8.822 11.750 6.341 1.00 0.00 H new ATOM 0 HD3 ARG A 28 7.417 12.791 6.453 1.00 0.00 H new ATOM 0 HE ARG A 28 7.455 12.480 8.742 1.00 0.00 H new ATOM 0 HH11 ARG A 28 8.916 9.684 7.155 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.322 8.887 8.678 1.00 0.00 H new ATOM 0 HH21 ARG A 28 7.982 11.450 10.694 1.00 0.00 H new ATOM 0 HH22 ARG A 28 8.796 9.882 10.674 1.00 0.00 H new ATOM 391 N ARG A 29 5.104 9.253 3.091 1.00 0.00 N ATOM 392 CA ARG A 29 3.757 8.701 3.001 1.00 0.00 C ATOM 393 C ARG A 29 3.027 8.830 4.335 1.00 0.00 C ATOM 394 O ARG A 29 3.541 9.424 5.281 1.00 0.00 O ATOM 395 CB ARG A 29 3.812 7.233 2.577 1.00 0.00 C ATOM 396 CG ARG A 29 4.756 6.390 3.419 1.00 0.00 C ATOM 397 CD ARG A 29 6.150 6.340 2.811 1.00 0.00 C ATOM 398 NE ARG A 29 6.735 5.004 2.896 1.00 0.00 N ATOM 399 CZ ARG A 29 8.015 4.747 2.651 1.00 0.00 C ATOM 400 NH1 ARG A 29 8.839 5.728 2.309 1.00 0.00 N ATOM 401 NH2 ARG A 29 8.474 3.505 2.750 1.00 0.00 N ATOM 0 H ARG A 29 5.841 8.619 2.781 1.00 0.00 H new ATOM 0 HA ARG A 29 3.208 9.268 2.250 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.810 6.809 2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.121 7.177 1.533 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.812 6.801 4.427 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.360 5.378 3.509 1.00 0.00 H new ATOM 0 HD2 ARG A 29 6.102 6.649 1.767 1.00 0.00 H new ATOM 0 HD3 ARG A 29 6.796 7.052 3.325 1.00 0.00 H new ATOM 0 HE ARG A 29 6.128 4.227 3.157 1.00 0.00 H new ATOM 0 HH11 ARG A 29 8.491 6.684 2.233 1.00 0.00 H new ATOM 0 HH12 ARG A 29 9.821 5.527 2.122 1.00 0.00 H new ATOM 0 HH21 ARG A 29 7.844 2.748 3.014 1.00 0.00 H new ATOM 0 HH22 ARG A 29 9.457 3.308 2.562 1.00 0.00 H new ATOM 415 N GLY A 30 1.823 8.268 4.401 1.00 0.00 N ATOM 416 CA GLY A 30 1.042 8.332 5.622 1.00 0.00 C ATOM 417 C GLY A 30 0.879 6.975 6.278 1.00 0.00 C ATOM 418 O GLY A 30 0.748 6.878 7.498 1.00 0.00 O ATOM 0 H GLY A 30 1.376 7.770 3.631 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.523 9.015 6.322 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.058 8.745 5.399 1.00 0.00 H new ATOM 422 N PHE A 31 0.887 5.922 5.466 1.00 0.00 N ATOM 423 CA PHE A 31 0.736 4.564 5.974 1.00 0.00 C ATOM 424 C PHE A 31 1.900 3.684 5.526 1.00 0.00 C ATOM 425 O PHE A 31 2.510 3.926 4.485 1.00 0.00 O ATOM 426 CB PHE A 31 -0.587 3.962 5.497 1.00 0.00 C ATOM 427 CG PHE A 31 -0.602 3.632 4.032 1.00 0.00 C ATOM 428 CD1 PHE A 31 -0.899 4.606 3.093 1.00 0.00 C ATOM 429 CD2 PHE A 31 -0.319 2.348 3.594 1.00 0.00 C ATOM 430 CE1 PHE A 31 -0.914 4.306 1.743 1.00 0.00 C ATOM 431 CE2 PHE A 31 -0.331 2.043 2.247 1.00 0.00 C ATOM 432 CZ PHE A 31 -0.630 3.023 1.320 1.00 0.00 C ATOM 0 H PHE A 31 0.996 5.984 4.454 1.00 0.00 H new ATOM 0 HA PHE A 31 0.734 4.608 7.063 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.791 3.056 6.067 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -1.394 4.662 5.712 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.121 5.611 3.419 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -0.086 1.577 4.314 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.148 5.074 1.021 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.107 1.039 1.918 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.642 2.786 0.266 1.00 0.00 H new ATOM 442 N SER A 32 2.200 2.661 6.320 1.00 0.00 N ATOM 443 CA SER A 32 3.293 1.747 6.008 1.00 0.00 C ATOM 444 C SER A 32 2.755 0.406 5.518 1.00 0.00 C ATOM 445 O SER A 32 1.625 0.027 5.825 1.00 0.00 O ATOM 446 CB SER A 32 4.176 1.536 7.239 1.00 0.00 C ATOM 447 OG SER A 32 3.410 1.580 8.431 1.00 0.00 O ATOM 0 H SER A 32 1.702 2.444 7.183 1.00 0.00 H new ATOM 0 HA SER A 32 3.891 2.192 5.213 1.00 0.00 H new ATOM 0 HB2 SER A 32 4.684 0.575 7.165 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.949 2.304 7.272 1.00 0.00 H new ATOM 0 HG SER A 32 3.998 1.441 9.203 1.00 0.00 H new ATOM 453 N VAL A 33 3.575 -0.310 4.754 1.00 0.00 N ATOM 454 CA VAL A 33 3.184 -1.609 4.221 1.00 0.00 C ATOM 455 C VAL A 33 4.260 -2.657 4.484 1.00 0.00 C ATOM 456 O VAL A 33 5.422 -2.325 4.723 1.00 0.00 O ATOM 457 CB VAL A 33 2.913 -1.536 2.707 1.00 0.00 C ATOM 458 CG1 VAL A 33 1.873 -0.470 2.401 1.00 0.00 C ATOM 459 CG2 VAL A 33 4.203 -1.268 1.947 1.00 0.00 C ATOM 0 H VAL A 33 4.514 -0.012 4.491 1.00 0.00 H new ATOM 0 HA VAL A 33 2.266 -1.898 4.733 1.00 0.00 H new ATOM 0 HB VAL A 33 2.519 -2.498 2.380 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.695 -0.433 1.326 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.943 -0.711 2.915 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.235 0.500 2.742 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.993 -1.220 0.879 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.629 -0.320 2.276 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.913 -2.072 2.141 1.00 0.00 H new ATOM 469 N THR A 34 3.867 -3.926 4.438 1.00 0.00 N ATOM 470 CA THR A 34 4.797 -5.024 4.671 1.00 0.00 C ATOM 471 C THR A 34 5.039 -5.820 3.394 1.00 0.00 C ATOM 472 O THR A 34 4.104 -6.129 2.656 1.00 0.00 O ATOM 473 CB THR A 34 4.279 -5.976 5.766 1.00 0.00 C ATOM 474 OG1 THR A 34 4.930 -5.693 7.009 1.00 0.00 O ATOM 475 CG2 THR A 34 4.520 -7.427 5.379 1.00 0.00 C ATOM 0 H THR A 34 2.910 -4.219 4.241 1.00 0.00 H new ATOM 0 HA THR A 34 5.735 -4.579 5.001 1.00 0.00 H new ATOM 0 HB THR A 34 3.206 -5.820 5.875 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.594 -6.301 7.700 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.146 -8.081 6.167 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.998 -7.647 4.448 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.589 -7.595 5.245 1.00 0.00 H new ATOM 483 N VAL A 35 6.301 -6.150 3.139 1.00 0.00 N ATOM 484 CA VAL A 35 6.667 -6.913 1.951 1.00 0.00 C ATOM 485 C VAL A 35 7.257 -8.267 2.328 1.00 0.00 C ATOM 486 O VAL A 35 8.287 -8.341 2.997 1.00 0.00 O ATOM 487 CB VAL A 35 7.682 -6.146 1.082 1.00 0.00 C ATOM 488 CG1 VAL A 35 8.287 -7.065 0.032 1.00 0.00 C ATOM 489 CG2 VAL A 35 7.022 -4.940 0.432 1.00 0.00 C ATOM 0 H VAL A 35 7.087 -5.901 3.739 1.00 0.00 H new ATOM 0 HA VAL A 35 5.752 -7.066 1.378 1.00 0.00 H new ATOM 0 HB VAL A 35 8.487 -5.788 1.724 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.001 -6.506 -0.572 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.797 -7.893 0.524 1.00 0.00 H new ATOM 0 HG13 VAL A 35 7.496 -7.455 -0.609 1.00 0.00 H new ATOM 0 HG21 VAL A 35 7.753 -4.410 -0.178 1.00 0.00 H new ATOM 0 HG22 VAL A 35 6.197 -5.272 -0.198 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.642 -4.272 1.205 1.00 0.00 H new ATOM 499 N GLU A 36 6.597 -9.336 1.892 1.00 0.00 N ATOM 500 CA GLU A 36 7.057 -10.688 2.184 1.00 0.00 C ATOM 501 C GLU A 36 7.600 -11.362 0.927 1.00 0.00 C ATOM 502 O GLU A 36 6.944 -11.378 -0.114 1.00 0.00 O ATOM 503 CB GLU A 36 5.917 -11.523 2.771 1.00 0.00 C ATOM 504 CG GLU A 36 5.068 -10.769 3.781 1.00 0.00 C ATOM 505 CD GLU A 36 4.748 -11.599 5.009 1.00 0.00 C ATOM 506 OE1 GLU A 36 4.028 -12.610 4.871 1.00 0.00 O ATOM 507 OE2 GLU A 36 5.217 -11.236 6.108 1.00 0.00 O ATOM 0 H GLU A 36 5.743 -9.291 1.336 1.00 0.00 H new ATOM 0 HA GLU A 36 7.862 -10.620 2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.278 -11.871 1.960 1.00 0.00 H new ATOM 0 HB3 GLU A 36 6.335 -12.408 3.250 1.00 0.00 H new ATOM 0 HG2 GLU A 36 5.592 -9.863 4.086 1.00 0.00 H new ATOM 0 HG3 GLU A 36 4.138 -10.456 3.306 1.00 0.00 H new ATOM 514 N SER A 37 8.804 -11.916 1.033 1.00 0.00 N ATOM 515 CA SER A 37 9.438 -12.587 -0.096 1.00 0.00 C ATOM 516 C SER A 37 9.766 -14.036 0.249 1.00 0.00 C ATOM 517 O SER A 37 10.411 -14.740 -0.528 1.00 0.00 O ATOM 518 CB SER A 37 10.713 -11.847 -0.505 1.00 0.00 C ATOM 519 OG SER A 37 11.597 -11.708 0.594 1.00 0.00 O ATOM 0 H SER A 37 9.359 -11.913 1.888 1.00 0.00 H new ATOM 0 HA SER A 37 8.738 -12.580 -0.932 1.00 0.00 H new ATOM 0 HB2 SER A 37 11.210 -12.390 -1.309 1.00 0.00 H new ATOM 0 HB3 SER A 37 10.456 -10.862 -0.896 1.00 0.00 H new ATOM 0 HG SER A 37 12.405 -11.233 0.306 1.00 0.00 H new ATOM 525 N ALA A 38 9.315 -14.476 1.419 1.00 0.00 N ATOM 526 CA ALA A 38 9.558 -15.842 1.866 1.00 0.00 C ATOM 527 C ALA A 38 11.050 -16.156 1.888 1.00 0.00 C ATOM 528 O ALA A 38 11.735 -15.893 2.876 1.00 0.00 O ATOM 529 CB ALA A 38 8.822 -16.829 0.973 1.00 0.00 C ATOM 0 H ALA A 38 8.780 -13.907 2.074 1.00 0.00 H new ATOM 0 HA ALA A 38 9.179 -15.937 2.883 1.00 0.00 H new ATOM 0 HB1 ALA A 38 9.013 -17.845 1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.752 -16.627 1.013 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.173 -16.723 -0.053 1.00 0.00 H new ATOM 535 N SER A 39 11.548 -16.719 0.791 1.00 0.00 N ATOM 536 CA SER A 39 12.958 -17.073 0.686 1.00 0.00 C ATOM 537 C SER A 39 13.519 -16.672 -0.675 1.00 0.00 C ATOM 538 O SER A 39 14.429 -17.315 -1.198 1.00 0.00 O ATOM 539 CB SER A 39 13.147 -18.575 0.905 1.00 0.00 C ATOM 540 OG SER A 39 12.590 -19.320 -0.164 1.00 0.00 O ATOM 0 H SER A 39 10.995 -16.939 -0.037 1.00 0.00 H new ATOM 0 HA SER A 39 13.502 -16.529 1.459 1.00 0.00 H new ATOM 0 HB2 SER A 39 14.209 -18.802 0.996 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.677 -18.871 1.843 1.00 0.00 H new ATOM 0 HG SER A 39 12.725 -20.277 -0.001 1.00 0.00 H new ATOM 546 N SER A 40 12.969 -15.603 -1.243 1.00 0.00 N ATOM 547 CA SER A 40 13.411 -15.117 -2.545 1.00 0.00 C ATOM 548 C SER A 40 13.864 -13.663 -2.457 1.00 0.00 C ATOM 549 O SER A 40 14.288 -13.197 -1.401 1.00 0.00 O ATOM 550 CB SER A 40 12.284 -15.251 -3.572 1.00 0.00 C ATOM 551 OG SER A 40 12.803 -15.428 -4.878 1.00 0.00 O ATOM 0 H SER A 40 12.217 -15.057 -0.822 1.00 0.00 H new ATOM 0 HA SER A 40 14.258 -15.724 -2.864 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.649 -16.098 -3.312 1.00 0.00 H new ATOM 0 HB3 SER A 40 11.655 -14.361 -3.545 1.00 0.00 H new ATOM 0 HG SER A 40 12.063 -15.513 -5.515 1.00 0.00 H new ATOM 557 N ASN A 41 13.770 -12.952 -3.576 1.00 0.00 N ATOM 558 CA ASN A 41 14.170 -11.550 -3.626 1.00 0.00 C ATOM 559 C ASN A 41 12.994 -10.662 -4.020 1.00 0.00 C ATOM 560 O ASN A 41 12.898 -9.513 -3.588 1.00 0.00 O ATOM 561 CB ASN A 41 15.320 -11.362 -4.618 1.00 0.00 C ATOM 562 CG ASN A 41 16.607 -12.005 -4.139 1.00 0.00 C ATOM 563 OD1 ASN A 41 16.762 -12.303 -2.955 1.00 0.00 O ATOM 564 ND2 ASN A 41 17.539 -12.220 -5.060 1.00 0.00 N ATOM 0 H ASN A 41 13.421 -13.323 -4.460 1.00 0.00 H new ATOM 0 HA ASN A 41 14.505 -11.258 -2.631 1.00 0.00 H new ATOM 0 HB2 ASN A 41 15.040 -11.790 -5.581 1.00 0.00 H new ATOM 0 HB3 ASN A 41 15.487 -10.297 -4.779 1.00 0.00 H new ATOM 0 HD21 ASN A 41 18.427 -12.648 -4.797 1.00 0.00 H new ATOM 0 HD22 ASN A 41 17.367 -11.957 -6.030 1.00 0.00 H new ATOM 571 N TYR A 42 12.101 -11.203 -4.841 1.00 0.00 N ATOM 572 CA TYR A 42 10.931 -10.459 -5.295 1.00 0.00 C ATOM 573 C TYR A 42 9.835 -10.467 -4.234 1.00 0.00 C ATOM 574 O TYR A 42 10.009 -11.022 -3.150 1.00 0.00 O ATOM 575 CB TYR A 42 10.398 -11.053 -6.600 1.00 0.00 C ATOM 576 CG TYR A 42 9.531 -12.275 -6.399 1.00 0.00 C ATOM 577 CD1 TYR A 42 9.652 -13.058 -5.257 1.00 0.00 C ATOM 578 CD2 TYR A 42 8.589 -12.647 -7.351 1.00 0.00 C ATOM 579 CE1 TYR A 42 8.862 -14.175 -5.070 1.00 0.00 C ATOM 580 CE2 TYR A 42 7.794 -13.762 -7.172 1.00 0.00 C ATOM 581 CZ TYR A 42 7.934 -14.523 -6.030 1.00 0.00 C ATOM 582 OH TYR A 42 7.144 -15.635 -5.846 1.00 0.00 O ATOM 0 H TYR A 42 12.164 -12.153 -5.206 1.00 0.00 H new ATOM 0 HA TYR A 42 11.234 -9.427 -5.470 1.00 0.00 H new ATOM 0 HB2 TYR A 42 9.822 -10.292 -7.127 1.00 0.00 H new ATOM 0 HB3 TYR A 42 11.240 -11.316 -7.240 1.00 0.00 H new ATOM 0 HD1 TYR A 42 10.376 -12.788 -4.503 1.00 0.00 H new ATOM 0 HD2 TYR A 42 8.477 -12.054 -8.246 1.00 0.00 H new ATOM 0 HE1 TYR A 42 8.970 -14.773 -4.177 1.00 0.00 H new ATOM 0 HE2 TYR A 42 7.067 -14.037 -7.922 1.00 0.00 H new ATOM 0 HH TYR A 42 6.543 -15.740 -6.613 1.00 0.00 H new ATOM 592 N ALA A 43 8.704 -9.848 -4.557 1.00 0.00 N ATOM 593 CA ALA A 43 7.578 -9.785 -3.634 1.00 0.00 C ATOM 594 C ALA A 43 6.722 -11.044 -3.726 1.00 0.00 C ATOM 595 O ALA A 43 6.699 -11.718 -4.756 1.00 0.00 O ATOM 596 CB ALA A 43 6.735 -8.549 -3.913 1.00 0.00 C ATOM 0 H ALA A 43 8.544 -9.383 -5.451 1.00 0.00 H new ATOM 0 HA ALA A 43 7.974 -9.720 -2.621 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.898 -8.515 -3.216 1.00 0.00 H new ATOM 0 HB2 ALA A 43 7.347 -7.656 -3.789 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.356 -8.590 -4.934 1.00 0.00 H new ATOM 602 N THR A 44 6.019 -11.356 -2.642 1.00 0.00 N ATOM 603 CA THR A 44 5.163 -12.535 -2.600 1.00 0.00 C ATOM 604 C THR A 44 3.818 -12.215 -1.958 1.00 0.00 C ATOM 605 O THR A 44 2.784 -12.754 -2.356 1.00 0.00 O ATOM 606 CB THR A 44 5.829 -13.686 -1.822 1.00 0.00 C ATOM 607 OG1 THR A 44 5.818 -14.881 -2.610 1.00 0.00 O ATOM 608 CG2 THR A 44 5.112 -13.934 -0.504 1.00 0.00 C ATOM 0 H THR A 44 6.026 -10.809 -1.781 1.00 0.00 H new ATOM 0 HA THR A 44 5.005 -12.848 -3.632 1.00 0.00 H new ATOM 0 HB THR A 44 6.860 -13.402 -1.609 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.245 -15.607 -2.109 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.600 -14.751 0.028 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.149 -13.031 0.106 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.073 -14.198 -0.699 1.00 0.00 H new ATOM 616 N THR A 45 3.836 -11.335 -0.963 1.00 0.00 N ATOM 617 CA THR A 45 2.618 -10.943 -0.265 1.00 0.00 C ATOM 618 C THR A 45 2.775 -9.576 0.391 1.00 0.00 C ATOM 619 O THR A 45 3.847 -9.237 0.893 1.00 0.00 O ATOM 620 CB THR A 45 2.230 -11.975 0.810 1.00 0.00 C ATOM 621 OG1 THR A 45 2.288 -13.298 0.264 1.00 0.00 O ATOM 622 CG2 THR A 45 0.831 -11.702 1.343 1.00 0.00 C ATOM 0 H THR A 45 4.682 -10.879 -0.622 1.00 0.00 H new ATOM 0 HA THR A 45 1.827 -10.894 -1.013 1.00 0.00 H new ATOM 0 HB THR A 45 2.939 -11.891 1.634 1.00 0.00 H new ATOM 0 HG1 THR A 45 2.041 -13.948 0.955 1.00 0.00 H new ATOM 0 HG21 THR A 45 0.579 -12.444 2.101 1.00 0.00 H new ATOM 0 HG22 THR A 45 0.798 -10.706 1.785 1.00 0.00 H new ATOM 0 HG23 THR A 45 0.112 -11.760 0.525 1.00 0.00 H new ATOM 630 N VAL A 46 1.700 -8.795 0.385 1.00 0.00 N ATOM 631 CA VAL A 46 1.718 -7.465 0.981 1.00 0.00 C ATOM 632 C VAL A 46 0.618 -7.316 2.026 1.00 0.00 C ATOM 633 O VAL A 46 -0.514 -7.752 1.816 1.00 0.00 O ATOM 634 CB VAL A 46 1.548 -6.368 -0.087 1.00 0.00 C ATOM 635 CG1 VAL A 46 1.892 -5.003 0.490 1.00 0.00 C ATOM 636 CG2 VAL A 46 2.407 -6.673 -1.305 1.00 0.00 C ATOM 0 H VAL A 46 0.805 -9.061 -0.026 1.00 0.00 H new ATOM 0 HA VAL A 46 2.690 -7.347 1.461 1.00 0.00 H new ATOM 0 HB VAL A 46 0.505 -6.350 -0.402 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.766 -4.241 -0.279 1.00 0.00 H new ATOM 0 HG12 VAL A 46 1.231 -4.785 1.329 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.926 -5.004 0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.275 -5.888 -2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 46 3.455 -6.719 -1.009 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.108 -7.631 -1.731 1.00 0.00 H new ATOM 646 N GLN A 47 0.958 -6.697 3.152 1.00 0.00 N ATOM 647 CA GLN A 47 -0.002 -6.491 4.230 1.00 0.00 C ATOM 648 C GLN A 47 0.117 -5.083 4.803 1.00 0.00 C ATOM 649 O GLN A 47 1.193 -4.485 4.790 1.00 0.00 O ATOM 650 CB GLN A 47 0.214 -7.525 5.338 1.00 0.00 C ATOM 651 CG GLN A 47 -0.406 -8.879 5.035 1.00 0.00 C ATOM 652 CD GLN A 47 0.634 -9.954 4.786 1.00 0.00 C ATOM 653 OE1 GLN A 47 1.733 -9.672 4.307 1.00 0.00 O ATOM 654 NE2 GLN A 47 0.293 -11.195 5.113 1.00 0.00 N ATOM 0 H GLN A 47 1.891 -6.330 3.341 1.00 0.00 H new ATOM 0 HA GLN A 47 -1.004 -6.613 3.819 1.00 0.00 H new ATOM 0 HB2 GLN A 47 1.284 -7.653 5.501 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -0.206 -7.142 6.268 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -1.040 -9.179 5.869 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -1.050 -8.792 4.160 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -0.629 -11.384 5.507 1.00 0.00 H new ATOM 0 HE22 GLN A 47 0.953 -11.960 4.970 1.00 0.00 H new ATOM 663 N VAL A 48 -0.997 -4.557 5.304 1.00 0.00 N ATOM 664 CA VAL A 48 -1.018 -3.219 5.882 1.00 0.00 C ATOM 665 C VAL A 48 -0.614 -3.249 7.352 1.00 0.00 C ATOM 666 O VAL A 48 -1.344 -3.765 8.198 1.00 0.00 O ATOM 667 CB VAL A 48 -2.412 -2.576 5.757 1.00 0.00 C ATOM 668 CG1 VAL A 48 -2.373 -1.125 6.212 1.00 0.00 C ATOM 669 CG2 VAL A 48 -2.921 -2.682 4.328 1.00 0.00 C ATOM 0 H VAL A 48 -1.896 -5.038 5.321 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.299 -2.621 5.323 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.102 -3.116 6.405 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.367 -0.687 6.117 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.054 -1.079 7.253 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.670 -0.568 5.592 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.907 -2.223 4.258 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.233 -2.168 3.657 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.989 -3.732 4.043 1.00 0.00 H new ATOM 679 N LYS A 49 0.555 -2.691 7.650 1.00 0.00 N ATOM 680 CA LYS A 49 1.058 -2.651 9.018 1.00 0.00 C ATOM 681 C LYS A 49 0.385 -1.536 9.812 1.00 0.00 C ATOM 682 O LYS A 49 -0.372 -1.798 10.746 1.00 0.00 O ATOM 683 CB LYS A 49 2.575 -2.449 9.020 1.00 0.00 C ATOM 684 CG LYS A 49 3.267 -3.055 10.228 1.00 0.00 C ATOM 685 CD LYS A 49 4.471 -2.231 10.653 1.00 0.00 C ATOM 686 CE LYS A 49 4.351 -1.772 12.098 1.00 0.00 C ATOM 687 NZ LYS A 49 5.683 -1.640 12.750 1.00 0.00 N ATOM 0 H LYS A 49 1.172 -2.260 6.962 1.00 0.00 H new ATOM 0 HA LYS A 49 0.824 -3.604 9.493 1.00 0.00 H new ATOM 0 HB2 LYS A 49 2.993 -2.888 8.114 1.00 0.00 H new ATOM 0 HB3 LYS A 49 2.791 -1.381 8.986 1.00 0.00 H new ATOM 0 HG2 LYS A 49 2.561 -3.124 11.056 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.585 -4.071 9.995 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.379 -2.822 10.532 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.567 -1.363 10.001 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.833 -0.814 12.133 1.00 0.00 H new ATOM 0 HE3 LYS A 49 3.742 -2.484 12.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 5.558 -1.325 13.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.167 -2.560 12.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.255 -0.942 12.233 1.00 0.00 H new ATOM 701 N GLU A 50 0.665 -0.293 9.433 1.00 0.00 N ATOM 702 CA GLU A 50 0.086 0.860 10.111 1.00 0.00 C ATOM 703 C GLU A 50 -0.610 1.784 9.115 1.00 0.00 C ATOM 704 O GLU A 50 -0.244 1.838 7.941 1.00 0.00 O ATOM 705 CB GLU A 50 1.168 1.632 10.869 1.00 0.00 C ATOM 706 CG GLU A 50 1.296 1.228 12.328 1.00 0.00 C ATOM 707 CD GLU A 50 0.530 2.149 13.258 1.00 0.00 C ATOM 708 OE1 GLU A 50 -0.637 2.467 12.950 1.00 0.00 O ATOM 709 OE2 GLU A 50 1.100 2.553 14.293 1.00 0.00 O ATOM 0 H GLU A 50 1.289 -0.059 8.661 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.655 0.496 10.822 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.126 1.479 10.373 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.948 2.698 10.814 1.00 0.00 H new ATOM 0 HG2 GLU A 50 0.932 0.208 12.452 1.00 0.00 H new ATOM 0 HG3 GLU A 50 2.349 1.227 12.610 1.00 0.00 H new ATOM 716 N VAL A 51 -1.616 2.509 9.593 1.00 0.00 N ATOM 717 CA VAL A 51 -2.363 3.431 8.746 1.00 0.00 C ATOM 718 C VAL A 51 -2.877 4.622 9.548 1.00 0.00 C ATOM 719 O VAL A 51 -3.466 4.456 10.615 1.00 0.00 O ATOM 720 CB VAL A 51 -3.556 2.730 8.068 1.00 0.00 C ATOM 721 CG1 VAL A 51 -4.133 3.604 6.965 1.00 0.00 C ATOM 722 CG2 VAL A 51 -3.135 1.375 7.521 1.00 0.00 C ATOM 0 H VAL A 51 -1.932 2.476 10.562 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.674 3.784 7.979 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.334 2.570 8.815 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.974 3.092 6.498 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.473 4.549 7.390 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.365 3.799 6.216 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.989 0.893 7.045 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.340 1.510 6.788 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.774 0.749 8.337 1.00 0.00 H new ATOM 732 N ASN A 52 -2.650 5.823 9.026 1.00 0.00 N ATOM 733 CA ASN A 52 -3.089 7.042 9.695 1.00 0.00 C ATOM 734 C ASN A 52 -4.307 7.637 8.994 1.00 0.00 C ATOM 735 O ASN A 52 -4.269 7.923 7.797 1.00 0.00 O ATOM 736 CB ASN A 52 -1.955 8.068 9.728 1.00 0.00 C ATOM 737 CG ASN A 52 -1.504 8.385 11.141 1.00 0.00 C ATOM 738 OD1 ASN A 52 -2.257 8.207 12.099 1.00 0.00 O ATOM 739 ND2 ASN A 52 -0.271 8.859 11.277 1.00 0.00 N ATOM 0 H ASN A 52 -2.165 5.978 8.142 1.00 0.00 H new ATOM 0 HA ASN A 52 -3.368 6.786 10.717 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -1.108 7.689 9.156 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -2.284 8.985 9.240 1.00 0.00 H new ATOM 0 HD21 ASN A 52 0.087 9.091 12.204 1.00 0.00 H new ATOM 0 HD22 ASN A 52 0.318 8.991 10.455 1.00 0.00 H new ATOM 746 N ARG A 53 -5.386 7.822 9.748 1.00 0.00 N ATOM 747 CA ARG A 53 -6.615 8.382 9.200 1.00 0.00 C ATOM 748 C ARG A 53 -6.481 9.889 8.996 1.00 0.00 C ATOM 749 O ARG A 53 -7.225 10.488 8.220 1.00 0.00 O ATOM 750 CB ARG A 53 -7.794 8.085 10.127 1.00 0.00 C ATOM 751 CG ARG A 53 -7.835 6.647 10.618 1.00 0.00 C ATOM 752 CD ARG A 53 -8.225 6.571 12.086 1.00 0.00 C ATOM 753 NE ARG A 53 -7.099 6.187 12.933 1.00 0.00 N ATOM 754 CZ ARG A 53 -6.738 4.927 13.149 1.00 0.00 C ATOM 755 NH1 ARG A 53 -7.411 3.935 12.583 1.00 0.00 N ATOM 756 NH2 ARG A 53 -5.701 4.657 13.932 1.00 0.00 N ATOM 0 H ARG A 53 -5.434 7.592 10.741 1.00 0.00 H new ATOM 0 HA ARG A 53 -6.797 7.916 8.232 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -7.746 8.753 10.987 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.723 8.308 9.602 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.547 6.078 10.021 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -6.858 6.185 10.475 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.608 7.539 12.410 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -9.033 5.850 12.209 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.560 6.927 13.383 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.208 4.138 11.980 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.132 2.968 12.751 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.180 5.417 14.369 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -5.425 3.689 14.097 1.00 0.00 H new ATOM 770 N MET A 54 -5.529 10.494 9.699 1.00 0.00 N ATOM 771 CA MET A 54 -5.299 11.930 9.594 1.00 0.00 C ATOM 772 C MET A 54 -4.456 12.257 8.365 1.00 0.00 C ATOM 773 O MET A 54 -4.729 13.223 7.652 1.00 0.00 O ATOM 774 CB MET A 54 -4.606 12.450 10.855 1.00 0.00 C ATOM 775 CG MET A 54 -4.939 11.651 12.105 1.00 0.00 C ATOM 776 SD MET A 54 -5.243 12.700 13.539 1.00 0.00 S ATOM 777 CE MET A 54 -6.656 13.645 12.975 1.00 0.00 C ATOM 0 H MET A 54 -4.905 10.013 10.347 1.00 0.00 H new ATOM 0 HA MET A 54 -6.266 12.421 9.490 1.00 0.00 H new ATOM 0 HB2 MET A 54 -3.527 12.434 10.700 1.00 0.00 H new ATOM 0 HB3 MET A 54 -4.890 13.491 11.013 1.00 0.00 H new ATOM 0 HG2 MET A 54 -5.820 11.037 11.915 1.00 0.00 H new ATOM 0 HG3 MET A 54 -4.117 10.970 12.326 1.00 0.00 H new ATOM 0 HE1 MET A 54 -7.303 13.872 13.822 1.00 0.00 H new ATOM 0 HE2 MET A 54 -6.314 14.575 12.520 1.00 0.00 H new ATOM 0 HE3 MET A 54 -7.212 13.064 12.239 1.00 0.00 H new ATOM 787 N HIS A 55 -3.431 11.446 8.123 1.00 0.00 N ATOM 788 CA HIS A 55 -2.548 11.650 6.980 1.00 0.00 C ATOM 789 C HIS A 55 -3.276 11.354 5.672 1.00 0.00 C ATOM 790 O HIS A 55 -3.013 11.985 4.648 1.00 0.00 O ATOM 791 CB HIS A 55 -1.309 10.762 7.101 1.00 0.00 C ATOM 792 CG HIS A 55 -0.259 11.319 8.012 1.00 0.00 C ATOM 793 ND1 HIS A 55 0.590 10.526 8.754 1.00 0.00 N ATOM 794 CD2 HIS A 55 0.077 12.599 8.297 1.00 0.00 C ATOM 795 CE1 HIS A 55 1.403 11.294 9.458 1.00 0.00 C ATOM 796 NE2 HIS A 55 1.113 12.556 9.198 1.00 0.00 N ATOM 0 H HIS A 55 -3.191 10.642 8.703 1.00 0.00 H new ATOM 0 HA HIS A 55 -2.237 12.695 6.974 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -1.610 9.780 7.465 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -0.879 10.616 6.110 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.383 13.488 7.892 1.00 0.00 H new ATOM 0 HE1 HIS A 55 2.173 10.948 10.131 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.582 13.367 9.601 1.00 0.00 H new ATOM 805 N ILE A 56 -4.190 10.390 5.715 1.00 0.00 N ATOM 806 CA ILE A 56 -4.955 10.011 4.533 1.00 0.00 C ATOM 807 C ILE A 56 -6.211 10.864 4.395 1.00 0.00 C ATOM 808 O ILE A 56 -6.198 11.905 3.739 1.00 0.00 O ATOM 809 CB ILE A 56 -5.359 8.526 4.577 1.00 0.00 C ATOM 810 CG1 ILE A 56 -4.127 7.634 4.405 1.00 0.00 C ATOM 811 CG2 ILE A 56 -6.391 8.226 3.500 1.00 0.00 C ATOM 812 CD1 ILE A 56 -4.359 6.197 4.816 1.00 0.00 C ATOM 0 H ILE A 56 -4.419 9.858 6.555 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.309 10.178 3.671 1.00 0.00 H new ATOM 0 HB ILE A 56 -5.804 8.315 5.549 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -3.813 7.659 3.361 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -3.307 8.044 4.994 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.667 7.172 3.544 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -7.277 8.840 3.664 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.970 8.451 2.520 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.444 5.624 4.667 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.643 6.161 5.868 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -5.158 5.770 4.210 1.00 0.00 H new ATOM 824 N SER A 57 -7.296 10.416 5.020 1.00 0.00 N ATOM 825 CA SER A 57 -8.562 11.138 4.965 1.00 0.00 C ATOM 826 C SER A 57 -9.721 10.231 5.369 1.00 0.00 C ATOM 827 O SER A 57 -9.632 9.005 5.314 1.00 0.00 O ATOM 828 CB SER A 57 -8.798 11.691 3.559 1.00 0.00 C ATOM 829 OG SER A 57 -8.430 13.057 3.479 1.00 0.00 O ATOM 0 H SER A 57 -7.323 9.557 5.570 1.00 0.00 H new ATOM 0 HA SER A 57 -8.510 11.968 5.669 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.222 11.113 2.836 1.00 0.00 H new ATOM 0 HB3 SER A 57 -9.849 11.578 3.292 1.00 0.00 H new ATOM 0 HG SER A 57 -7.453 13.132 3.452 1.00 0.00 H new ATOM 835 N PRO A 58 -10.837 10.849 5.785 1.00 0.00 N ATOM 836 CA PRO A 58 -12.036 10.118 6.206 1.00 0.00 C ATOM 837 C PRO A 58 -12.735 9.430 5.038 1.00 0.00 C ATOM 838 O PRO A 58 -13.726 8.726 5.224 1.00 0.00 O ATOM 839 CB PRO A 58 -12.930 11.213 6.794 1.00 0.00 C ATOM 840 CG PRO A 58 -12.489 12.465 6.119 1.00 0.00 C ATOM 841 CD PRO A 58 -11.014 12.308 5.876 1.00 0.00 C ATOM 0 HA PRO A 58 -11.801 9.318 6.908 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -13.983 11.010 6.602 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -12.811 11.283 7.875 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -13.025 12.612 5.182 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -12.691 13.336 6.742 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.702 12.809 4.959 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -10.425 12.734 6.688 1.00 0.00 H new ATOM 849 N ASN A 59 -12.211 9.639 3.835 1.00 0.00 N ATOM 850 CA ASN A 59 -12.786 9.038 2.636 1.00 0.00 C ATOM 851 C ASN A 59 -12.141 7.686 2.343 1.00 0.00 C ATOM 852 O ASN A 59 -12.827 6.671 2.235 1.00 0.00 O ATOM 853 CB ASN A 59 -12.608 9.971 1.437 1.00 0.00 C ATOM 854 CG ASN A 59 -12.576 9.220 0.120 1.00 0.00 C ATOM 855 OD1 ASN A 59 -13.331 8.269 -0.084 1.00 0.00 O ATOM 856 ND2 ASN A 59 -11.699 9.645 -0.782 1.00 0.00 N ATOM 0 H ASN A 59 -11.390 10.219 3.664 1.00 0.00 H new ATOM 0 HA ASN A 59 -13.850 8.883 2.812 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -13.422 10.695 1.420 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -11.683 10.535 1.553 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -11.632 9.179 -1.687 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -11.093 10.437 -0.570 1.00 0.00 H new ATOM 863 N ASN A 60 -10.818 7.683 2.216 1.00 0.00 N ATOM 864 CA ASN A 60 -10.080 6.457 1.935 1.00 0.00 C ATOM 865 C ASN A 60 -9.839 5.662 3.215 1.00 0.00 C ATOM 866 O ASN A 60 -9.392 4.515 3.171 1.00 0.00 O ATOM 867 CB ASN A 60 -8.744 6.783 1.265 1.00 0.00 C ATOM 868 CG ASN A 60 -8.918 7.588 -0.008 1.00 0.00 C ATOM 869 OD1 ASN A 60 -9.437 7.088 -1.006 1.00 0.00 O ATOM 870 ND2 ASN A 60 -8.482 8.842 0.021 1.00 0.00 N ATOM 0 H ASN A 60 -10.235 8.516 2.303 1.00 0.00 H new ATOM 0 HA ASN A 60 -10.679 5.849 1.258 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -8.118 7.340 1.962 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -8.219 5.855 1.036 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.571 9.432 -0.806 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -8.058 9.215 0.870 1.00 0.00 H new ATOM 877 N ARG A 61 -10.140 6.278 4.353 1.00 0.00 N ATOM 878 CA ARG A 61 -9.955 5.629 5.646 1.00 0.00 C ATOM 879 C ARG A 61 -10.893 4.434 5.793 1.00 0.00 C ATOM 880 O ARG A 61 -10.570 3.458 6.469 1.00 0.00 O ATOM 881 CB ARG A 61 -10.199 6.625 6.781 1.00 0.00 C ATOM 882 CG ARG A 61 -10.814 5.997 8.021 1.00 0.00 C ATOM 883 CD ARG A 61 -12.333 6.058 7.981 1.00 0.00 C ATOM 884 NE ARG A 61 -12.943 5.119 8.919 1.00 0.00 N ATOM 885 CZ ARG A 61 -14.196 5.219 9.348 1.00 0.00 C ATOM 886 NH1 ARG A 61 -14.968 6.211 8.926 1.00 0.00 N ATOM 887 NH2 ARG A 61 -14.680 4.326 10.202 1.00 0.00 N ATOM 0 H ARG A 61 -10.513 7.226 4.406 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.927 5.272 5.701 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -9.253 7.093 7.052 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -10.855 7.418 6.422 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -10.492 4.959 8.102 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -10.451 6.513 8.910 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -12.662 7.070 8.216 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -12.678 5.837 6.971 1.00 0.00 H new ATOM 0 HE ARG A 61 -12.376 4.344 9.263 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -14.600 6.900 8.270 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -15.930 6.285 9.257 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -14.090 3.562 10.530 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -15.642 4.404 10.531 1.00 0.00 H new ATOM 901 N ASN A 62 -12.056 4.519 5.155 1.00 0.00 N ATOM 902 CA ASN A 62 -13.041 3.446 5.215 1.00 0.00 C ATOM 903 C ASN A 62 -12.631 2.279 4.322 1.00 0.00 C ATOM 904 O ASN A 62 -12.749 1.117 4.708 1.00 0.00 O ATOM 905 CB ASN A 62 -14.418 3.965 4.794 1.00 0.00 C ATOM 906 CG ASN A 62 -15.517 2.948 5.034 1.00 0.00 C ATOM 907 OD1 ASN A 62 -15.383 1.777 4.678 1.00 0.00 O ATOM 908 ND2 ASN A 62 -16.613 3.392 5.638 1.00 0.00 N ATOM 0 H ASN A 62 -12.339 5.320 4.591 1.00 0.00 H new ATOM 0 HA ASN A 62 -13.092 3.092 6.245 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -14.644 4.877 5.346 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -14.396 4.230 3.737 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -17.387 2.754 5.824 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -16.681 4.371 5.916 1.00 0.00 H new ATOM 915 N ALA A 63 -12.147 2.599 3.126 1.00 0.00 N ATOM 916 CA ALA A 63 -11.716 1.578 2.179 1.00 0.00 C ATOM 917 C ALA A 63 -10.512 0.809 2.711 1.00 0.00 C ATOM 918 O ALA A 63 -10.550 -0.416 2.831 1.00 0.00 O ATOM 919 CB ALA A 63 -11.389 2.210 0.834 1.00 0.00 C ATOM 0 H ALA A 63 -12.044 3.557 2.790 1.00 0.00 H new ATOM 0 HA ALA A 63 -12.535 0.872 2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -11.069 1.436 0.137 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.275 2.708 0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -10.589 2.939 0.960 1.00 0.00 H new ATOM 925 N ILE A 64 -9.445 1.534 3.027 1.00 0.00 N ATOM 926 CA ILE A 64 -8.230 0.919 3.546 1.00 0.00 C ATOM 927 C ILE A 64 -8.267 0.827 5.068 1.00 0.00 C ATOM 928 O ILE A 64 -9.120 1.435 5.717 1.00 0.00 O ATOM 929 CB ILE A 64 -6.975 1.705 3.122 1.00 0.00 C ATOM 930 CG1 ILE A 64 -5.774 0.765 3.003 1.00 0.00 C ATOM 931 CG2 ILE A 64 -6.686 2.819 4.116 1.00 0.00 C ATOM 932 CD1 ILE A 64 -4.726 1.243 2.022 1.00 0.00 C ATOM 0 H ILE A 64 -9.397 2.549 2.933 1.00 0.00 H new ATOM 0 HA ILE A 64 -8.180 -0.085 3.124 1.00 0.00 H new ATOM 0 HB ILE A 64 -7.159 2.155 2.146 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.315 0.650 3.985 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -6.124 -0.221 2.697 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -5.796 3.365 3.802 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -7.535 3.501 4.155 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -6.519 2.391 5.104 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.904 0.527 1.990 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -5.169 1.331 1.030 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.348 2.215 2.338 1.00 0.00 H new ATOM 944 N HIS A 65 -7.336 0.065 5.633 1.00 0.00 N ATOM 945 CA HIS A 65 -7.261 -0.105 7.079 1.00 0.00 C ATOM 946 C HIS A 65 -6.160 -1.093 7.454 1.00 0.00 C ATOM 947 O HIS A 65 -5.782 -1.965 6.671 1.00 0.00 O ATOM 948 CB HIS A 65 -8.604 -0.588 7.628 1.00 0.00 C ATOM 949 CG HIS A 65 -9.414 0.496 8.268 1.00 0.00 C ATOM 950 ND1 HIS A 65 -8.852 1.544 8.966 1.00 0.00 N ATOM 951 CD2 HIS A 65 -10.753 0.693 8.312 1.00 0.00 C ATOM 952 CE1 HIS A 65 -9.809 2.337 9.413 1.00 0.00 C ATOM 953 NE2 HIS A 65 -10.972 1.843 9.030 1.00 0.00 N ATOM 0 H HIS A 65 -6.623 -0.445 5.111 1.00 0.00 H new ATOM 0 HA HIS A 65 -7.023 0.862 7.521 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -9.181 -1.030 6.816 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -8.426 -1.377 8.359 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -11.508 0.063 7.866 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -9.665 3.236 9.993 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -11.885 2.250 9.234 1.00 0.00 H new ATOM 962 N PRO A 66 -5.632 -0.955 8.679 1.00 0.00 N ATOM 963 CA PRO A 66 -4.568 -1.827 9.185 1.00 0.00 C ATOM 964 C PRO A 66 -5.057 -3.247 9.449 1.00 0.00 C ATOM 965 O PRO A 66 -5.905 -3.471 10.311 1.00 0.00 O ATOM 966 CB PRO A 66 -4.150 -1.153 10.495 1.00 0.00 C ATOM 967 CG PRO A 66 -5.353 -0.389 10.928 1.00 0.00 C ATOM 968 CD PRO A 66 -6.035 0.062 9.665 1.00 0.00 C ATOM 0 HA PRO A 66 -3.755 -1.936 8.467 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -3.858 -1.889 11.244 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -3.295 -0.494 10.346 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.016 -1.012 11.528 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.072 0.464 11.546 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -7.118 0.099 9.784 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.712 1.060 9.368 1.00 0.00 H new ATOM 976 N GLY A 67 -4.516 -4.203 8.700 1.00 0.00 N ATOM 977 CA GLY A 67 -4.910 -5.590 8.869 1.00 0.00 C ATOM 978 C GLY A 67 -5.328 -6.236 7.564 1.00 0.00 C ATOM 979 O GLY A 67 -5.360 -7.462 7.453 1.00 0.00 O ATOM 0 H GLY A 67 -3.812 -4.042 7.979 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.080 -6.151 9.299 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -5.735 -5.646 9.579 1.00 0.00 H new ATOM 983 N ASP A 68 -5.652 -5.412 6.574 1.00 0.00 N ATOM 984 CA ASP A 68 -6.071 -5.911 5.269 1.00 0.00 C ATOM 985 C ASP A 68 -4.869 -6.374 4.452 1.00 0.00 C ATOM 986 O ASP A 68 -3.759 -6.489 4.973 1.00 0.00 O ATOM 987 CB ASP A 68 -6.835 -4.827 4.506 1.00 0.00 C ATOM 988 CG ASP A 68 -8.046 -5.376 3.778 1.00 0.00 C ATOM 989 OD1 ASP A 68 -7.859 -6.145 2.811 1.00 0.00 O ATOM 990 OD2 ASP A 68 -9.180 -5.038 4.175 1.00 0.00 O ATOM 0 H ASP A 68 -5.633 -4.395 6.650 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.729 -6.765 5.429 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.154 -4.052 5.203 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -6.167 -4.353 3.787 1.00 0.00 H new ATOM 995 N ARG A 69 -5.098 -6.640 3.171 1.00 0.00 N ATOM 996 CA ARG A 69 -4.035 -7.094 2.282 1.00 0.00 C ATOM 997 C ARG A 69 -4.149 -6.429 0.914 1.00 0.00 C ATOM 998 O ARG A 69 -5.191 -6.505 0.261 1.00 0.00 O ATOM 999 CB ARG A 69 -4.084 -8.615 2.128 1.00 0.00 C ATOM 1000 CG ARG A 69 -5.486 -9.160 1.914 1.00 0.00 C ATOM 1001 CD ARG A 69 -5.478 -10.674 1.762 1.00 0.00 C ATOM 1002 NE ARG A 69 -6.467 -11.316 2.623 1.00 0.00 N ATOM 1003 CZ ARG A 69 -6.761 -12.610 2.567 1.00 0.00 C ATOM 1004 NH1 ARG A 69 -6.143 -13.396 1.696 1.00 0.00 N ATOM 1005 NH2 ARG A 69 -7.673 -13.121 3.384 1.00 0.00 N ATOM 0 H ARG A 69 -6.011 -6.549 2.725 1.00 0.00 H new ATOM 0 HA ARG A 69 -3.080 -6.812 2.725 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -3.457 -8.907 1.285 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.656 -9.076 3.018 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -6.119 -8.881 2.757 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.922 -8.706 1.024 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -5.678 -10.935 0.723 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -4.486 -11.057 2.001 1.00 0.00 H new ATOM 0 HE ARG A 69 -6.959 -10.739 3.305 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -5.440 -13.007 1.067 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -6.370 -14.389 1.655 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -8.149 -12.520 4.056 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.898 -14.115 3.340 1.00 0.00 H new ATOM 1019 N ILE A 70 -3.073 -5.778 0.486 1.00 0.00 N ATOM 1020 CA ILE A 70 -3.053 -5.100 -0.804 1.00 0.00 C ATOM 1021 C ILE A 70 -2.838 -6.092 -1.942 1.00 0.00 C ATOM 1022 O ILE A 70 -1.814 -6.775 -2.001 1.00 0.00 O ATOM 1023 CB ILE A 70 -1.950 -4.026 -0.859 1.00 0.00 C ATOM 1024 CG1 ILE A 70 -2.276 -2.880 0.101 1.00 0.00 C ATOM 1025 CG2 ILE A 70 -1.789 -3.505 -2.280 1.00 0.00 C ATOM 1026 CD1 ILE A 70 -1.071 -2.363 0.855 1.00 0.00 C ATOM 0 H ILE A 70 -2.203 -5.706 1.014 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.024 -4.618 -0.923 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.007 -4.477 -0.549 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.721 -2.060 -0.463 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.025 -3.218 0.817 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.006 -2.747 -2.303 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.517 -4.328 -2.941 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.729 -3.066 -2.615 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.376 -1.552 1.517 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.638 -3.170 1.446 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.329 -1.994 0.147 1.00 0.00 H new ATOM 1038 N LEU A 71 -3.808 -6.166 -2.847 1.00 0.00 N ATOM 1039 CA LEU A 71 -3.725 -7.073 -3.986 1.00 0.00 C ATOM 1040 C LEU A 71 -2.928 -6.446 -5.125 1.00 0.00 C ATOM 1041 O LEU A 71 -2.033 -7.075 -5.688 1.00 0.00 O ATOM 1042 CB LEU A 71 -5.128 -7.442 -4.472 1.00 0.00 C ATOM 1043 CG LEU A 71 -6.201 -7.572 -3.391 1.00 0.00 C ATOM 1044 CD1 LEU A 71 -7.567 -7.797 -4.019 1.00 0.00 C ATOM 1045 CD2 LEU A 71 -5.859 -8.705 -2.434 1.00 0.00 C ATOM 0 H LEU A 71 -4.661 -5.608 -2.814 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.210 -7.977 -3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.452 -6.687 -5.189 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.067 -8.388 -5.011 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.233 -6.641 -2.824 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.318 -7.887 -3.234 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.815 -6.953 -4.663 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.549 -8.712 -4.611 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.634 -8.783 -1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.798 -9.642 -2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.900 -8.502 -1.958 1.00 0.00 H new ATOM 1057 N GLU A 72 -3.258 -5.202 -5.456 1.00 0.00 N ATOM 1058 CA GLU A 72 -2.571 -4.489 -6.527 1.00 0.00 C ATOM 1059 C GLU A 72 -2.271 -3.050 -6.118 1.00 0.00 C ATOM 1060 O GLU A 72 -3.039 -2.430 -5.382 1.00 0.00 O ATOM 1061 CB GLU A 72 -3.416 -4.503 -7.803 1.00 0.00 C ATOM 1062 CG GLU A 72 -3.678 -5.899 -8.343 1.00 0.00 C ATOM 1063 CD GLU A 72 -3.920 -5.909 -9.840 1.00 0.00 C ATOM 1064 OE1 GLU A 72 -3.907 -4.820 -10.451 1.00 0.00 O ATOM 1065 OE2 GLU A 72 -4.122 -7.006 -10.401 1.00 0.00 O ATOM 0 H GLU A 72 -3.996 -4.667 -4.999 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.626 -4.998 -6.720 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.370 -4.015 -7.603 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.912 -3.915 -8.569 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -2.827 -6.540 -8.112 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.544 -6.324 -7.836 1.00 0.00 H new ATOM 1072 N ILE A 73 -1.150 -2.525 -6.601 1.00 0.00 N ATOM 1073 CA ILE A 73 -0.749 -1.160 -6.286 1.00 0.00 C ATOM 1074 C ILE A 73 -0.633 -0.316 -7.551 1.00 0.00 C ATOM 1075 O ILE A 73 0.147 -0.629 -8.449 1.00 0.00 O ATOM 1076 CB ILE A 73 0.595 -1.126 -5.536 1.00 0.00 C ATOM 1077 CG1 ILE A 73 0.482 -1.878 -4.208 1.00 0.00 C ATOM 1078 CG2 ILE A 73 1.035 0.311 -5.301 1.00 0.00 C ATOM 1079 CD1 ILE A 73 1.735 -1.806 -3.364 1.00 0.00 C ATOM 0 H ILE A 73 -0.504 -3.024 -7.212 1.00 0.00 H new ATOM 0 HA ILE A 73 -1.525 -0.744 -5.643 1.00 0.00 H new ATOM 0 HB ILE A 73 1.349 -1.620 -6.149 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -0.353 -1.470 -3.639 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.250 -2.924 -4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.987 0.318 -4.770 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.151 0.817 -6.259 1.00 0.00 H new ATOM 0 HG23 ILE A 73 0.283 0.829 -4.705 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.582 -2.361 -2.438 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.570 -2.240 -3.914 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.957 -0.765 -3.131 1.00 0.00 H new ATOM 1091 N ASN A 74 -1.415 0.758 -7.613 1.00 0.00 N ATOM 1092 CA ASN A 74 -1.399 1.649 -8.768 1.00 0.00 C ATOM 1093 C ASN A 74 -1.989 0.960 -9.995 1.00 0.00 C ATOM 1094 O ASN A 74 -1.966 1.505 -11.097 1.00 0.00 O ATOM 1095 CB ASN A 74 0.030 2.108 -9.065 1.00 0.00 C ATOM 1096 CG ASN A 74 0.233 3.584 -8.782 1.00 0.00 C ATOM 1097 OD1 ASN A 74 -0.334 4.441 -9.459 1.00 0.00 O ATOM 1098 ND2 ASN A 74 1.047 3.886 -7.777 1.00 0.00 N ATOM 0 H ASN A 74 -2.067 1.032 -6.878 1.00 0.00 H new ATOM 0 HA ASN A 74 -2.011 2.519 -8.532 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.728 1.526 -8.463 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.264 1.906 -10.110 1.00 0.00 H new ATOM 0 HD21 ASN A 74 1.224 4.862 -7.539 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.496 3.142 -7.243 1.00 0.00 H new ATOM 1105 N GLY A 75 -2.519 -0.243 -9.794 1.00 0.00 N ATOM 1106 CA GLY A 75 -3.108 -0.987 -10.892 1.00 0.00 C ATOM 1107 C GLY A 75 -2.176 -2.052 -11.437 1.00 0.00 C ATOM 1108 O GLY A 75 -2.193 -2.351 -12.631 1.00 0.00 O ATOM 0 H GLY A 75 -2.551 -0.715 -8.890 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.032 -1.456 -10.555 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.374 -0.297 -11.693 1.00 0.00 H new ATOM 1112 N THR A 76 -1.359 -2.626 -10.559 1.00 0.00 N ATOM 1113 CA THR A 76 -0.414 -3.661 -10.959 1.00 0.00 C ATOM 1114 C THR A 76 -0.359 -4.783 -9.929 1.00 0.00 C ATOM 1115 O THR A 76 -0.508 -4.563 -8.727 1.00 0.00 O ATOM 1116 CB THR A 76 1.002 -3.086 -11.151 1.00 0.00 C ATOM 1117 OG1 THR A 76 1.092 -1.794 -10.540 1.00 0.00 O ATOM 1118 CG2 THR A 76 1.348 -2.979 -12.628 1.00 0.00 C ATOM 0 H THR A 76 -1.333 -2.392 -9.567 1.00 0.00 H new ATOM 0 HA THR A 76 -0.767 -4.061 -11.909 1.00 0.00 H new ATOM 0 HB THR A 76 1.712 -3.763 -10.677 1.00 0.00 H new ATOM 0 HG1 THR A 76 0.744 -1.840 -9.625 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.353 -2.570 -12.738 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.307 -3.968 -13.084 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.633 -2.322 -13.123 1.00 0.00 H new ATOM 1126 N PRO A 77 -0.139 -6.017 -10.407 1.00 0.00 N ATOM 1127 CA PRO A 77 -0.059 -7.198 -9.543 1.00 0.00 C ATOM 1128 C PRO A 77 1.200 -7.202 -8.683 1.00 0.00 C ATOM 1129 O PRO A 77 2.317 -7.261 -9.198 1.00 0.00 O ATOM 1130 CB PRO A 77 -0.031 -8.363 -10.537 1.00 0.00 C ATOM 1131 CG PRO A 77 0.524 -7.779 -11.790 1.00 0.00 C ATOM 1132 CD PRO A 77 0.047 -6.353 -11.829 1.00 0.00 C ATOM 0 HA PRO A 77 -0.887 -7.243 -8.836 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.591 -9.180 -10.172 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.029 -8.770 -10.698 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.613 -7.826 -11.794 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.178 -8.330 -12.664 1.00 0.00 H new ATOM 0 HD2 PRO A 77 0.777 -5.698 -12.305 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.882 -6.255 -12.390 1.00 0.00 H new ATOM 1140 N VAL A 78 1.013 -7.140 -7.368 1.00 0.00 N ATOM 1141 CA VAL A 78 2.134 -7.137 -6.436 1.00 0.00 C ATOM 1142 C VAL A 78 2.841 -8.488 -6.423 1.00 0.00 C ATOM 1143 O VAL A 78 4.027 -8.576 -6.105 1.00 0.00 O ATOM 1144 CB VAL A 78 1.673 -6.798 -5.006 1.00 0.00 C ATOM 1145 CG1 VAL A 78 0.827 -5.534 -5.002 1.00 0.00 C ATOM 1146 CG2 VAL A 78 0.906 -7.965 -4.403 1.00 0.00 C ATOM 0 H VAL A 78 0.096 -7.091 -6.925 1.00 0.00 H new ATOM 0 HA VAL A 78 2.829 -6.370 -6.778 1.00 0.00 H new ATOM 0 HB VAL A 78 2.555 -6.617 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.511 -5.311 -3.983 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.414 -4.702 -5.390 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.051 -5.682 -5.630 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.588 -7.708 -3.393 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.030 -8.180 -5.015 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.549 -8.844 -4.368 1.00 0.00 H new ATOM 1156 N ARG A 79 2.106 -9.538 -6.773 1.00 0.00 N ATOM 1157 CA ARG A 79 2.662 -10.885 -6.801 1.00 0.00 C ATOM 1158 C ARG A 79 3.773 -10.992 -7.842 1.00 0.00 C ATOM 1159 O ARG A 79 4.519 -11.972 -7.871 1.00 0.00 O ATOM 1160 CB ARG A 79 1.565 -11.907 -7.104 1.00 0.00 C ATOM 1161 CG ARG A 79 0.847 -11.659 -8.420 1.00 0.00 C ATOM 1162 CD ARG A 79 -0.393 -12.528 -8.551 1.00 0.00 C ATOM 1163 NE ARG A 79 -0.074 -13.869 -9.032 1.00 0.00 N ATOM 1164 CZ ARG A 79 -0.978 -14.830 -9.186 1.00 0.00 C ATOM 1165 NH1 ARG A 79 -2.252 -14.598 -8.899 1.00 0.00 N ATOM 1166 NH2 ARG A 79 -0.610 -16.025 -9.628 1.00 0.00 N ATOM 0 H ARG A 79 1.124 -9.482 -7.041 1.00 0.00 H new ATOM 0 HA ARG A 79 3.085 -11.097 -5.819 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.005 -12.904 -7.122 1.00 0.00 H new ATOM 0 HB3 ARG A 79 0.836 -11.895 -6.294 1.00 0.00 H new ATOM 0 HG2 ARG A 79 0.565 -10.608 -8.489 1.00 0.00 H new ATOM 0 HG3 ARG A 79 1.524 -11.863 -9.249 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -0.890 -12.599 -7.583 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -1.096 -12.055 -9.236 1.00 0.00 H new ATOM 0 HE ARG A 79 0.897 -14.080 -9.263 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -2.539 -13.680 -8.559 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -2.944 -15.337 -9.018 1.00 0.00 H new ATOM 0 HH21 ARG A 79 0.369 -16.207 -9.850 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -1.306 -16.762 -9.746 1.00 0.00 H new ATOM 1180 N THR A 80 3.877 -9.979 -8.696 1.00 0.00 N ATOM 1181 CA THR A 80 4.894 -9.960 -9.739 1.00 0.00 C ATOM 1182 C THR A 80 5.838 -8.776 -9.564 1.00 0.00 C ATOM 1183 O THR A 80 7.019 -8.854 -9.907 1.00 0.00 O ATOM 1184 CB THR A 80 4.260 -9.893 -11.141 1.00 0.00 C ATOM 1185 OG1 THR A 80 3.679 -8.602 -11.356 1.00 0.00 O ATOM 1186 CG2 THR A 80 3.196 -10.968 -11.305 1.00 0.00 C ATOM 0 H THR A 80 3.269 -9.160 -8.686 1.00 0.00 H new ATOM 0 HA THR A 80 5.458 -10.888 -9.647 1.00 0.00 H new ATOM 0 HB THR A 80 5.044 -10.064 -11.879 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.271 -8.284 -10.524 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.762 -10.901 -12.303 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.648 -11.951 -11.171 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.414 -10.823 -10.559 1.00 0.00 H new ATOM 1194 N LEU A 81 5.313 -7.680 -9.028 1.00 0.00 N ATOM 1195 CA LEU A 81 6.110 -6.478 -8.807 1.00 0.00 C ATOM 1196 C LEU A 81 7.195 -6.729 -7.764 1.00 0.00 C ATOM 1197 O LEU A 81 6.909 -6.847 -6.573 1.00 0.00 O ATOM 1198 CB LEU A 81 5.213 -5.323 -8.358 1.00 0.00 C ATOM 1199 CG LEU A 81 4.424 -4.618 -9.462 1.00 0.00 C ATOM 1200 CD1 LEU A 81 3.738 -3.374 -8.917 1.00 0.00 C ATOM 1201 CD2 LEU A 81 5.338 -4.258 -10.624 1.00 0.00 C ATOM 0 H LEU A 81 4.338 -7.599 -8.738 1.00 0.00 H new ATOM 0 HA LEU A 81 6.591 -6.212 -9.748 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.506 -5.704 -7.620 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.833 -4.583 -7.853 1.00 0.00 H new ATOM 0 HG LEU A 81 3.657 -5.301 -9.827 1.00 0.00 H new ATOM 0 HD11 LEU A 81 3.181 -2.885 -9.717 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.052 -3.657 -8.118 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.488 -2.687 -8.525 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.760 -3.757 -11.400 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.127 -3.593 -10.274 1.00 0.00 H new ATOM 0 HD23 LEU A 81 5.783 -5.166 -11.032 1.00 0.00 H new ATOM 1213 N ARG A 82 8.440 -6.807 -8.222 1.00 0.00 N ATOM 1214 CA ARG A 82 9.568 -7.043 -7.329 1.00 0.00 C ATOM 1215 C ARG A 82 9.470 -6.164 -6.085 1.00 0.00 C ATOM 1216 O ARG A 82 8.907 -5.070 -6.128 1.00 0.00 O ATOM 1217 CB ARG A 82 10.887 -6.772 -8.056 1.00 0.00 C ATOM 1218 CG ARG A 82 11.233 -7.820 -9.100 1.00 0.00 C ATOM 1219 CD ARG A 82 12.551 -8.510 -8.781 1.00 0.00 C ATOM 1220 NE ARG A 82 13.701 -7.714 -9.200 1.00 0.00 N ATOM 1221 CZ ARG A 82 14.946 -8.178 -9.226 1.00 0.00 C ATOM 1222 NH1 ARG A 82 15.199 -9.427 -8.859 1.00 0.00 N ATOM 1223 NH2 ARG A 82 15.940 -7.392 -9.619 1.00 0.00 N ATOM 0 H ARG A 82 8.693 -6.710 -9.205 1.00 0.00 H new ATOM 0 HA ARG A 82 9.541 -8.087 -7.018 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.833 -5.796 -8.538 1.00 0.00 H new ATOM 0 HB3 ARG A 82 11.692 -6.722 -7.323 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.436 -8.562 -9.151 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.295 -7.351 -10.082 1.00 0.00 H new ATOM 0 HD2 ARG A 82 12.612 -8.698 -7.709 1.00 0.00 H new ATOM 0 HD3 ARG A 82 12.582 -9.480 -9.277 1.00 0.00 H new ATOM 0 HE ARG A 82 13.540 -6.749 -9.489 1.00 0.00 H new ATOM 0 HH11 ARG A 82 14.437 -10.034 -8.556 1.00 0.00 H new ATOM 0 HH12 ARG A 82 16.155 -9.781 -8.880 1.00 0.00 H new ATOM 0 HH21 ARG A 82 15.749 -6.431 -9.901 1.00 0.00 H new ATOM 0 HH22 ARG A 82 16.895 -7.749 -9.639 1.00 0.00 H new ATOM 1237 N VAL A 83 10.022 -6.651 -4.978 1.00 0.00 N ATOM 1238 CA VAL A 83 9.997 -5.910 -3.722 1.00 0.00 C ATOM 1239 C VAL A 83 10.256 -4.426 -3.955 1.00 0.00 C ATOM 1240 O VAL A 83 9.444 -3.579 -3.586 1.00 0.00 O ATOM 1241 CB VAL A 83 11.042 -6.453 -2.730 1.00 0.00 C ATOM 1242 CG1 VAL A 83 11.180 -5.520 -1.536 1.00 0.00 C ATOM 1243 CG2 VAL A 83 10.669 -7.857 -2.279 1.00 0.00 C ATOM 0 H VAL A 83 10.492 -7.555 -4.925 1.00 0.00 H new ATOM 0 HA VAL A 83 9.002 -6.040 -3.297 1.00 0.00 H new ATOM 0 HB VAL A 83 12.006 -6.503 -3.236 1.00 0.00 H new ATOM 0 HG11 VAL A 83 11.923 -5.920 -0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.496 -4.535 -1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.220 -5.436 -1.027 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.418 -8.225 -1.578 1.00 0.00 H new ATOM 0 HG22 VAL A 83 9.695 -7.835 -1.790 1.00 0.00 H new ATOM 0 HG23 VAL A 83 10.626 -8.518 -3.145 1.00 0.00 H new ATOM 1253 N GLU A 84 11.394 -4.118 -4.571 1.00 0.00 N ATOM 1254 CA GLU A 84 11.760 -2.735 -4.852 1.00 0.00 C ATOM 1255 C GLU A 84 10.603 -1.990 -5.512 1.00 0.00 C ATOM 1256 O GLU A 84 10.374 -0.813 -5.237 1.00 0.00 O ATOM 1257 CB GLU A 84 12.995 -2.685 -5.755 1.00 0.00 C ATOM 1258 CG GLU A 84 13.056 -3.817 -6.767 1.00 0.00 C ATOM 1259 CD GLU A 84 14.114 -3.593 -7.829 1.00 0.00 C ATOM 1260 OE1 GLU A 84 15.287 -3.371 -7.460 1.00 0.00 O ATOM 1261 OE2 GLU A 84 13.771 -3.640 -9.028 1.00 0.00 O ATOM 0 H GLU A 84 12.077 -4.807 -4.884 1.00 0.00 H new ATOM 0 HA GLU A 84 11.991 -2.247 -3.905 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.008 -1.733 -6.286 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.890 -2.716 -5.134 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.260 -4.753 -6.248 1.00 0.00 H new ATOM 0 HG3 GLU A 84 12.083 -3.924 -7.246 1.00 0.00 H new ATOM 1268 N GLU A 85 9.879 -2.685 -6.384 1.00 0.00 N ATOM 1269 CA GLU A 85 8.748 -2.088 -7.083 1.00 0.00 C ATOM 1270 C GLU A 85 7.591 -1.826 -6.123 1.00 0.00 C ATOM 1271 O GLU A 85 6.984 -0.755 -6.142 1.00 0.00 O ATOM 1272 CB GLU A 85 8.284 -3.001 -8.221 1.00 0.00 C ATOM 1273 CG GLU A 85 8.569 -2.442 -9.605 1.00 0.00 C ATOM 1274 CD GLU A 85 10.043 -2.169 -9.831 1.00 0.00 C ATOM 1275 OE1 GLU A 85 10.596 -1.284 -9.146 1.00 0.00 O ATOM 1276 OE2 GLU A 85 10.644 -2.842 -10.695 1.00 0.00 O ATOM 0 H GLU A 85 10.056 -3.661 -6.623 1.00 0.00 H new ATOM 0 HA GLU A 85 9.074 -1.135 -7.500 1.00 0.00 H new ATOM 0 HB2 GLU A 85 8.774 -3.969 -8.121 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.212 -3.175 -8.122 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.214 -3.146 -10.357 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.007 -1.518 -9.743 1.00 0.00 H new ATOM 1283 N VAL A 86 7.290 -2.813 -5.285 1.00 0.00 N ATOM 1284 CA VAL A 86 6.207 -2.690 -4.317 1.00 0.00 C ATOM 1285 C VAL A 86 6.491 -1.579 -3.312 1.00 0.00 C ATOM 1286 O VAL A 86 5.570 -0.957 -2.784 1.00 0.00 O ATOM 1287 CB VAL A 86 5.982 -4.010 -3.556 1.00 0.00 C ATOM 1288 CG1 VAL A 86 4.630 -4.002 -2.860 1.00 0.00 C ATOM 1289 CG2 VAL A 86 6.098 -5.196 -4.501 1.00 0.00 C ATOM 0 H VAL A 86 7.781 -3.707 -5.257 1.00 0.00 H new ATOM 0 HA VAL A 86 5.306 -2.445 -4.880 1.00 0.00 H new ATOM 0 HB VAL A 86 6.755 -4.106 -2.793 1.00 0.00 H new ATOM 0 HG11 VAL A 86 4.489 -4.943 -2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 86 4.590 -3.175 -2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.840 -3.883 -3.601 1.00 0.00 H new ATOM 0 HG21 VAL A 86 5.936 -6.120 -3.946 1.00 0.00 H new ATOM 0 HG22 VAL A 86 5.349 -5.109 -5.288 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.092 -5.210 -4.947 1.00 0.00 H new ATOM 1299 N GLU A 87 7.772 -1.335 -3.055 1.00 0.00 N ATOM 1300 CA GLU A 87 8.177 -0.298 -2.113 1.00 0.00 C ATOM 1301 C GLU A 87 8.231 1.066 -2.795 1.00 0.00 C ATOM 1302 O GLU A 87 7.727 2.057 -2.266 1.00 0.00 O ATOM 1303 CB GLU A 87 9.542 -0.632 -1.508 1.00 0.00 C ATOM 1304 CG GLU A 87 9.489 -1.722 -0.450 1.00 0.00 C ATOM 1305 CD GLU A 87 9.563 -1.170 0.960 1.00 0.00 C ATOM 1306 OE1 GLU A 87 10.687 -1.030 1.485 1.00 0.00 O ATOM 1307 OE2 GLU A 87 8.496 -0.876 1.539 1.00 0.00 O ATOM 0 H GLU A 87 8.546 -1.841 -3.485 1.00 0.00 H new ATOM 0 HA GLU A 87 7.434 -0.257 -1.316 1.00 0.00 H new ATOM 0 HB2 GLU A 87 10.217 -0.944 -2.305 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.965 0.270 -1.067 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.566 -2.291 -0.566 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.314 -2.417 -0.608 1.00 0.00 H new ATOM 1314 N ASP A 88 8.846 1.108 -3.972 1.00 0.00 N ATOM 1315 CA ASP A 88 8.967 2.349 -4.727 1.00 0.00 C ATOM 1316 C ASP A 88 7.610 3.032 -4.870 1.00 0.00 C ATOM 1317 O ASP A 88 7.473 4.225 -4.601 1.00 0.00 O ATOM 1318 CB ASP A 88 9.561 2.074 -6.110 1.00 0.00 C ATOM 1319 CG ASP A 88 11.066 2.251 -6.138 1.00 0.00 C ATOM 1320 OD1 ASP A 88 11.603 2.912 -5.224 1.00 0.00 O ATOM 1321 OD2 ASP A 88 11.708 1.730 -7.074 1.00 0.00 O ATOM 0 H ASP A 88 9.268 0.297 -4.424 1.00 0.00 H new ATOM 0 HA ASP A 88 9.634 3.015 -4.179 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.312 1.057 -6.414 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.105 2.745 -6.838 1.00 0.00 H new ATOM 1326 N ALA A 89 6.610 2.268 -5.297 1.00 0.00 N ATOM 1327 CA ALA A 89 5.264 2.798 -5.474 1.00 0.00 C ATOM 1328 C ALA A 89 4.853 3.661 -4.286 1.00 0.00 C ATOM 1329 O ALA A 89 4.313 4.754 -4.459 1.00 0.00 O ATOM 1330 CB ALA A 89 4.271 1.663 -5.674 1.00 0.00 C ATOM 0 H ALA A 89 6.707 1.279 -5.527 1.00 0.00 H new ATOM 0 HA ALA A 89 5.263 3.427 -6.364 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.270 2.074 -5.805 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.547 1.090 -6.559 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.284 1.010 -4.801 1.00 0.00 H new ATOM 1336 N ILE A 90 5.112 3.163 -3.082 1.00 0.00 N ATOM 1337 CA ILE A 90 4.768 3.890 -1.866 1.00 0.00 C ATOM 1338 C ILE A 90 5.584 5.172 -1.742 1.00 0.00 C ATOM 1339 O ILE A 90 5.063 6.218 -1.355 1.00 0.00 O ATOM 1340 CB ILE A 90 4.997 3.027 -0.611 1.00 0.00 C ATOM 1341 CG1 ILE A 90 4.609 1.573 -0.887 1.00 0.00 C ATOM 1342 CG2 ILE A 90 4.203 3.578 0.564 1.00 0.00 C ATOM 1343 CD1 ILE A 90 3.280 1.426 -1.595 1.00 0.00 C ATOM 0 H ILE A 90 5.558 2.260 -2.922 1.00 0.00 H new ATOM 0 HA ILE A 90 3.710 4.141 -1.937 1.00 0.00 H new ATOM 0 HB ILE A 90 6.056 3.059 -0.356 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.387 1.106 -1.491 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.570 1.030 0.057 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.376 2.957 1.443 1.00 0.00 H new ATOM 0 HG22 ILE A 90 4.523 4.599 0.772 1.00 0.00 H new ATOM 0 HG23 ILE A 90 3.141 3.573 0.319 1.00 0.00 H new ATOM 0 HD11 ILE A 90 3.070 0.369 -1.758 1.00 0.00 H new ATOM 0 HD12 ILE A 90 2.491 1.863 -0.983 1.00 0.00 H new ATOM 0 HD13 ILE A 90 3.321 1.940 -2.555 1.00 0.00 H new ATOM 1355 N LYS A 91 6.867 5.085 -2.077 1.00 0.00 N ATOM 1356 CA LYS A 91 7.757 6.238 -2.007 1.00 0.00 C ATOM 1357 C LYS A 91 7.164 7.428 -2.756 1.00 0.00 C ATOM 1358 O LYS A 91 7.335 8.576 -2.347 1.00 0.00 O ATOM 1359 CB LYS A 91 9.127 5.887 -2.590 1.00 0.00 C ATOM 1360 CG LYS A 91 9.766 4.666 -1.950 1.00 0.00 C ATOM 1361 CD LYS A 91 10.021 4.883 -0.468 1.00 0.00 C ATOM 1362 CE LYS A 91 10.872 3.768 0.121 1.00 0.00 C ATOM 1363 NZ LYS A 91 11.991 4.301 0.946 1.00 0.00 N ATOM 0 H LYS A 91 7.314 4.227 -2.400 1.00 0.00 H new ATOM 0 HA LYS A 91 7.875 6.512 -0.959 1.00 0.00 H new ATOM 0 HB2 LYS A 91 9.023 5.713 -3.661 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.794 6.741 -2.469 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.117 3.801 -2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 91 10.706 4.441 -2.453 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.521 5.840 -0.320 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.070 4.935 0.062 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.246 3.119 0.734 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.275 3.155 -0.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 12.299 3.575 1.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.787 4.557 0.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 11.670 5.144 1.463 1.00 0.00 H new ATOM 1377 N GLN A 92 6.467 7.145 -3.851 1.00 0.00 N ATOM 1378 CA GLN A 92 5.849 8.193 -4.655 1.00 0.00 C ATOM 1379 C GLN A 92 4.980 9.100 -3.791 1.00 0.00 C ATOM 1380 O GLN A 92 3.883 8.720 -3.379 1.00 0.00 O ATOM 1381 CB GLN A 92 5.008 7.577 -5.775 1.00 0.00 C ATOM 1382 CG GLN A 92 5.811 6.713 -6.733 1.00 0.00 C ATOM 1383 CD GLN A 92 6.552 7.529 -7.774 1.00 0.00 C ATOM 1384 OE1 GLN A 92 5.809 8.120 -8.702 1.00 0.00 O flip ATOM 1385 NE2 GLN A 92 7.779 7.628 -7.745 1.00 0.00 N flip ATOM 0 H GLN A 92 6.316 6.199 -4.202 1.00 0.00 H new ATOM 0 HA GLN A 92 6.644 8.794 -5.096 1.00 0.00 H new ATOM 0 HB2 GLN A 92 4.215 6.974 -5.333 1.00 0.00 H new ATOM 0 HB3 GLN A 92 4.525 8.376 -6.337 1.00 0.00 H new ATOM 0 HG2 GLN A 92 6.527 6.118 -6.166 1.00 0.00 H new ATOM 0 HG3 GLN A 92 5.141 6.014 -7.234 1.00 0.00 H new ATOM 0 HE21 GLN A 92 8.312 7.157 -7.014 1.00 0.00 H new ATOM 0 HE22 GLN A 92 8.263 8.181 -8.452 1.00 0.00 H new ATOM 1394 N THR A 93 5.477 10.303 -3.518 1.00 0.00 N ATOM 1395 CA THR A 93 4.747 11.264 -2.702 1.00 0.00 C ATOM 1396 C THR A 93 4.353 12.491 -3.517 1.00 0.00 C ATOM 1397 O THR A 93 4.261 13.598 -2.985 1.00 0.00 O ATOM 1398 CB THR A 93 5.578 11.715 -1.486 1.00 0.00 C ATOM 1399 OG1 THR A 93 6.750 12.411 -1.925 1.00 0.00 O ATOM 1400 CG2 THR A 93 5.981 10.521 -0.633 1.00 0.00 C ATOM 0 H THR A 93 6.383 10.634 -3.851 1.00 0.00 H new ATOM 0 HA THR A 93 3.847 10.760 -2.351 1.00 0.00 H new ATOM 0 HB THR A 93 4.964 12.383 -0.881 1.00 0.00 H new ATOM 0 HG1 THR A 93 7.272 12.696 -1.146 1.00 0.00 H new ATOM 0 HG21 THR A 93 6.567 10.864 0.220 1.00 0.00 H new ATOM 0 HG22 THR A 93 5.087 10.010 -0.277 1.00 0.00 H new ATOM 0 HG23 THR A 93 6.579 9.832 -1.230 1.00 0.00 H new ATOM 1408 N SER A 94 4.121 12.287 -4.810 1.00 0.00 N ATOM 1409 CA SER A 94 3.740 13.378 -5.699 1.00 0.00 C ATOM 1410 C SER A 94 2.868 12.868 -6.842 1.00 0.00 C ATOM 1411 O SER A 94 2.723 13.531 -7.869 1.00 0.00 O ATOM 1412 CB SER A 94 4.986 14.066 -6.260 1.00 0.00 C ATOM 1413 OG SER A 94 6.154 13.313 -5.979 1.00 0.00 O ATOM 0 H SER A 94 4.190 11.377 -5.265 1.00 0.00 H new ATOM 0 HA SER A 94 3.164 14.101 -5.121 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.881 14.193 -7.338 1.00 0.00 H new ATOM 0 HB3 SER A 94 5.080 15.063 -5.830 1.00 0.00 H new ATOM 0 HG SER A 94 6.936 13.773 -6.349 1.00 0.00 H new ATOM 1419 N GLN A 95 2.291 11.685 -6.655 1.00 0.00 N ATOM 1420 CA GLN A 95 1.434 11.085 -7.671 1.00 0.00 C ATOM 1421 C GLN A 95 0.250 10.369 -7.030 1.00 0.00 C ATOM 1422 O GLN A 95 0.282 10.029 -5.847 1.00 0.00 O ATOM 1423 CB GLN A 95 2.235 10.104 -8.529 1.00 0.00 C ATOM 1424 CG GLN A 95 3.485 10.713 -9.142 1.00 0.00 C ATOM 1425 CD GLN A 95 4.008 9.912 -10.319 1.00 0.00 C ATOM 1426 OE1 GLN A 95 3.321 9.034 -10.840 1.00 0.00 O ATOM 1427 NE2 GLN A 95 5.229 10.213 -10.744 1.00 0.00 N ATOM 0 H GLN A 95 2.401 11.124 -5.810 1.00 0.00 H new ATOM 0 HA GLN A 95 1.052 11.884 -8.306 1.00 0.00 H new ATOM 0 HB2 GLN A 95 2.520 9.248 -7.917 1.00 0.00 H new ATOM 0 HB3 GLN A 95 1.596 9.726 -9.327 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.267 11.730 -9.468 1.00 0.00 H new ATOM 0 HG3 GLN A 95 4.262 10.782 -8.381 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.763 10.949 -10.282 1.00 0.00 H new ATOM 0 HE22 GLN A 95 5.633 9.708 -11.533 1.00 0.00 H new ATOM 1436 N THR A 96 -0.797 10.143 -7.819 1.00 0.00 N ATOM 1437 CA THR A 96 -1.992 9.469 -7.329 1.00 0.00 C ATOM 1438 C THR A 96 -1.679 8.043 -6.891 1.00 0.00 C ATOM 1439 O THR A 96 -1.357 7.186 -7.715 1.00 0.00 O ATOM 1440 CB THR A 96 -3.097 9.433 -8.401 1.00 0.00 C ATOM 1441 OG1 THR A 96 -2.646 10.092 -9.590 1.00 0.00 O ATOM 1442 CG2 THR A 96 -4.365 10.103 -7.894 1.00 0.00 C ATOM 0 H THR A 96 -0.840 10.417 -8.800 1.00 0.00 H new ATOM 0 HA THR A 96 -2.347 10.040 -6.471 1.00 0.00 H new ATOM 0 HB THR A 96 -3.321 8.390 -8.626 1.00 0.00 H new ATOM 0 HG1 THR A 96 -3.353 10.064 -10.268 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.131 10.065 -8.668 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.721 9.582 -7.005 1.00 0.00 H new ATOM 0 HG23 THR A 96 -4.152 11.143 -7.644 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.775 7.794 -5.589 1.00 0.00 N ATOM 1451 CA LEU A 97 -1.502 6.470 -5.041 1.00 0.00 C ATOM 1452 C LEU A 97 -2.768 5.621 -5.014 1.00 0.00 C ATOM 1453 O LEU A 97 -3.683 5.879 -4.232 1.00 0.00 O ATOM 1454 CB LEU A 97 -0.924 6.590 -3.630 1.00 0.00 C ATOM 1455 CG LEU A 97 -0.497 5.280 -2.966 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -0.279 4.198 -4.012 1.00 0.00 C ATOM 1457 CD2 LEU A 97 0.763 5.487 -2.139 1.00 0.00 C ATOM 0 H LEU A 97 -2.040 8.492 -4.894 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.772 5.980 -5.685 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.060 7.253 -3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.667 7.071 -2.994 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.296 4.956 -2.299 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.024 3.273 -3.521 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.206 4.030 -4.561 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.501 4.514 -4.705 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.052 4.544 -1.674 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.569 5.835 -2.785 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.572 6.230 -1.365 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.813 4.606 -5.870 1.00 0.00 N ATOM 1470 CA GLN A 98 -3.967 3.717 -5.943 1.00 0.00 C ATOM 1471 C GLN A 98 -3.727 2.446 -5.135 1.00 0.00 C ATOM 1472 O GLN A 98 -2.672 1.819 -5.243 1.00 0.00 O ATOM 1473 CB GLN A 98 -4.272 3.360 -7.398 1.00 0.00 C ATOM 1474 CG GLN A 98 -5.746 3.467 -7.755 1.00 0.00 C ATOM 1475 CD GLN A 98 -6.168 2.457 -8.803 1.00 0.00 C ATOM 1476 OE1 GLN A 98 -6.148 1.180 -8.437 1.00 0.00 O flip ATOM 1477 NE2 GLN A 98 -6.508 2.819 -9.930 1.00 0.00 N flip ATOM 0 H GLN A 98 -2.064 4.378 -6.523 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.824 4.240 -5.518 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.700 4.018 -8.052 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.933 2.343 -7.593 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -6.345 3.323 -6.856 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -5.955 4.472 -8.120 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -6.509 3.811 -10.169 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.789 2.127 -10.625 1.00 0.00 H new ATOM 1486 N LEU A 99 -4.710 2.071 -4.325 1.00 0.00 N ATOM 1487 CA LEU A 99 -4.606 0.874 -3.497 1.00 0.00 C ATOM 1488 C LEU A 99 -5.869 0.026 -3.606 1.00 0.00 C ATOM 1489 O LEU A 99 -6.975 0.504 -3.350 1.00 0.00 O ATOM 1490 CB LEU A 99 -4.361 1.259 -2.038 1.00 0.00 C ATOM 1491 CG LEU A 99 -3.205 2.227 -1.784 1.00 0.00 C ATOM 1492 CD1 LEU A 99 -3.391 2.945 -0.456 1.00 0.00 C ATOM 1493 CD2 LEU A 99 -1.875 1.488 -1.811 1.00 0.00 C ATOM 0 H LEU A 99 -5.589 2.578 -4.223 1.00 0.00 H new ATOM 0 HA LEU A 99 -3.763 0.285 -3.857 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.274 1.703 -1.642 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.177 0.348 -1.469 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.200 2.973 -2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.559 3.629 -0.293 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.325 3.507 -0.474 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.423 2.214 0.352 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.064 2.192 -1.628 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.870 0.720 -1.038 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.738 1.021 -2.786 1.00 0.00 H new ATOM 1505 N LEU A 100 -5.697 -1.236 -3.985 1.00 0.00 N ATOM 1506 CA LEU A 100 -6.823 -2.153 -4.125 1.00 0.00 C ATOM 1507 C LEU A 100 -6.914 -3.090 -2.926 1.00 0.00 C ATOM 1508 O LEU A 100 -6.182 -4.076 -2.839 1.00 0.00 O ATOM 1509 CB LEU A 100 -6.686 -2.966 -5.413 1.00 0.00 C ATOM 1510 CG LEU A 100 -7.886 -3.836 -5.789 1.00 0.00 C ATOM 1511 CD1 LEU A 100 -8.939 -3.010 -6.511 1.00 0.00 C ATOM 1512 CD2 LEU A 100 -7.445 -5.011 -6.649 1.00 0.00 C ATOM 0 H LEU A 100 -4.789 -1.647 -4.201 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.738 -1.562 -4.171 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.491 -2.277 -6.235 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.811 -3.609 -5.321 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.327 -4.228 -4.873 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.785 -3.646 -6.771 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.277 -2.203 -5.861 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.510 -2.588 -7.420 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.312 -5.619 -6.907 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.978 -4.639 -7.561 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.728 -5.618 -6.096 1.00 0.00 H new ATOM 1524 N ILE A 101 -7.819 -2.778 -2.005 1.00 0.00 N ATOM 1525 CA ILE A 101 -8.009 -3.594 -0.812 1.00 0.00 C ATOM 1526 C ILE A 101 -9.121 -4.617 -1.017 1.00 0.00 C ATOM 1527 O ILE A 101 -10.136 -4.326 -1.648 1.00 0.00 O ATOM 1528 CB ILE A 101 -8.344 -2.727 0.416 1.00 0.00 C ATOM 1529 CG1 ILE A 101 -7.552 -1.419 0.376 1.00 0.00 C ATOM 1530 CG2 ILE A 101 -8.051 -3.491 1.699 1.00 0.00 C ATOM 1531 CD1 ILE A 101 -6.078 -1.613 0.097 1.00 0.00 C ATOM 0 H ILE A 101 -8.433 -1.965 -2.062 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.068 -4.115 -0.633 1.00 0.00 H new ATOM 0 HB ILE A 101 -9.407 -2.487 0.394 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -7.976 -0.770 -0.390 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -7.668 -0.904 1.330 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.293 -2.865 2.558 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -8.655 -4.398 1.729 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -6.995 -3.758 1.730 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -5.580 -0.644 0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -5.639 -2.236 0.877 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -5.952 -2.100 -0.870 1.00 0.00 H new ATOM 1543 N GLU A 102 -8.921 -5.816 -0.478 1.00 0.00 N ATOM 1544 CA GLU A 102 -9.908 -6.882 -0.602 1.00 0.00 C ATOM 1545 C GLU A 102 -10.716 -7.028 0.685 1.00 0.00 C ATOM 1546 O GLU A 102 -10.154 -7.142 1.775 1.00 0.00 O ATOM 1547 CB GLU A 102 -9.220 -8.207 -0.937 1.00 0.00 C ATOM 1548 CG GLU A 102 -10.122 -9.195 -1.658 1.00 0.00 C ATOM 1549 CD GLU A 102 -11.521 -9.241 -1.075 1.00 0.00 C ATOM 1550 OE1 GLU A 102 -11.737 -10.001 -0.108 1.00 0.00 O ATOM 1551 OE2 GLU A 102 -12.400 -8.516 -1.586 1.00 0.00 O ATOM 0 H GLU A 102 -8.086 -6.073 0.048 1.00 0.00 H new ATOM 0 HA GLU A 102 -10.589 -6.619 -1.411 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -8.346 -8.007 -1.557 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -8.859 -8.663 -0.015 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -10.181 -8.925 -2.712 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.679 -10.189 -1.608 1.00 0.00 H new ATOM 1558 N HIS A 103 -12.038 -7.022 0.550 1.00 0.00 N ATOM 1559 CA HIS A 103 -12.925 -7.153 1.701 1.00 0.00 C ATOM 1560 C HIS A 103 -13.790 -8.403 1.580 1.00 0.00 C ATOM 1561 O HIS A 103 -14.579 -8.537 0.644 1.00 0.00 O ATOM 1562 CB HIS A 103 -13.812 -5.915 1.831 1.00 0.00 C ATOM 1563 CG HIS A 103 -13.388 -4.986 2.927 1.00 0.00 C ATOM 1564 ND1 HIS A 103 -13.145 -5.406 4.218 1.00 0.00 N ATOM 1565 CD2 HIS A 103 -13.160 -3.652 2.918 1.00 0.00 C ATOM 1566 CE1 HIS A 103 -12.789 -4.370 4.956 1.00 0.00 C ATOM 1567 NE2 HIS A 103 -12.790 -3.293 4.191 1.00 0.00 N ATOM 0 H HIS A 103 -12.519 -6.928 -0.345 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.309 -7.244 2.595 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -13.807 -5.374 0.885 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -14.839 -6.232 2.012 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -13.252 -2.992 2.068 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -12.539 -4.399 6.006 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -12.554 -2.349 4.496 1.00 0.00 H new ATOM 1576 N ASP A 104 -13.638 -9.317 2.532 1.00 0.00 N ATOM 1577 CA ASP A 104 -14.405 -10.557 2.533 1.00 0.00 C ATOM 1578 C ASP A 104 -15.691 -10.399 3.339 1.00 0.00 C ATOM 1579 O ASP A 104 -15.769 -9.611 4.282 1.00 0.00 O ATOM 1580 CB ASP A 104 -13.567 -11.701 3.105 1.00 0.00 C ATOM 1581 CG ASP A 104 -12.852 -11.311 4.384 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -13.527 -10.832 5.319 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -11.617 -11.484 4.450 1.00 0.00 O ATOM 0 H ASP A 104 -12.990 -9.222 3.314 1.00 0.00 H new ATOM 0 HA ASP A 104 -14.669 -10.792 1.502 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -14.212 -12.558 3.299 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -12.833 -12.016 2.363 1.00 0.00 H new ATOM 1588 N PRO A 105 -16.725 -11.165 2.960 1.00 0.00 N ATOM 1589 CA PRO A 105 -18.026 -11.128 3.634 1.00 0.00 C ATOM 1590 C PRO A 105 -17.970 -11.726 5.036 1.00 0.00 C ATOM 1591 O PRO A 105 -18.484 -11.144 5.991 1.00 0.00 O ATOM 1592 CB PRO A 105 -18.920 -11.977 2.727 1.00 0.00 C ATOM 1593 CG PRO A 105 -17.982 -12.897 2.025 1.00 0.00 C ATOM 1594 CD PRO A 105 -16.703 -12.127 1.846 1.00 0.00 C ATOM 0 HA PRO A 105 -18.383 -10.108 3.774 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -19.659 -12.531 3.306 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -19.470 -11.356 2.019 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -17.814 -13.802 2.608 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -18.388 -13.208 1.063 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -15.831 -12.779 1.896 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -16.669 -11.623 0.880 1.00 0.00 H new ATOM 1602 N VAL A 106 -17.342 -12.891 5.153 1.00 0.00 N ATOM 1603 CA VAL A 106 -17.217 -13.567 6.439 1.00 0.00 C ATOM 1604 C VAL A 106 -17.084 -12.562 7.578 1.00 0.00 C ATOM 1605 O VAL A 106 -16.455 -11.512 7.442 1.00 0.00 O ATOM 1606 CB VAL A 106 -16.002 -14.513 6.461 1.00 0.00 C ATOM 1607 CG1 VAL A 106 -15.063 -14.203 5.304 1.00 0.00 C ATOM 1608 CG2 VAL A 106 -15.272 -14.412 7.792 1.00 0.00 C ATOM 0 H VAL A 106 -16.911 -13.387 4.373 1.00 0.00 H new ATOM 0 HA VAL A 106 -18.126 -14.152 6.578 1.00 0.00 H new ATOM 0 HB VAL A 106 -16.358 -15.537 6.345 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -14.210 -14.881 5.336 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -15.594 -14.331 4.360 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -14.712 -13.174 5.386 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -14.416 -15.087 7.790 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -14.927 -13.389 7.941 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -15.949 -14.687 8.600 1.00 0.00 H new ATOM 1618 N PRO A 107 -17.691 -12.888 8.728 1.00 0.00 N ATOM 1619 CA PRO A 107 -17.655 -12.026 9.914 1.00 0.00 C ATOM 1620 C PRO A 107 -16.269 -11.970 10.547 1.00 0.00 C ATOM 1621 O PRO A 107 -15.453 -12.872 10.357 1.00 0.00 O ATOM 1622 CB PRO A 107 -18.651 -12.692 10.867 1.00 0.00 C ATOM 1623 CG PRO A 107 -18.678 -14.122 10.449 1.00 0.00 C ATOM 1624 CD PRO A 107 -18.459 -14.122 8.961 1.00 0.00 C ATOM 0 HA PRO A 107 -17.900 -10.992 9.674 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -18.335 -12.589 11.905 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -19.639 -12.238 10.788 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -17.901 -14.692 10.958 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -19.631 -14.585 10.703 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -17.909 -15.005 8.636 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -19.403 -14.116 8.416 1.00 0.00 H new ATOM 1632 N GLN A 108 -16.010 -10.906 11.300 1.00 0.00 N ATOM 1633 CA GLN A 108 -14.721 -10.733 11.960 1.00 0.00 C ATOM 1634 C GLN A 108 -14.560 -11.726 13.106 1.00 0.00 C ATOM 1635 O GLN A 108 -15.402 -11.798 14.002 1.00 0.00 O ATOM 1636 CB GLN A 108 -14.581 -9.303 12.485 1.00 0.00 C ATOM 1637 CG GLN A 108 -13.299 -9.065 13.266 1.00 0.00 C ATOM 1638 CD GLN A 108 -13.511 -8.182 14.481 1.00 0.00 C ATOM 1639 OE1 GLN A 108 -12.854 -8.351 15.508 1.00 0.00 O ATOM 1640 NE2 GLN A 108 -14.432 -7.232 14.369 1.00 0.00 N ATOM 0 H GLN A 108 -16.675 -10.151 11.468 1.00 0.00 H new ATOM 0 HA GLN A 108 -13.937 -10.921 11.227 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -14.618 -8.611 11.644 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -15.434 -9.074 13.124 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -12.889 -10.023 13.585 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -12.559 -8.604 12.611 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -14.954 -7.127 13.499 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -14.618 -6.607 15.153 1.00 0.00 H new ATOM 1649 N ARG A 109 -13.473 -12.490 13.072 1.00 0.00 N ATOM 1650 CA ARG A 109 -13.202 -13.481 14.107 1.00 0.00 C ATOM 1651 C ARG A 109 -12.929 -12.805 15.447 1.00 0.00 C ATOM 1652 O ARG A 109 -11.781 -12.513 15.785 1.00 0.00 O ATOM 1653 CB ARG A 109 -12.008 -14.351 13.710 1.00 0.00 C ATOM 1654 CG ARG A 109 -12.294 -15.843 13.775 1.00 0.00 C ATOM 1655 CD ARG A 109 -12.532 -16.302 15.205 1.00 0.00 C ATOM 1656 NE ARG A 109 -13.670 -17.211 15.305 1.00 0.00 N ATOM 1657 CZ ARG A 109 -14.211 -17.587 16.459 1.00 0.00 C ATOM 1658 NH1 ARG A 109 -13.720 -17.133 17.604 1.00 0.00 N ATOM 1659 NH2 ARG A 109 -15.246 -18.417 16.469 1.00 0.00 N ATOM 0 H ARG A 109 -12.765 -12.442 12.339 1.00 0.00 H new ATOM 0 HA ARG A 109 -14.084 -14.113 14.211 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -11.701 -14.092 12.697 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -11.168 -14.122 14.366 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -13.169 -16.074 13.167 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -11.456 -16.394 13.349 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -11.637 -16.799 15.580 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -12.705 -15.434 15.841 1.00 0.00 H new ATOM 0 HE ARG A 109 -14.072 -17.577 14.442 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -12.925 -16.494 17.600 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -14.137 -17.423 18.488 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -15.627 -18.767 15.590 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -15.660 -18.705 17.355 1.00 0.00 H new ATOM 1673 N LEU A 110 -13.990 -12.560 16.207 1.00 0.00 N ATOM 1674 CA LEU A 110 -13.866 -11.918 17.511 1.00 0.00 C ATOM 1675 C LEU A 110 -13.810 -12.957 18.627 1.00 0.00 C ATOM 1676 O LEU A 110 -13.522 -14.129 18.383 1.00 0.00 O ATOM 1677 CB LEU A 110 -15.038 -10.963 17.746 1.00 0.00 C ATOM 1678 CG LEU A 110 -14.673 -9.555 18.218 1.00 0.00 C ATOM 1679 CD1 LEU A 110 -15.229 -8.511 17.262 1.00 0.00 C ATOM 1680 CD2 LEU A 110 -15.186 -9.316 19.630 1.00 0.00 C ATOM 0 H LEU A 110 -14.946 -12.796 15.943 1.00 0.00 H new ATOM 0 HA LEU A 110 -12.936 -11.350 17.521 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -15.603 -10.878 16.818 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -15.703 -11.411 18.484 1.00 0.00 H new ATOM 0 HG LEU A 110 -13.587 -9.466 18.228 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -14.959 -7.515 17.614 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -14.812 -8.670 16.267 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -16.315 -8.599 17.219 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -14.917 -8.309 19.949 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -16.270 -9.424 19.646 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -14.739 -10.043 20.308 1.00 0.00 H new ATOM 1692 N ASP A 111 -14.090 -12.520 19.850 1.00 0.00 N ATOM 1693 CA ASP A 111 -14.075 -13.413 21.002 1.00 0.00 C ATOM 1694 C ASP A 111 -15.154 -14.483 20.875 1.00 0.00 C ATOM 1695 O ASP A 111 -15.665 -14.735 19.784 1.00 0.00 O ATOM 1696 CB ASP A 111 -14.278 -12.617 22.293 1.00 0.00 C ATOM 1697 CG ASP A 111 -13.116 -12.767 23.254 1.00 0.00 C ATOM 1698 OD1 ASP A 111 -12.143 -11.993 23.134 1.00 0.00 O ATOM 1699 OD2 ASP A 111 -13.179 -13.657 24.128 1.00 0.00 O ATOM 0 H ASP A 111 -14.330 -11.553 20.069 1.00 0.00 H new ATOM 0 HA ASP A 111 -13.103 -13.906 21.036 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -14.411 -11.563 22.049 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -15.194 -12.949 22.781 1.00 0.00 H new ATOM 1704 N GLN A 112 -15.495 -15.109 21.996 1.00 0.00 N ATOM 1705 CA GLN A 112 -16.512 -16.154 22.008 1.00 0.00 C ATOM 1706 C GLN A 112 -17.278 -16.153 23.328 1.00 0.00 C ATOM 1707 O GLN A 112 -17.519 -17.207 23.917 1.00 0.00 O ATOM 1708 CB GLN A 112 -15.870 -17.523 21.778 1.00 0.00 C ATOM 1709 CG GLN A 112 -16.597 -18.370 20.746 1.00 0.00 C ATOM 1710 CD GLN A 112 -17.769 -19.130 21.335 1.00 0.00 C ATOM 1711 OE1 GLN A 112 -18.481 -18.622 22.201 1.00 0.00 O ATOM 1712 NE2 GLN A 112 -17.975 -20.356 20.867 1.00 0.00 N ATOM 0 H GLN A 112 -15.082 -14.911 22.908 1.00 0.00 H new ATOM 0 HA GLN A 112 -17.215 -15.951 21.201 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -14.838 -17.382 21.458 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -15.839 -18.064 22.724 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -16.953 -17.728 19.941 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -15.896 -19.077 20.303 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -17.360 -20.738 20.149 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -18.748 -20.916 21.226 1.00 0.00 H new ATOM 1721 N SER A 113 -17.656 -14.964 23.786 1.00 0.00 N ATOM 1722 CA SER A 113 -18.391 -14.826 25.038 1.00 0.00 C ATOM 1723 C SER A 113 -19.482 -13.767 24.914 1.00 0.00 C ATOM 1724 O SER A 113 -19.225 -12.574 25.069 1.00 0.00 O ATOM 1725 CB SER A 113 -17.436 -14.461 26.176 1.00 0.00 C ATOM 1726 OG SER A 113 -16.367 -15.387 26.262 1.00 0.00 O ATOM 0 H SER A 113 -17.466 -14.083 23.309 1.00 0.00 H new ATOM 0 HA SER A 113 -18.863 -15.783 25.262 1.00 0.00 H new ATOM 0 HB2 SER A 113 -17.040 -13.458 26.015 1.00 0.00 H new ATOM 0 HB3 SER A 113 -17.981 -14.441 27.120 1.00 0.00 H new ATOM 0 HG SER A 113 -15.770 -15.131 26.996 1.00 0.00 H new ATOM 1732 N GLY A 114 -20.702 -14.213 24.633 1.00 0.00 N ATOM 1733 CA GLY A 114 -21.815 -13.292 24.492 1.00 0.00 C ATOM 1734 C GLY A 114 -22.405 -12.887 25.828 1.00 0.00 C ATOM 1735 O GLY A 114 -21.796 -13.074 26.882 1.00 0.00 O ATOM 0 H GLY A 114 -20.940 -15.196 24.500 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -21.480 -12.401 23.961 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -22.590 -13.755 23.881 1.00 0.00 H new ATOM 1739 N PRO A 115 -23.618 -12.317 25.795 1.00 0.00 N ATOM 1740 CA PRO A 115 -24.317 -11.871 27.005 1.00 0.00 C ATOM 1741 C PRO A 115 -24.781 -13.038 27.869 1.00 0.00 C ATOM 1742 O PRO A 115 -25.855 -13.599 27.648 1.00 0.00 O ATOM 1743 CB PRO A 115 -25.520 -11.100 26.456 1.00 0.00 C ATOM 1744 CG PRO A 115 -25.757 -11.680 25.104 1.00 0.00 C ATOM 1745 CD PRO A 115 -24.402 -12.063 24.575 1.00 0.00 C ATOM 0 HA PRO A 115 -23.672 -11.277 27.653 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -26.393 -11.220 27.097 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -25.312 -10.032 26.398 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -26.413 -12.548 25.161 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -26.242 -10.957 24.448 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -24.454 -12.947 23.940 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -23.965 -11.265 23.975 1.00 0.00 H new ATOM 1753 N SER A 116 -23.966 -13.400 28.855 1.00 0.00 N ATOM 1754 CA SER A 116 -24.292 -14.503 29.751 1.00 0.00 C ATOM 1755 C SER A 116 -25.675 -14.312 30.366 1.00 0.00 C ATOM 1756 O SER A 116 -26.345 -13.310 30.117 1.00 0.00 O ATOM 1757 CB SER A 116 -23.241 -14.618 30.857 1.00 0.00 C ATOM 1758 OG SER A 116 -21.931 -14.502 30.329 1.00 0.00 O ATOM 0 H SER A 116 -23.075 -12.945 29.053 1.00 0.00 H new ATOM 0 HA SER A 116 -24.297 -15.424 29.167 1.00 0.00 H new ATOM 0 HB2 SER A 116 -23.406 -13.840 31.602 1.00 0.00 H new ATOM 0 HB3 SER A 116 -23.348 -15.576 31.366 1.00 0.00 H new ATOM 0 HG SER A 116 -21.278 -14.577 31.056 1.00 0.00 H new ATOM 1764 N SER A 117 -26.096 -15.282 31.172 1.00 0.00 N ATOM 1765 CA SER A 117 -27.401 -15.224 31.821 1.00 0.00 C ATOM 1766 C SER A 117 -28.498 -14.910 30.808 1.00 0.00 C ATOM 1767 O SER A 117 -28.715 -13.753 30.449 1.00 0.00 O ATOM 1768 CB SER A 117 -27.397 -14.169 32.929 1.00 0.00 C ATOM 1769 OG SER A 117 -26.074 -13.810 33.286 1.00 0.00 O ATOM 0 H SER A 117 -25.553 -16.117 31.391 1.00 0.00 H new ATOM 0 HA SER A 117 -27.605 -16.201 32.260 1.00 0.00 H new ATOM 0 HB2 SER A 117 -27.940 -13.285 32.595 1.00 0.00 H new ATOM 0 HB3 SER A 117 -27.921 -14.554 33.804 1.00 0.00 H new ATOM 0 HG SER A 117 -26.099 -13.133 33.994 1.00 0.00 H new ATOM 1775 N GLY A 118 -29.188 -15.951 30.350 1.00 0.00 N ATOM 1776 CA GLY A 118 -30.254 -15.766 29.383 1.00 0.00 C ATOM 1777 C GLY A 118 -29.773 -15.097 28.111 1.00 0.00 C ATOM 1778 O GLY A 118 -28.573 -15.046 27.844 1.00 0.00 O ATOM 0 H GLY A 118 -29.028 -16.918 30.631 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -30.690 -16.734 29.138 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -31.045 -15.164 29.830 1.00 0.00 H new TER 1782 GLY A 118