USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1036 hydrogens (94 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 NoAdj-H: A 78 ASNHD21 : A 78 ASN ND2 : A 136 NAG C1 :(H bumps) USER MOD NoAdj-H: A 111 ASNHD21 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD Set 1.1: A 71 THR OG1 : rot 140:sc= -0.101 USER MOD Set 1.2: A 138 FUC O4 : rot 150:sc= 0.118 USER MOD Set 2.1: A 30 THR OG1 : rot 180:sc= -0.51 USER MOD Set 2.2: A 53 MET CE :methyl -133:sc= -6.34 (180deg=-11.7!) USER MOD Set 3.1: A 18 SER OG : rot 98:sc= 2.01 USER MOD Set 3.2: A 80 THR OG1 : rot 179:sc= 1.06 USER MOD Single : A 1 MET CE :methyl 140:sc= -0.171 (180deg=-1.02) USER MOD Single : A 1AALA N :NH3+ -116:sc= 0.0753 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 5 GLN : amide:sc= -6.94! C(o=-6.9!,f=-11!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 88:sc= 1.22 USER MOD Single : A 25 SER OG : rot -23:sc= -3.45! USER MOD Single : A 28 LYS NZ :NH3+ -158:sc= -0.652 (180deg=-1.96) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 GLN :FLIP amide:sc= -0.958 F(o=-4.7!,f=-0.96) USER MOD Single : A 42 SER OG : rot 180:sc= -0.212 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot -148:sc= 0.606! USER MOD Single : A 52 TYR OH : rot -65:sc= 0.00213 USER MOD Single : A 54 MET CE :methyl -108:sc= -1.51 (180deg=-3.38!) USER MOD Single : A 56 ASN : amide:sc= -0.464 K(o=-0.46,f=-1.1) USER MOD Single : A 59 THR OG1 : rot 86:sc= -2.21! USER MOD Single : A 64 SER OG : rot -40:sc= 1.08 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 110:sc= 0.46 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 76 GLN : amide:sc= -0.364 X(o=-0.36,f=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 98:sc= 0.271 USER MOD Single : A 92 TYR OH : rot 162:sc= 1.26 USER MOD Single : A 95 LYS NZ :NH3+ -172:sc= -0.0849 (180deg=-0.173) USER MOD Single : A 99 MET CE :methyl -149:sc= -0.37 (180deg=-1.62!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= -1.64 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -41:sc= 0.122 USER MOD Single : A 114 GLN : amide:sc= -0.321 X(o=-0.32,f=-0.48) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 180:sc= -0.131 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 NAG O3 : rot 134:sc= 0.00273 USER MOD Single : A 133 NAG O3 : rot -170:sc= -0.973 USER MOD Single : A 133 NAG O6 : rot 180:sc= 0 USER MOD Single : A 134 FUL O2 : rot 149:sc= 0.00308 USER MOD Single : A 134 FUL O3 : rot 180:sc= 0 USER MOD Single : A 134 FUL O4 : rot -92:sc= -4.81! USER MOD Single : A 135 BMA O2 : rot 149:sc= 0.0725 USER MOD Single : A 135 BMA O3 : rot 180:sc= 0.0675 USER MOD Single : A 135 BMA O4 : rot 160:sc= 0 USER MOD Single : A 135 BMA O6 : rot 180:sc= -0.0316 USER MOD Single : A 136 NAG O3 : rot 180:sc= -1.27 USER MOD Single : A 137 NAG O3 : rot -150:sc= -0.613 USER MOD Single : A 137 NAG O6 : rot 180:sc= -0.028 USER MOD Single : A 138 FUC O2 : rot 26:sc=0.000388 USER MOD Single : A 138 FUC O3 : rot -89:sc= 0.134 USER MOD Single : A 139 BMA O2 : rot 145:sc= 0.0581 USER MOD Single : A 139 BMA O3 : rot 180:sc= 0.0642 USER MOD Single : A 139 BMA O4 : rot 160:sc= 0 USER MOD Single : A 139 BMA O6 : rot 29:sc= 0.0176 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1A -14.587 7.678 2.549 1.00 0.00 N ATOM 2 CA ALA A 1A -13.623 7.086 3.520 1.00 0.00 C ATOM 3 C ALA A 1A -12.758 6.029 2.828 1.00 0.00 C ATOM 4 O ALA A 1A -13.071 5.570 1.747 1.00 0.00 O ATOM 5 CB ALA A 1A -14.493 6.444 4.600 1.00 0.00 C ATOM 0 H1 ALA A 1A -14.377 8.689 2.424 1.00 0.00 H new ATOM 0 H2 ALA A 1A -14.501 7.191 1.634 1.00 0.00 H new ATOM 0 H3 ALA A 1A -15.556 7.567 2.910 1.00 0.00 H new ATOM 0 HA ALA A 1A -12.943 7.831 3.934 1.00 0.00 H new ATOM 0 HB1 ALA A 1A -13.855 5.984 5.355 1.00 0.00 H new ATOM 0 HB2 ALA A 1A -15.116 7.207 5.067 1.00 0.00 H new ATOM 0 HB3 ALA A 1A -15.129 5.682 4.150 1.00 0.00 H new ATOM 13 N MET A 1 -11.668 5.640 3.448 1.00 0.00 N ATOM 14 CA MET A 1 -10.762 4.608 2.841 1.00 0.00 C ATOM 15 C MET A 1 -10.346 5.016 1.422 1.00 0.00 C ATOM 16 O MET A 1 -11.078 4.816 0.471 1.00 0.00 O ATOM 17 CB MET A 1 -11.579 3.312 2.809 1.00 0.00 C ATOM 18 CG MET A 1 -10.703 2.168 2.296 1.00 0.00 C ATOM 19 SD MET A 1 -11.705 0.669 2.129 1.00 0.00 S ATOM 20 CE MET A 1 -12.655 1.192 0.681 1.00 0.00 C ATOM 0 H MET A 1 -11.364 5.995 4.355 1.00 0.00 H new ATOM 0 HA MET A 1 -9.843 4.494 3.416 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.951 3.080 3.807 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.450 3.434 2.165 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.265 2.434 1.334 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.877 1.991 2.985 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.774 0.349 0.000 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.637 1.544 0.998 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.127 1.998 0.171 1.00 0.00 H new ATOM 30 N HIS A 2 -9.175 5.584 1.278 1.00 0.00 N ATOM 31 CA HIS A 2 -8.704 6.007 -0.076 1.00 0.00 C ATOM 32 C HIS A 2 -7.659 5.026 -0.603 1.00 0.00 C ATOM 33 O HIS A 2 -6.767 5.388 -1.347 1.00 0.00 O ATOM 34 CB HIS A 2 -8.098 7.397 0.121 1.00 0.00 C ATOM 35 CG HIS A 2 -9.158 8.345 0.612 1.00 0.00 C ATOM 36 ND1 HIS A 2 -9.331 8.629 1.957 1.00 0.00 N ATOM 37 CD2 HIS A 2 -10.108 9.082 -0.052 1.00 0.00 C ATOM 38 CE1 HIS A 2 -10.349 9.503 2.060 1.00 0.00 C ATOM 39 NE2 HIS A 2 -10.859 9.812 0.865 1.00 0.00 N ATOM 0 H HIS A 2 -8.524 5.773 2.040 1.00 0.00 H new ATOM 0 HA HIS A 2 -9.514 6.024 -0.805 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -7.278 7.349 0.838 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -7.679 7.759 -0.818 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -10.251 9.093 -1.122 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -10.710 9.906 2.995 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -11.633 10.447 0.667 1.00 0.00 H new ATOM 47 N VAL A 3 -7.774 3.786 -0.220 1.00 0.00 N ATOM 48 CA VAL A 3 -6.802 2.750 -0.687 1.00 0.00 C ATOM 49 C VAL A 3 -7.523 1.404 -0.828 1.00 0.00 C ATOM 50 O VAL A 3 -8.462 1.122 -0.107 1.00 0.00 O ATOM 51 CB VAL A 3 -5.724 2.682 0.403 1.00 0.00 C ATOM 52 CG1 VAL A 3 -4.640 1.680 -0.005 1.00 0.00 C ATOM 53 CG2 VAL A 3 -5.088 4.064 0.592 1.00 0.00 C ATOM 0 H VAL A 3 -8.505 3.440 0.402 1.00 0.00 H new ATOM 0 HA VAL A 3 -6.367 2.989 -1.657 1.00 0.00 H new ATOM 0 HB VAL A 3 -6.184 2.363 1.338 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.876 1.634 0.771 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.086 0.694 -0.134 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -4.185 1.998 -0.943 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.323 4.010 1.367 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.633 4.386 -0.345 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.855 4.780 0.888 1.00 0.00 H new ATOM 63 N ALA A 4 -7.102 0.577 -1.754 1.00 0.00 N ATOM 64 CA ALA A 4 -7.779 -0.748 -1.942 1.00 0.00 C ATOM 65 C ALA A 4 -6.753 -1.872 -2.099 1.00 0.00 C ATOM 66 O ALA A 4 -5.777 -1.740 -2.813 1.00 0.00 O ATOM 67 CB ALA A 4 -8.599 -0.600 -3.222 1.00 0.00 C ATOM 0 H ALA A 4 -6.322 0.759 -2.386 1.00 0.00 H new ATOM 0 HA ALA A 4 -8.396 -1.007 -1.082 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -9.125 -1.532 -3.427 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -9.323 0.206 -3.099 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.935 -0.368 -4.055 1.00 0.00 H new ATOM 73 N GLN A 5 -6.974 -2.979 -1.435 1.00 0.00 N ATOM 74 CA GLN A 5 -6.020 -4.126 -1.537 1.00 0.00 C ATOM 75 C GLN A 5 -6.794 -5.453 -1.598 1.00 0.00 C ATOM 76 O GLN A 5 -7.829 -5.582 -0.975 1.00 0.00 O ATOM 77 CB GLN A 5 -5.190 -4.078 -0.250 1.00 0.00 C ATOM 78 CG GLN A 5 -4.551 -2.696 -0.088 1.00 0.00 C ATOM 79 CD GLN A 5 -5.431 -1.843 0.829 1.00 0.00 C ATOM 80 OE1 GLN A 5 -5.800 -0.740 0.483 1.00 0.00 O ATOM 81 NE2 GLN A 5 -5.798 -2.320 1.986 1.00 0.00 N ATOM 0 H GLN A 5 -7.776 -3.138 -0.825 1.00 0.00 H new ATOM 0 HA GLN A 5 -5.402 -4.059 -2.432 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -5.824 -4.297 0.609 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -4.415 -4.844 -0.279 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -3.550 -2.791 0.333 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -4.443 -2.215 -1.060 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -5.488 -3.247 2.277 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -6.395 -1.766 2.600 1.00 0.00 H new ATOM 90 N PRO A 6 -6.265 -6.414 -2.326 1.00 0.00 N ATOM 91 CA PRO A 6 -6.929 -7.739 -2.411 1.00 0.00 C ATOM 92 C PRO A 6 -6.811 -8.456 -1.071 1.00 0.00 C ATOM 93 O PRO A 6 -5.847 -8.281 -0.353 1.00 0.00 O ATOM 94 CB PRO A 6 -6.155 -8.465 -3.509 1.00 0.00 C ATOM 95 CG PRO A 6 -4.815 -7.807 -3.537 1.00 0.00 C ATOM 96 CD PRO A 6 -5.021 -6.376 -3.114 1.00 0.00 C ATOM 0 HA PRO A 6 -7.994 -7.684 -2.635 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.067 -9.530 -3.292 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -6.659 -8.376 -4.472 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -4.122 -8.313 -2.864 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -4.382 -7.856 -4.536 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -4.183 -6.011 -2.520 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -5.114 -5.714 -3.975 1.00 0.00 H new ATOM 104 N ALA A 7 -7.783 -9.252 -0.721 1.00 0.00 N ATOM 105 CA ALA A 7 -7.720 -9.973 0.581 1.00 0.00 C ATOM 106 C ALA A 7 -6.946 -11.272 0.426 1.00 0.00 C ATOM 107 O ALA A 7 -6.449 -11.811 1.399 1.00 0.00 O ATOM 108 CB ALA A 7 -9.173 -10.245 0.968 1.00 0.00 C ATOM 0 H ALA A 7 -8.617 -9.434 -1.279 1.00 0.00 H new ATOM 0 HA ALA A 7 -7.207 -9.392 1.347 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.203 -10.775 1.920 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.708 -9.300 1.062 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.647 -10.854 0.198 1.00 0.00 H new ATOM 114 N VAL A 8 -6.823 -11.783 -0.777 1.00 0.00 N ATOM 115 CA VAL A 8 -6.065 -13.035 -0.940 1.00 0.00 C ATOM 116 C VAL A 8 -5.645 -13.176 -2.401 1.00 0.00 C ATOM 117 O VAL A 8 -6.233 -12.573 -3.281 1.00 0.00 O ATOM 118 CB VAL A 8 -7.059 -14.125 -0.507 1.00 0.00 C ATOM 119 CG1 VAL A 8 -8.074 -14.529 -1.604 1.00 0.00 C ATOM 120 CG2 VAL A 8 -6.311 -15.336 -0.007 1.00 0.00 C ATOM 0 H VAL A 8 -7.213 -11.385 -1.632 1.00 0.00 H new ATOM 0 HA VAL A 8 -5.147 -13.086 -0.355 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.653 -13.692 0.297 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.738 -15.302 -1.218 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.661 -13.658 -1.895 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.538 -14.912 -2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.023 -16.103 0.298 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -5.676 -15.726 -0.803 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -5.693 -15.055 0.846 1.00 0.00 H new ATOM 130 N VAL A 9 -4.663 -13.976 -2.665 1.00 0.00 N ATOM 131 CA VAL A 9 -4.229 -14.177 -4.074 1.00 0.00 C ATOM 132 C VAL A 9 -3.959 -15.660 -4.336 1.00 0.00 C ATOM 133 O VAL A 9 -3.746 -16.437 -3.424 1.00 0.00 O ATOM 134 CB VAL A 9 -2.971 -13.318 -4.245 1.00 0.00 C ATOM 135 CG1 VAL A 9 -2.204 -13.700 -5.522 1.00 0.00 C ATOM 136 CG2 VAL A 9 -3.377 -11.850 -4.352 1.00 0.00 C ATOM 0 H VAL A 9 -4.137 -14.503 -1.968 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.993 -13.881 -4.793 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.327 -13.485 -3.381 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -1.317 -13.073 -5.615 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.904 -14.747 -5.467 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.846 -13.551 -6.390 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.486 -11.234 -4.474 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.032 -11.715 -5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -3.904 -11.551 -3.446 1.00 0.00 H new ATOM 146 N LEU A 10 -3.974 -16.049 -5.583 1.00 0.00 N ATOM 147 CA LEU A 10 -3.726 -17.479 -5.927 1.00 0.00 C ATOM 148 C LEU A 10 -2.496 -17.602 -6.835 1.00 0.00 C ATOM 149 O LEU A 10 -2.385 -16.920 -7.837 1.00 0.00 O ATOM 150 CB LEU A 10 -4.986 -17.930 -6.675 1.00 0.00 C ATOM 151 CG LEU A 10 -6.219 -17.768 -5.776 1.00 0.00 C ATOM 152 CD1 LEU A 10 -7.475 -18.152 -6.561 1.00 0.00 C ATOM 153 CD2 LEU A 10 -6.089 -18.669 -4.543 1.00 0.00 C ATOM 0 H LEU A 10 -4.148 -15.436 -6.380 1.00 0.00 H new ATOM 0 HA LEU A 10 -3.532 -18.087 -5.043 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.109 -17.341 -7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.884 -18.971 -6.981 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.293 -16.730 -5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.352 -18.037 -5.924 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.572 -17.504 -7.432 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.397 -19.189 -6.888 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.968 -18.548 -3.910 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.010 -19.709 -4.859 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.197 -18.391 -3.982 1.00 0.00 H new ATOM 165 N ALA A 11 -1.584 -18.479 -6.499 1.00 0.00 N ATOM 166 CA ALA A 11 -0.366 -18.669 -7.347 1.00 0.00 C ATOM 167 C ALA A 11 -0.549 -19.920 -8.211 1.00 0.00 C ATOM 168 O ALA A 11 -0.983 -20.948 -7.727 1.00 0.00 O ATOM 169 CB ALA A 11 0.785 -18.852 -6.356 1.00 0.00 C ATOM 0 H ALA A 11 -1.630 -19.074 -5.672 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.179 -17.832 -8.019 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.716 -18.998 -6.903 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.868 -17.966 -5.727 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.592 -19.724 -5.731 1.00 0.00 H new ATOM 175 N SER A 12 -0.254 -19.839 -9.487 1.00 0.00 N ATOM 176 CA SER A 12 -0.453 -21.038 -10.371 1.00 0.00 C ATOM 177 C SER A 12 0.732 -21.271 -11.320 1.00 0.00 C ATOM 178 O SER A 12 1.535 -20.393 -11.567 1.00 0.00 O ATOM 179 CB SER A 12 -1.715 -20.721 -11.171 1.00 0.00 C ATOM 180 OG SER A 12 -2.822 -20.626 -10.285 1.00 0.00 O ATOM 0 H SER A 12 0.111 -19.008 -9.952 1.00 0.00 H new ATOM 0 HA SER A 12 -0.536 -21.950 -9.780 1.00 0.00 H new ATOM 0 HB2 SER A 12 -1.589 -19.785 -11.715 1.00 0.00 H new ATOM 0 HB3 SER A 12 -1.894 -21.499 -11.913 1.00 0.00 H new ATOM 0 HG SER A 12 -3.633 -20.421 -10.796 1.00 0.00 H new ATOM 186 N SER A 13 0.822 -22.466 -11.867 1.00 0.00 N ATOM 187 CA SER A 13 1.924 -22.810 -12.828 1.00 0.00 C ATOM 188 C SER A 13 3.309 -22.635 -12.162 1.00 0.00 C ATOM 189 O SER A 13 3.626 -23.335 -11.218 1.00 0.00 O ATOM 190 CB SER A 13 1.715 -21.877 -14.032 1.00 0.00 C ATOM 191 OG SER A 13 2.605 -22.250 -15.075 1.00 0.00 O ATOM 0 H SER A 13 0.168 -23.227 -11.684 1.00 0.00 H new ATOM 0 HA SER A 13 1.896 -23.853 -13.144 1.00 0.00 H new ATOM 0 HB2 SER A 13 0.684 -21.938 -14.379 1.00 0.00 H new ATOM 0 HB3 SER A 13 1.892 -20.842 -13.740 1.00 0.00 H new ATOM 0 HG SER A 13 2.473 -21.658 -15.845 1.00 0.00 H new ATOM 197 N ARG A 14 4.138 -21.721 -12.631 1.00 0.00 N ATOM 198 CA ARG A 14 5.489 -21.527 -12.009 1.00 0.00 C ATOM 199 C ARG A 14 5.372 -21.142 -10.527 1.00 0.00 C ATOM 200 O ARG A 14 6.352 -21.162 -9.806 1.00 0.00 O ATOM 201 CB ARG A 14 6.143 -20.402 -12.818 1.00 0.00 C ATOM 202 CG ARG A 14 6.507 -20.913 -14.221 1.00 0.00 C ATOM 203 CD ARG A 14 8.001 -20.700 -14.482 1.00 0.00 C ATOM 204 NE ARG A 14 8.216 -21.137 -15.897 1.00 0.00 N ATOM 205 CZ ARG A 14 9.280 -20.760 -16.579 1.00 0.00 C ATOM 206 NH1 ARG A 14 10.199 -19.985 -16.049 1.00 0.00 N ATOM 207 NH2 ARG A 14 9.423 -21.166 -17.811 1.00 0.00 N ATOM 0 H ARG A 14 3.934 -21.104 -13.417 1.00 0.00 H new ATOM 0 HA ARG A 14 6.078 -22.444 -12.033 1.00 0.00 H new ATOM 0 HB2 ARG A 14 5.462 -19.554 -12.895 1.00 0.00 H new ATOM 0 HB3 ARG A 14 7.038 -20.047 -12.307 1.00 0.00 H new ATOM 0 HG2 ARG A 14 6.261 -21.971 -14.307 1.00 0.00 H new ATOM 0 HG3 ARG A 14 5.919 -20.387 -14.973 1.00 0.00 H new ATOM 0 HD2 ARG A 14 8.280 -19.655 -14.345 1.00 0.00 H new ATOM 0 HD3 ARG A 14 8.609 -21.285 -13.792 1.00 0.00 H new ATOM 0 HE ARG A 14 7.525 -21.739 -16.344 1.00 0.00 H new ATOM 0 HH11 ARG A 14 10.099 -19.660 -15.087 1.00 0.00 H new ATOM 0 HH12 ARG A 14 11.012 -19.709 -16.599 1.00 0.00 H new ATOM 0 HH21 ARG A 14 8.717 -21.767 -18.235 1.00 0.00 H new ATOM 0 HH22 ARG A 14 10.241 -20.882 -18.350 1.00 0.00 H new ATOM 221 N GLY A 15 4.197 -20.779 -10.067 1.00 0.00 N ATOM 222 CA GLY A 15 4.045 -20.383 -8.640 1.00 0.00 C ATOM 223 C GLY A 15 4.354 -18.900 -8.543 1.00 0.00 C ATOM 224 O GLY A 15 5.059 -18.450 -7.658 1.00 0.00 O ATOM 0 H GLY A 15 3.341 -20.742 -10.621 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.033 -20.587 -8.291 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.722 -20.958 -8.008 1.00 0.00 H new ATOM 228 N ILE A 16 3.840 -18.143 -9.473 1.00 0.00 N ATOM 229 CA ILE A 16 4.097 -16.688 -9.486 1.00 0.00 C ATOM 230 C ILE A 16 2.803 -15.974 -9.117 1.00 0.00 C ATOM 231 O ILE A 16 1.864 -15.941 -9.891 1.00 0.00 O ATOM 232 CB ILE A 16 4.503 -16.337 -10.926 1.00 0.00 C ATOM 233 CG1 ILE A 16 5.418 -17.409 -11.536 1.00 0.00 C ATOM 234 CG2 ILE A 16 5.234 -15.000 -10.929 1.00 0.00 C ATOM 235 CD1 ILE A 16 6.638 -17.656 -10.663 1.00 0.00 C ATOM 0 H ILE A 16 3.247 -18.481 -10.231 1.00 0.00 H new ATOM 0 HA ILE A 16 4.876 -16.393 -8.783 1.00 0.00 H new ATOM 0 HB ILE A 16 3.596 -16.282 -11.528 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.862 -18.338 -11.658 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.737 -17.095 -12.530 1.00 0.00 H new ATOM 0 HG21 ILE A 16 5.524 -14.746 -11.949 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.576 -14.225 -10.535 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.125 -15.071 -10.305 1.00 0.00 H new ATOM 0 HD11 ILE A 16 7.265 -18.420 -11.122 1.00 0.00 H new ATOM 0 HD12 ILE A 16 7.207 -16.732 -10.562 1.00 0.00 H new ATOM 0 HD13 ILE A 16 6.318 -17.994 -9.677 1.00 0.00 H new ATOM 247 N ALA A 17 2.742 -15.417 -7.945 1.00 0.00 N ATOM 248 CA ALA A 17 1.496 -14.713 -7.522 1.00 0.00 C ATOM 249 C ALA A 17 1.648 -13.210 -7.735 1.00 0.00 C ATOM 250 O ALA A 17 2.567 -12.595 -7.227 1.00 0.00 O ATOM 251 CB ALA A 17 1.331 -15.024 -6.036 1.00 0.00 C ATOM 0 H ALA A 17 3.497 -15.416 -7.259 1.00 0.00 H new ATOM 0 HA ALA A 17 0.630 -15.038 -8.098 1.00 0.00 H new ATOM 0 HB1 ALA A 17 0.432 -14.536 -5.660 1.00 0.00 H new ATOM 0 HB2 ALA A 17 1.244 -16.102 -5.897 1.00 0.00 H new ATOM 0 HB3 ALA A 17 2.199 -14.657 -5.489 1.00 0.00 H new ATOM 257 N SER A 18 0.754 -12.617 -8.478 1.00 0.00 N ATOM 258 CA SER A 18 0.843 -11.150 -8.722 1.00 0.00 C ATOM 259 C SER A 18 -0.476 -10.472 -8.347 1.00 0.00 C ATOM 260 O SER A 18 -1.543 -10.902 -8.744 1.00 0.00 O ATOM 261 CB SER A 18 1.120 -11.004 -10.218 1.00 0.00 C ATOM 262 OG SER A 18 1.450 -9.651 -10.498 1.00 0.00 O ATOM 0 H SER A 18 -0.034 -13.085 -8.926 1.00 0.00 H new ATOM 0 HA SER A 18 1.623 -10.681 -8.122 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.938 -11.660 -10.515 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.245 -11.305 -10.794 1.00 0.00 H new ATOM 0 HG SER A 18 2.424 -9.553 -10.535 1.00 0.00 H new ATOM 268 N PHE A 19 -0.402 -9.412 -7.590 1.00 0.00 N ATOM 269 CA PHE A 19 -1.639 -8.682 -7.181 1.00 0.00 C ATOM 270 C PHE A 19 -1.398 -7.175 -7.232 1.00 0.00 C ATOM 271 O PHE A 19 -0.272 -6.725 -7.341 1.00 0.00 O ATOM 272 CB PHE A 19 -1.949 -9.153 -5.757 1.00 0.00 C ATOM 273 CG PHE A 19 -0.796 -8.841 -4.828 1.00 0.00 C ATOM 274 CD1 PHE A 19 0.363 -9.662 -4.839 1.00 0.00 C ATOM 275 CD2 PHE A 19 -0.877 -7.737 -3.935 1.00 0.00 C ATOM 276 CE1 PHE A 19 1.442 -9.380 -3.960 1.00 0.00 C ATOM 277 CE2 PHE A 19 0.203 -7.456 -3.053 1.00 0.00 C ATOM 278 CZ PHE A 19 1.363 -8.278 -3.067 1.00 0.00 C ATOM 0 H PHE A 19 0.468 -9.016 -7.234 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.477 -8.886 -7.847 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.855 -8.666 -5.397 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.142 -10.226 -5.757 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.424 -10.501 -5.516 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.758 -7.112 -3.927 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.324 -10.004 -3.970 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.142 -6.619 -2.373 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.184 -8.065 -2.399 1.00 0.00 H new ATOM 288 N VAL A 20 -2.447 -6.396 -7.181 1.00 0.00 N ATOM 289 CA VAL A 20 -2.274 -4.914 -7.257 1.00 0.00 C ATOM 290 C VAL A 20 -2.900 -4.204 -6.052 1.00 0.00 C ATOM 291 O VAL A 20 -4.067 -4.369 -5.751 1.00 0.00 O ATOM 292 CB VAL A 20 -2.981 -4.496 -8.549 1.00 0.00 C ATOM 293 CG1 VAL A 20 -2.859 -2.982 -8.742 1.00 0.00 C ATOM 294 CG2 VAL A 20 -2.339 -5.203 -9.743 1.00 0.00 C ATOM 0 H VAL A 20 -3.410 -6.719 -7.091 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.219 -4.641 -7.250 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.033 -4.773 -8.480 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.364 -2.691 -9.663 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.320 -2.469 -7.898 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -1.806 -2.707 -8.803 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -2.846 -4.902 -10.660 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.286 -4.930 -9.804 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.427 -6.282 -9.617 1.00 0.00 H new ATOM 304 N CYS A 21 -2.129 -3.379 -5.395 1.00 0.00 N ATOM 305 CA CYS A 21 -2.649 -2.599 -4.237 1.00 0.00 C ATOM 306 C CYS A 21 -2.726 -1.130 -4.663 1.00 0.00 C ATOM 307 O CYS A 21 -1.732 -0.547 -5.049 1.00 0.00 O ATOM 308 CB CYS A 21 -1.610 -2.798 -3.131 1.00 0.00 C ATOM 309 SG CYS A 21 -2.170 -1.997 -1.609 1.00 0.00 S ATOM 0 H CYS A 21 -1.147 -3.211 -5.616 1.00 0.00 H new ATOM 0 HA CYS A 21 -3.638 -2.908 -3.900 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -1.452 -3.862 -2.955 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.652 -2.381 -3.441 1.00 0.00 H new ATOM 314 N GLU A 22 -3.890 -0.532 -4.644 1.00 0.00 N ATOM 315 CA GLU A 22 -3.983 0.886 -5.104 1.00 0.00 C ATOM 316 C GLU A 22 -3.845 1.874 -3.943 1.00 0.00 C ATOM 317 O GLU A 22 -4.139 1.568 -2.803 1.00 0.00 O ATOM 318 CB GLU A 22 -5.340 0.997 -5.812 1.00 0.00 C ATOM 319 CG GLU A 22 -6.476 1.035 -4.799 1.00 0.00 C ATOM 320 CD GLU A 22 -7.814 1.099 -5.539 1.00 0.00 C ATOM 321 OE1 GLU A 22 -7.955 0.399 -6.529 1.00 0.00 O ATOM 322 OE2 GLU A 22 -8.674 1.846 -5.104 1.00 0.00 O ATOM 0 H GLU A 22 -4.765 -0.955 -4.336 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.167 1.144 -5.779 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.363 1.898 -6.425 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.475 0.150 -6.485 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.441 0.150 -4.163 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.367 1.901 -4.146 1.00 0.00 H new ATOM 329 N TYR A 23 -3.398 3.062 -4.249 1.00 0.00 N ATOM 330 CA TYR A 23 -3.227 4.100 -3.213 1.00 0.00 C ATOM 331 C TYR A 23 -3.816 5.417 -3.734 1.00 0.00 C ATOM 332 O TYR A 23 -4.404 5.455 -4.800 1.00 0.00 O ATOM 333 CB TYR A 23 -1.710 4.179 -2.984 1.00 0.00 C ATOM 334 CG TYR A 23 -0.998 4.649 -4.233 1.00 0.00 C ATOM 335 CD1 TYR A 23 -0.671 3.723 -5.260 1.00 0.00 C ATOM 336 CD2 TYR A 23 -0.629 6.012 -4.364 1.00 0.00 C ATOM 337 CE1 TYR A 23 0.024 4.164 -6.419 1.00 0.00 C ATOM 338 CE2 TYR A 23 0.061 6.455 -5.521 1.00 0.00 C ATOM 339 CZ TYR A 23 0.391 5.531 -6.548 1.00 0.00 C ATOM 340 OH TYR A 23 1.068 5.961 -7.671 1.00 0.00 O ATOM 0 H TYR A 23 -3.142 3.354 -5.192 1.00 0.00 H new ATOM 0 HA TYR A 23 -3.739 3.883 -2.276 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -1.498 4.862 -2.161 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.331 3.200 -2.692 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -0.950 2.685 -5.160 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -0.874 6.714 -3.581 1.00 0.00 H new ATOM 0 HE1 TYR A 23 0.273 3.461 -7.200 1.00 0.00 H new ATOM 0 HE2 TYR A 23 0.336 7.495 -5.621 1.00 0.00 H new ATOM 0 HH TYR A 23 0.424 6.211 -8.366 1.00 0.00 H new ATOM 350 N ALA A 24 -3.690 6.480 -2.991 1.00 0.00 N ATOM 351 CA ALA A 24 -4.275 7.783 -3.444 1.00 0.00 C ATOM 352 C ALA A 24 -3.246 8.917 -3.393 1.00 0.00 C ATOM 353 O ALA A 24 -2.765 9.288 -2.339 1.00 0.00 O ATOM 354 CB ALA A 24 -5.416 8.058 -2.465 1.00 0.00 C ATOM 0 H ALA A 24 -3.210 6.508 -2.092 1.00 0.00 H new ATOM 0 HA ALA A 24 -4.610 7.729 -4.480 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.901 8.999 -2.726 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.144 7.248 -2.517 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -5.019 8.124 -1.452 1.00 0.00 H new ATOM 360 N SER A 25 -2.929 9.482 -4.531 1.00 0.00 N ATOM 361 CA SER A 25 -1.954 10.613 -4.576 1.00 0.00 C ATOM 362 C SER A 25 -2.103 11.373 -5.904 1.00 0.00 C ATOM 363 O SER A 25 -2.564 10.812 -6.878 1.00 0.00 O ATOM 364 CB SER A 25 -0.576 9.965 -4.485 1.00 0.00 C ATOM 365 OG SER A 25 -0.442 9.318 -3.227 1.00 0.00 O ATOM 0 H SER A 25 -3.307 9.206 -5.437 1.00 0.00 H new ATOM 0 HA SER A 25 -2.114 11.329 -3.770 1.00 0.00 H new ATOM 0 HB2 SER A 25 -0.446 9.245 -5.293 1.00 0.00 H new ATOM 0 HB3 SER A 25 0.202 10.720 -4.603 1.00 0.00 H new ATOM 0 HG SER A 25 -1.060 9.723 -2.583 1.00 0.00 H new ATOM 371 N PRO A 26 -1.705 12.627 -5.914 1.00 0.00 N ATOM 372 CA PRO A 26 -1.804 13.434 -7.158 1.00 0.00 C ATOM 373 C PRO A 26 -0.826 12.914 -8.223 1.00 0.00 C ATOM 374 O PRO A 26 -0.993 13.168 -9.402 1.00 0.00 O ATOM 375 CB PRO A 26 -1.441 14.845 -6.703 1.00 0.00 C ATOM 376 CG PRO A 26 -0.611 14.649 -5.477 1.00 0.00 C ATOM 377 CD PRO A 26 -1.129 13.406 -4.805 1.00 0.00 C ATOM 0 HA PRO A 26 -2.790 13.389 -7.621 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.887 15.379 -7.475 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -2.333 15.433 -6.487 1.00 0.00 H new ATOM 0 HG2 PRO A 26 0.442 14.540 -5.735 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -0.690 15.510 -4.814 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -0.331 12.859 -4.303 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.878 13.641 -4.049 1.00 0.00 H new ATOM 385 N GLY A 27 0.184 12.178 -7.819 1.00 0.00 N ATOM 386 CA GLY A 27 1.162 11.628 -8.806 1.00 0.00 C ATOM 387 C GLY A 27 2.149 12.715 -9.247 1.00 0.00 C ATOM 388 O GLY A 27 2.567 12.748 -10.389 1.00 0.00 O ATOM 0 H GLY A 27 0.371 11.936 -6.846 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.705 10.794 -8.362 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.631 11.237 -9.674 1.00 0.00 H new ATOM 392 N LYS A 28 2.531 13.596 -8.355 1.00 0.00 N ATOM 393 CA LYS A 28 3.500 14.673 -8.733 1.00 0.00 C ATOM 394 C LYS A 28 4.900 14.345 -8.214 1.00 0.00 C ATOM 395 O LYS A 28 5.701 15.228 -7.969 1.00 0.00 O ATOM 396 CB LYS A 28 2.975 15.951 -8.076 1.00 0.00 C ATOM 397 CG LYS A 28 1.619 16.320 -8.677 1.00 0.00 C ATOM 398 CD LYS A 28 1.227 17.728 -8.221 1.00 0.00 C ATOM 399 CE LYS A 28 -0.297 17.827 -8.099 1.00 0.00 C ATOM 400 NZ LYS A 28 -0.571 17.766 -6.636 1.00 0.00 N ATOM 0 H LYS A 28 2.216 13.617 -7.385 1.00 0.00 H new ATOM 0 HA LYS A 28 3.579 14.777 -9.815 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.879 15.805 -7.000 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.684 16.766 -8.225 1.00 0.00 H new ATOM 0 HG2 LYS A 28 1.668 16.279 -9.765 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.862 15.601 -8.364 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.693 17.953 -7.262 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.593 18.467 -8.934 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.668 18.756 -8.532 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.789 17.010 -8.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.551 17.457 -6.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 0.081 17.091 -6.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.434 18.708 -6.218 1.00 0.00 H new ATOM 414 N ALA A 29 5.196 13.085 -8.046 1.00 0.00 N ATOM 415 CA ALA A 29 6.547 12.691 -7.543 1.00 0.00 C ATOM 416 C ALA A 29 6.970 11.340 -8.128 1.00 0.00 C ATOM 417 O ALA A 29 6.160 10.454 -8.325 1.00 0.00 O ATOM 418 CB ALA A 29 6.391 12.593 -6.026 1.00 0.00 C ATOM 0 H ALA A 29 4.561 12.309 -8.235 1.00 0.00 H new ATOM 0 HA ALA A 29 7.315 13.409 -7.831 1.00 0.00 H new ATOM 0 HB1 ALA A 29 7.344 12.307 -5.580 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.080 13.559 -5.629 1.00 0.00 H new ATOM 0 HB3 ALA A 29 5.638 11.843 -5.785 1.00 0.00 H new ATOM 424 N THR A 30 8.241 11.181 -8.396 1.00 0.00 N ATOM 425 CA THR A 30 8.747 9.892 -8.960 1.00 0.00 C ATOM 426 C THR A 30 8.926 8.845 -7.885 1.00 0.00 C ATOM 427 O THR A 30 8.737 7.667 -8.104 1.00 0.00 O ATOM 428 CB THR A 30 10.155 10.178 -9.481 1.00 0.00 C ATOM 429 OG1 THR A 30 10.889 10.915 -8.503 1.00 0.00 O ATOM 430 CG2 THR A 30 10.125 10.920 -10.801 1.00 0.00 C ATOM 0 H THR A 30 8.955 11.894 -8.247 1.00 0.00 H new ATOM 0 HA THR A 30 8.043 9.534 -9.711 1.00 0.00 H new ATOM 0 HB THR A 30 10.652 9.225 -9.661 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.792 11.095 -8.839 1.00 0.00 H new ATOM 0 HG21 THR A 30 11.145 11.104 -11.138 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.600 10.319 -11.544 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.608 11.871 -10.672 1.00 0.00 H new ATOM 438 N GLU A 31 9.397 9.270 -6.759 1.00 0.00 N ATOM 439 CA GLU A 31 9.748 8.301 -5.693 1.00 0.00 C ATOM 440 C GLU A 31 8.531 7.820 -4.901 1.00 0.00 C ATOM 441 O GLU A 31 8.266 8.281 -3.806 1.00 0.00 O ATOM 442 CB GLU A 31 10.701 9.078 -4.768 1.00 0.00 C ATOM 443 CG GLU A 31 11.893 9.647 -5.574 1.00 0.00 C ATOM 444 CD GLU A 31 13.131 8.765 -5.373 1.00 0.00 C ATOM 445 OE1 GLU A 31 13.264 8.195 -4.304 1.00 0.00 O ATOM 446 OE2 GLU A 31 13.929 8.680 -6.290 1.00 0.00 O ATOM 0 H GLU A 31 9.556 10.250 -6.526 1.00 0.00 H new ATOM 0 HA GLU A 31 10.189 7.400 -6.120 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.162 9.891 -4.281 1.00 0.00 H new ATOM 0 HB3 GLU A 31 11.068 8.421 -3.979 1.00 0.00 H new ATOM 0 HG2 GLU A 31 11.638 9.694 -6.633 1.00 0.00 H new ATOM 0 HG3 GLU A 31 12.107 10.666 -5.252 1.00 0.00 H new ATOM 453 N VAL A 32 7.832 6.844 -5.423 1.00 0.00 N ATOM 454 CA VAL A 32 6.680 6.271 -4.673 1.00 0.00 C ATOM 455 C VAL A 32 7.215 5.069 -3.896 1.00 0.00 C ATOM 456 O VAL A 32 7.169 3.945 -4.361 1.00 0.00 O ATOM 457 CB VAL A 32 5.663 5.836 -5.729 1.00 0.00 C ATOM 458 CG1 VAL A 32 4.460 5.177 -5.042 1.00 0.00 C ATOM 459 CG2 VAL A 32 5.195 7.063 -6.517 1.00 0.00 C ATOM 0 H VAL A 32 8.011 6.422 -6.334 1.00 0.00 H new ATOM 0 HA VAL A 32 6.214 6.968 -3.977 1.00 0.00 H new ATOM 0 HB VAL A 32 6.126 5.121 -6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.736 4.867 -5.795 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.795 4.305 -4.480 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.994 5.890 -4.362 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.470 6.756 -7.271 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.731 7.777 -5.837 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.050 7.530 -7.005 1.00 0.00 H new ATOM 469 N ARG A 33 7.763 5.309 -2.735 1.00 0.00 N ATOM 470 CA ARG A 33 8.356 4.195 -1.938 1.00 0.00 C ATOM 471 C ARG A 33 7.307 3.140 -1.605 1.00 0.00 C ATOM 472 O ARG A 33 6.296 3.425 -0.989 1.00 0.00 O ATOM 473 CB ARG A 33 8.890 4.848 -0.659 1.00 0.00 C ATOM 474 CG ARG A 33 9.777 3.851 0.090 1.00 0.00 C ATOM 475 CD ARG A 33 10.390 4.533 1.315 1.00 0.00 C ATOM 476 NE ARG A 33 11.305 3.512 1.914 1.00 0.00 N ATOM 477 CZ ARG A 33 12.267 3.855 2.749 1.00 0.00 C ATOM 478 NH1 ARG A 33 12.479 5.109 3.078 1.00 0.00 N ATOM 479 NH2 ARG A 33 13.030 2.927 3.258 1.00 0.00 N ATOM 0 H ARG A 33 7.826 6.231 -2.303 1.00 0.00 H new ATOM 0 HA ARG A 33 9.142 3.682 -2.492 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.460 5.744 -0.906 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.061 5.162 -0.025 1.00 0.00 H new ATOM 0 HG2 ARG A 33 9.190 2.986 0.398 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.565 3.484 -0.567 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.935 5.434 1.033 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.620 4.836 2.024 1.00 0.00 H new ATOM 0 HE ARG A 33 11.182 2.529 1.671 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.893 5.845 2.685 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.230 5.346 3.726 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.879 1.949 3.009 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.777 3.179 3.905 1.00 0.00 H new ATOM 493 N VAL A 34 7.560 1.915 -1.991 1.00 0.00 N ATOM 494 CA VAL A 34 6.606 0.823 -1.685 1.00 0.00 C ATOM 495 C VAL A 34 7.329 -0.277 -0.909 1.00 0.00 C ATOM 496 O VAL A 34 8.409 -0.704 -1.273 1.00 0.00 O ATOM 497 CB VAL A 34 6.100 0.302 -3.033 1.00 0.00 C ATOM 498 CG1 VAL A 34 5.345 1.414 -3.763 1.00 0.00 C ATOM 499 CG2 VAL A 34 7.272 -0.171 -3.900 1.00 0.00 C ATOM 0 H VAL A 34 8.392 1.630 -2.507 1.00 0.00 H new ATOM 0 HA VAL A 34 5.773 1.166 -1.072 1.00 0.00 H new ATOM 0 HB VAL A 34 5.432 -0.540 -2.852 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.986 1.041 -4.722 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.497 1.736 -3.158 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.013 2.259 -3.930 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.894 -0.538 -4.854 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.954 0.661 -4.076 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.803 -0.973 -3.388 1.00 0.00 H new ATOM 509 N THR A 35 6.741 -0.721 0.162 1.00 0.00 N ATOM 510 CA THR A 35 7.382 -1.788 0.991 1.00 0.00 C ATOM 511 C THR A 35 6.475 -3.015 1.085 1.00 0.00 C ATOM 512 O THR A 35 5.301 -2.910 1.385 1.00 0.00 O ATOM 513 CB THR A 35 7.573 -1.165 2.378 1.00 0.00 C ATOM 514 OG1 THR A 35 8.331 0.031 2.256 1.00 0.00 O ATOM 515 CG2 THR A 35 8.316 -2.152 3.287 1.00 0.00 C ATOM 0 H THR A 35 5.839 -0.392 0.505 1.00 0.00 H new ATOM 0 HA THR A 35 8.325 -2.122 0.558 1.00 0.00 H new ATOM 0 HB THR A 35 6.599 -0.938 2.812 1.00 0.00 H new ATOM 0 HG1 THR A 35 8.453 0.433 3.142 1.00 0.00 H new ATOM 0 HG21 THR A 35 8.451 -1.708 4.273 1.00 0.00 H new ATOM 0 HG22 THR A 35 7.735 -3.070 3.379 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.290 -2.381 2.856 1.00 0.00 H new ATOM 523 N VAL A 36 7.021 -4.179 0.848 1.00 0.00 N ATOM 524 CA VAL A 36 6.210 -5.425 0.942 1.00 0.00 C ATOM 525 C VAL A 36 6.634 -6.190 2.202 1.00 0.00 C ATOM 526 O VAL A 36 7.813 -6.375 2.435 1.00 0.00 O ATOM 527 CB VAL A 36 6.547 -6.213 -0.329 1.00 0.00 C ATOM 528 CG1 VAL A 36 5.816 -7.559 -0.315 1.00 0.00 C ATOM 529 CG2 VAL A 36 6.105 -5.408 -1.556 1.00 0.00 C ATOM 0 H VAL A 36 7.998 -4.319 0.592 1.00 0.00 H new ATOM 0 HA VAL A 36 5.138 -5.243 1.015 1.00 0.00 H new ATOM 0 HB VAL A 36 7.622 -6.388 -0.370 1.00 0.00 H new ATOM 0 HG11 VAL A 36 6.059 -8.115 -1.221 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.127 -8.133 0.558 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.740 -7.388 -0.272 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.343 -5.965 -2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.030 -5.234 -1.509 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.627 -4.451 -1.571 1.00 0.00 H new ATOM 539 N LEU A 37 5.702 -6.612 3.036 1.00 0.00 N ATOM 540 CA LEU A 37 6.114 -7.335 4.282 1.00 0.00 C ATOM 541 C LEU A 37 5.448 -8.700 4.395 1.00 0.00 C ATOM 542 O LEU A 37 4.528 -9.022 3.673 1.00 0.00 O ATOM 543 CB LEU A 37 5.630 -6.465 5.441 1.00 0.00 C ATOM 544 CG LEU A 37 6.271 -5.088 5.379 1.00 0.00 C ATOM 545 CD1 LEU A 37 5.613 -4.191 6.426 1.00 0.00 C ATOM 546 CD2 LEU A 37 7.758 -5.220 5.684 1.00 0.00 C ATOM 0 H LEU A 37 4.698 -6.489 2.909 1.00 0.00 H new ATOM 0 HA LEU A 37 7.192 -7.498 4.281 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.545 -6.369 5.403 1.00 0.00 H new ATOM 0 HB3 LEU A 37 5.874 -6.944 6.389 1.00 0.00 H new ATOM 0 HG LEU A 37 6.139 -4.654 4.388 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.065 -3.200 6.391 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.546 -4.111 6.218 1.00 0.00 H new ATOM 0 HD13 LEU A 37 5.758 -4.621 7.417 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.227 -4.237 5.642 1.00 0.00 H new ATOM 0 HD22 LEU A 37 7.889 -5.642 6.680 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.224 -5.876 4.948 1.00 0.00 H new ATOM 558 N ARG A 38 5.899 -9.484 5.337 1.00 0.00 N ATOM 559 CA ARG A 38 5.292 -10.826 5.566 1.00 0.00 C ATOM 560 C ARG A 38 4.976 -10.980 7.056 1.00 0.00 C ATOM 561 O ARG A 38 5.856 -10.880 7.891 1.00 0.00 O ATOM 562 CB ARG A 38 6.359 -11.832 5.135 1.00 0.00 C ATOM 563 CG ARG A 38 5.793 -13.250 5.239 1.00 0.00 C ATOM 564 CD ARG A 38 6.928 -14.269 5.100 1.00 0.00 C ATOM 565 NE ARG A 38 6.286 -15.605 5.314 1.00 0.00 N ATOM 566 CZ ARG A 38 6.935 -16.726 5.067 1.00 0.00 C ATOM 567 NH1 ARG A 38 8.170 -16.722 4.619 1.00 0.00 N ATOM 568 NH2 ARG A 38 6.335 -17.867 5.272 1.00 0.00 N ATOM 0 H ARG A 38 6.669 -9.249 5.963 1.00 0.00 H new ATOM 0 HA ARG A 38 4.365 -10.972 5.012 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.674 -11.629 4.111 1.00 0.00 H new ATOM 0 HB3 ARG A 38 7.243 -11.734 5.766 1.00 0.00 H new ATOM 0 HG2 ARG A 38 5.288 -13.381 6.196 1.00 0.00 H new ATOM 0 HG3 ARG A 38 5.048 -13.413 4.461 1.00 0.00 H new ATOM 0 HD2 ARG A 38 7.393 -14.209 4.116 1.00 0.00 H new ATOM 0 HD3 ARG A 38 7.712 -14.087 5.835 1.00 0.00 H new ATOM 0 HE ARG A 38 5.327 -15.649 5.658 1.00 0.00 H new ATOM 0 HH11 ARG A 38 8.650 -15.837 4.454 1.00 0.00 H new ATOM 0 HH12 ARG A 38 8.649 -17.604 4.436 1.00 0.00 H new ATOM 0 HH21 ARG A 38 5.376 -17.884 5.619 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.825 -18.742 5.085 1.00 0.00 H new ATOM 582 N GLN A 39 3.733 -11.214 7.400 1.00 0.00 N ATOM 583 CA GLN A 39 3.377 -11.364 8.844 1.00 0.00 C ATOM 584 C GLN A 39 3.000 -12.807 9.169 1.00 0.00 C ATOM 585 O GLN A 39 2.209 -13.428 8.484 1.00 0.00 O ATOM 586 CB GLN A 39 2.187 -10.433 9.075 1.00 0.00 C ATOM 587 CG GLN A 39 2.657 -8.979 9.040 1.00 0.00 C ATOM 588 CD GLN A 39 1.452 -8.045 9.167 1.00 0.00 C ATOM 589 OE1 GLN A 39 0.536 -8.048 8.237 1.00 0.00 O flip ATOM 590 NE2 GLN A 39 1.340 -7.306 10.125 1.00 0.00 N flip ATOM 0 H GLN A 39 2.955 -11.307 6.747 1.00 0.00 H new ATOM 0 HA GLN A 39 4.219 -11.112 9.488 1.00 0.00 H new ATOM 0 HB2 GLN A 39 1.429 -10.599 8.309 1.00 0.00 H new ATOM 0 HB3 GLN A 39 1.722 -10.652 10.036 1.00 0.00 H new ATOM 0 HG2 GLN A 39 3.360 -8.794 9.852 1.00 0.00 H new ATOM 0 HG3 GLN A 39 3.187 -8.780 8.108 1.00 0.00 H new ATOM 0 HE21 GLN A 39 2.055 -7.302 10.853 1.00 0.00 H new ATOM 0 HE22 GLN A 39 0.531 -6.689 10.202 1.00 0.00 H new ATOM 599 N ALA A 40 3.560 -13.332 10.223 1.00 0.00 N ATOM 600 CA ALA A 40 3.250 -14.728 10.636 1.00 0.00 C ATOM 601 C ALA A 40 2.853 -14.736 12.112 1.00 0.00 C ATOM 602 O ALA A 40 3.262 -13.875 12.870 1.00 0.00 O ATOM 603 CB ALA A 40 4.552 -15.504 10.418 1.00 0.00 C ATOM 0 H ALA A 40 4.227 -12.847 10.823 1.00 0.00 H new ATOM 0 HA ALA A 40 2.426 -15.167 10.073 1.00 0.00 H new ATOM 0 HB1 ALA A 40 4.406 -16.547 10.701 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.837 -15.449 9.367 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.342 -15.069 11.031 1.00 0.00 H new ATOM 609 N ASP A 41 2.054 -15.685 12.525 1.00 0.00 N ATOM 610 CA ASP A 41 1.632 -15.733 13.959 1.00 0.00 C ATOM 611 C ASP A 41 2.851 -15.864 14.873 1.00 0.00 C ATOM 612 O ASP A 41 2.952 -15.198 15.886 1.00 0.00 O ATOM 613 CB ASP A 41 0.736 -16.960 14.078 1.00 0.00 C ATOM 614 CG ASP A 41 -0.605 -16.700 13.384 1.00 0.00 C ATOM 615 OD1 ASP A 41 -1.011 -15.550 13.325 1.00 0.00 O ATOM 616 OD2 ASP A 41 -1.207 -17.658 12.928 1.00 0.00 O ATOM 0 H ASP A 41 1.676 -16.427 11.935 1.00 0.00 H new ATOM 0 HA ASP A 41 1.112 -14.823 14.259 1.00 0.00 H new ATOM 0 HB2 ASP A 41 1.226 -17.823 13.628 1.00 0.00 H new ATOM 0 HB3 ASP A 41 0.571 -17.199 15.129 1.00 0.00 H new ATOM 621 N SER A 42 3.776 -16.722 14.522 1.00 0.00 N ATOM 622 CA SER A 42 4.994 -16.900 15.370 1.00 0.00 C ATOM 623 C SER A 42 5.907 -15.670 15.287 1.00 0.00 C ATOM 624 O SER A 42 6.404 -15.196 16.291 1.00 0.00 O ATOM 625 CB SER A 42 5.703 -18.128 14.798 1.00 0.00 C ATOM 626 OG SER A 42 6.124 -17.851 13.469 1.00 0.00 O ATOM 0 H SER A 42 3.740 -17.306 13.686 1.00 0.00 H new ATOM 0 HA SER A 42 4.736 -17.024 16.422 1.00 0.00 H new ATOM 0 HB2 SER A 42 6.562 -18.388 15.417 1.00 0.00 H new ATOM 0 HB3 SER A 42 5.032 -18.987 14.808 1.00 0.00 H new ATOM 0 HG SER A 42 6.580 -18.636 13.100 1.00 0.00 H new ATOM 632 N GLN A 43 6.135 -15.155 14.100 1.00 0.00 N ATOM 633 CA GLN A 43 7.028 -13.960 13.955 1.00 0.00 C ATOM 634 C GLN A 43 6.691 -13.164 12.687 1.00 0.00 C ATOM 635 O GLN A 43 6.093 -13.674 11.760 1.00 0.00 O ATOM 636 CB GLN A 43 8.447 -14.528 13.845 1.00 0.00 C ATOM 637 CG GLN A 43 8.906 -15.071 15.201 1.00 0.00 C ATOM 638 CD GLN A 43 10.402 -15.390 15.143 1.00 0.00 C ATOM 639 OE1 GLN A 43 10.946 -15.624 14.082 1.00 0.00 O ATOM 640 NE2 GLN A 43 11.095 -15.412 16.249 1.00 0.00 N ATOM 0 H GLN A 43 5.742 -15.510 13.228 1.00 0.00 H new ATOM 0 HA GLN A 43 6.912 -13.278 14.797 1.00 0.00 H new ATOM 0 HB2 GLN A 43 8.472 -15.323 13.100 1.00 0.00 H new ATOM 0 HB3 GLN A 43 9.132 -13.751 13.505 1.00 0.00 H new ATOM 0 HG2 GLN A 43 8.710 -14.338 15.984 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.342 -15.968 15.455 1.00 0.00 H new ATOM 0 HE21 GLN A 43 10.639 -15.216 17.140 1.00 0.00 H new ATOM 0 HE22 GLN A 43 12.092 -15.625 16.222 1.00 0.00 H new ATOM 649 N VAL A 44 7.098 -11.920 12.642 1.00 0.00 N ATOM 650 CA VAL A 44 6.842 -11.071 11.437 1.00 0.00 C ATOM 651 C VAL A 44 8.168 -10.465 10.959 1.00 0.00 C ATOM 652 O VAL A 44 8.992 -10.059 11.757 1.00 0.00 O ATOM 653 CB VAL A 44 5.881 -9.976 11.912 1.00 0.00 C ATOM 654 CG1 VAL A 44 5.628 -8.969 10.785 1.00 0.00 C ATOM 655 CG2 VAL A 44 4.551 -10.611 12.326 1.00 0.00 C ATOM 0 H VAL A 44 7.601 -11.452 13.395 1.00 0.00 H new ATOM 0 HA VAL A 44 6.419 -11.633 10.604 1.00 0.00 H new ATOM 0 HB VAL A 44 6.327 -9.458 12.761 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.944 -8.196 11.135 1.00 0.00 H new ATOM 0 HG12 VAL A 44 6.571 -8.511 10.488 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.189 -9.483 9.930 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.866 -9.833 12.664 1.00 0.00 H new ATOM 0 HG22 VAL A 44 4.116 -11.132 11.473 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.723 -11.320 13.136 1.00 0.00 H new ATOM 665 N THR A 45 8.381 -10.408 9.668 1.00 0.00 N ATOM 666 CA THR A 45 9.661 -9.833 9.147 1.00 0.00 C ATOM 667 C THR A 45 9.426 -9.083 7.831 1.00 0.00 C ATOM 668 O THR A 45 8.445 -9.305 7.147 1.00 0.00 O ATOM 669 CB THR A 45 10.576 -11.038 8.920 1.00 0.00 C ATOM 670 OG1 THR A 45 9.974 -11.916 7.979 1.00 0.00 O ATOM 671 CG2 THR A 45 10.799 -11.776 10.242 1.00 0.00 C ATOM 0 H THR A 45 7.728 -10.733 8.955 1.00 0.00 H new ATOM 0 HA THR A 45 10.094 -9.113 9.842 1.00 0.00 H new ATOM 0 HB THR A 45 11.537 -10.695 8.536 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.559 -12.688 7.831 1.00 0.00 H new ATOM 0 HG21 THR A 45 11.451 -12.633 10.075 1.00 0.00 H new ATOM 0 HG22 THR A 45 11.263 -11.102 10.961 1.00 0.00 H new ATOM 0 HG23 THR A 45 9.841 -12.120 10.633 1.00 0.00 H new ATOM 679 N GLU A 46 10.337 -8.213 7.467 1.00 0.00 N ATOM 680 CA GLU A 46 10.183 -7.449 6.197 1.00 0.00 C ATOM 681 C GLU A 46 10.622 -8.305 5.010 1.00 0.00 C ATOM 682 O GLU A 46 11.394 -9.234 5.151 1.00 0.00 O ATOM 683 CB GLU A 46 11.106 -6.232 6.336 1.00 0.00 C ATOM 684 CG GLU A 46 10.524 -5.244 7.349 1.00 0.00 C ATOM 685 CD GLU A 46 11.656 -4.424 7.971 1.00 0.00 C ATOM 686 OE1 GLU A 46 12.530 -5.022 8.577 1.00 0.00 O ATOM 687 OE2 GLU A 46 11.630 -3.213 7.829 1.00 0.00 O ATOM 0 H GLU A 46 11.181 -8.001 7.999 1.00 0.00 H new ATOM 0 HA GLU A 46 9.147 -7.157 6.024 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.097 -6.552 6.657 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.226 -5.745 5.369 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.809 -4.583 6.859 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.981 -5.781 8.126 1.00 0.00 H new ATOM 694 N VAL A 47 10.121 -7.996 3.842 1.00 0.00 N ATOM 695 CA VAL A 47 10.493 -8.783 2.635 1.00 0.00 C ATOM 696 C VAL A 47 11.283 -7.907 1.648 1.00 0.00 C ATOM 697 O VAL A 47 12.497 -7.946 1.627 1.00 0.00 O ATOM 698 CB VAL A 47 9.153 -9.245 2.044 1.00 0.00 C ATOM 699 CG1 VAL A 47 9.380 -9.968 0.716 1.00 0.00 C ATOM 700 CG2 VAL A 47 8.470 -10.202 3.024 1.00 0.00 C ATOM 0 H VAL A 47 9.469 -7.230 3.675 1.00 0.00 H new ATOM 0 HA VAL A 47 11.140 -9.630 2.864 1.00 0.00 H new ATOM 0 HB VAL A 47 8.523 -8.372 1.873 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.422 -10.290 0.309 1.00 0.00 H new ATOM 0 HG12 VAL A 47 9.865 -9.292 0.012 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.015 -10.838 0.880 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.518 -10.532 2.607 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.111 -11.067 3.194 1.00 0.00 H new ATOM 0 HG23 VAL A 47 8.294 -9.690 3.970 1.00 0.00 H new ATOM 710 N CYS A 48 10.613 -7.132 0.826 1.00 0.00 N ATOM 711 CA CYS A 48 11.341 -6.276 -0.164 1.00 0.00 C ATOM 712 C CYS A 48 10.990 -4.800 0.030 1.00 0.00 C ATOM 713 O CYS A 48 9.991 -4.468 0.641 1.00 0.00 O ATOM 714 CB CYS A 48 10.868 -6.764 -1.533 1.00 0.00 C ATOM 715 SG CYS A 48 11.390 -8.480 -1.780 1.00 0.00 S ATOM 0 H CYS A 48 9.596 -7.056 0.799 1.00 0.00 H new ATOM 0 HA CYS A 48 12.422 -6.354 -0.050 1.00 0.00 H new ATOM 0 HB2 CYS A 48 9.783 -6.690 -1.602 1.00 0.00 H new ATOM 0 HB3 CYS A 48 11.281 -6.131 -2.318 1.00 0.00 H new ATOM 720 N ALA A 49 11.811 -3.913 -0.481 1.00 0.00 N ATOM 721 CA ALA A 49 11.528 -2.451 -0.319 1.00 0.00 C ATOM 722 C ALA A 49 12.332 -1.623 -1.328 1.00 0.00 C ATOM 723 O ALA A 49 13.509 -1.851 -1.531 1.00 0.00 O ATOM 724 CB ALA A 49 11.965 -2.129 1.111 1.00 0.00 C ATOM 0 H ALA A 49 12.660 -4.136 -1.000 1.00 0.00 H new ATOM 0 HA ALA A 49 10.479 -2.214 -0.496 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.792 -1.072 1.315 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.389 -2.733 1.812 1.00 0.00 H new ATOM 0 HB3 ALA A 49 13.026 -2.352 1.226 1.00 0.00 H new ATOM 730 N ALA A 50 11.703 -0.657 -1.958 1.00 0.00 N ATOM 731 CA ALA A 50 12.426 0.198 -2.954 1.00 0.00 C ATOM 732 C ALA A 50 11.545 1.363 -3.402 1.00 0.00 C ATOM 733 O ALA A 50 10.345 1.357 -3.198 1.00 0.00 O ATOM 734 CB ALA A 50 12.704 -0.720 -4.140 1.00 0.00 C ATOM 0 H ALA A 50 10.719 -0.424 -1.825 1.00 0.00 H new ATOM 0 HA ALA A 50 13.337 0.624 -2.532 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.233 -0.164 -4.914 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.317 -1.561 -3.814 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.761 -1.092 -4.541 1.00 0.00 H new ATOM 740 N THR A 51 12.128 2.352 -4.035 1.00 0.00 N ATOM 741 CA THR A 51 11.318 3.504 -4.524 1.00 0.00 C ATOM 742 C THR A 51 11.006 3.298 -6.000 1.00 0.00 C ATOM 743 O THR A 51 11.903 3.127 -6.806 1.00 0.00 O ATOM 744 CB THR A 51 12.193 4.746 -4.345 1.00 0.00 C ATOM 745 OG1 THR A 51 12.866 4.676 -3.096 1.00 0.00 O ATOM 746 CG2 THR A 51 11.310 5.996 -4.372 1.00 0.00 C ATOM 0 H THR A 51 13.127 2.409 -4.232 1.00 0.00 H new ATOM 0 HA THR A 51 10.377 3.603 -3.982 1.00 0.00 H new ATOM 0 HB THR A 51 12.924 4.794 -5.152 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.986 5.580 -2.738 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.931 6.883 -4.245 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.788 6.052 -5.327 1.00 0.00 H new ATOM 0 HG23 THR A 51 10.581 5.944 -3.563 1.00 0.00 H new ATOM 754 N TYR A 52 9.751 3.307 -6.365 1.00 0.00 N ATOM 755 CA TYR A 52 9.404 3.107 -7.790 1.00 0.00 C ATOM 756 C TYR A 52 9.395 4.440 -8.518 1.00 0.00 C ATOM 757 O TYR A 52 8.477 5.226 -8.369 1.00 0.00 O ATOM 758 CB TYR A 52 7.998 2.517 -7.793 1.00 0.00 C ATOM 759 CG TYR A 52 7.640 2.128 -9.205 1.00 0.00 C ATOM 760 CD1 TYR A 52 7.244 3.121 -10.145 1.00 0.00 C ATOM 761 CD2 TYR A 52 7.718 0.769 -9.597 1.00 0.00 C ATOM 762 CE1 TYR A 52 6.922 2.746 -11.477 1.00 0.00 C ATOM 763 CE2 TYR A 52 7.398 0.394 -10.930 1.00 0.00 C ATOM 764 CZ TYR A 52 6.999 1.383 -11.869 1.00 0.00 C ATOM 765 OH TYR A 52 6.688 1.018 -13.164 1.00 0.00 O ATOM 0 H TYR A 52 8.959 3.444 -5.737 1.00 0.00 H new ATOM 0 HA TYR A 52 10.123 2.458 -8.289 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.952 1.647 -7.138 1.00 0.00 H new ATOM 0 HB3 TYR A 52 7.282 3.244 -7.408 1.00 0.00 H new ATOM 0 HD1 TYR A 52 7.188 4.157 -9.846 1.00 0.00 H new ATOM 0 HD2 TYR A 52 8.021 0.018 -8.883 1.00 0.00 H new ATOM 0 HE1 TYR A 52 6.619 3.497 -12.191 1.00 0.00 H new ATOM 0 HE2 TYR A 52 7.458 -0.642 -11.229 1.00 0.00 H new ATOM 0 HH TYR A 52 5.738 1.189 -13.333 1.00 0.00 H new ATOM 775 N MET A 53 10.384 4.682 -9.333 1.00 0.00 N ATOM 776 CA MET A 53 10.398 5.944 -10.111 1.00 0.00 C ATOM 777 C MET A 53 9.387 5.761 -11.242 1.00 0.00 C ATOM 778 O MET A 53 9.068 4.638 -11.592 1.00 0.00 O ATOM 779 CB MET A 53 11.818 6.074 -10.670 1.00 0.00 C ATOM 780 CG MET A 53 12.044 7.480 -11.229 1.00 0.00 C ATOM 781 SD MET A 53 13.395 8.270 -10.317 1.00 0.00 S ATOM 782 CE MET A 53 12.692 8.099 -8.657 1.00 0.00 C ATOM 0 H MET A 53 11.178 4.061 -9.491 1.00 0.00 H new ATOM 0 HA MET A 53 10.142 6.830 -9.530 1.00 0.00 H new ATOM 0 HB2 MET A 53 12.545 5.867 -9.885 1.00 0.00 H new ATOM 0 HB3 MET A 53 11.976 5.334 -11.455 1.00 0.00 H new ATOM 0 HG2 MET A 53 12.287 7.428 -12.290 1.00 0.00 H new ATOM 0 HG3 MET A 53 11.133 8.072 -11.139 1.00 0.00 H new ATOM 0 HE1 MET A 53 12.775 9.048 -8.127 1.00 0.00 H new ATOM 0 HE2 MET A 53 11.642 7.817 -8.734 1.00 0.00 H new ATOM 0 HE3 MET A 53 13.236 7.329 -8.109 1.00 0.00 H new ATOM 792 N MET A 54 8.867 6.814 -11.814 1.00 0.00 N ATOM 793 CA MET A 54 7.871 6.627 -12.918 1.00 0.00 C ATOM 794 C MET A 54 8.506 5.842 -14.073 1.00 0.00 C ATOM 795 O MET A 54 7.831 5.136 -14.798 1.00 0.00 O ATOM 796 CB MET A 54 7.469 8.031 -13.365 1.00 0.00 C ATOM 797 CG MET A 54 6.694 8.717 -12.239 1.00 0.00 C ATOM 798 SD MET A 54 5.208 7.757 -11.856 1.00 0.00 S ATOM 799 CE MET A 54 5.882 6.841 -10.446 1.00 0.00 C ATOM 0 H MET A 54 9.082 7.782 -11.573 1.00 0.00 H new ATOM 0 HA MET A 54 7.001 6.059 -12.588 1.00 0.00 H new ATOM 0 HB2 MET A 54 8.356 8.612 -13.618 1.00 0.00 H new ATOM 0 HB3 MET A 54 6.855 7.977 -14.264 1.00 0.00 H new ATOM 0 HG2 MET A 54 7.322 8.805 -11.352 1.00 0.00 H new ATOM 0 HG3 MET A 54 6.419 9.729 -12.536 1.00 0.00 H new ATOM 0 HE1 MET A 54 6.041 5.801 -10.730 1.00 0.00 H new ATOM 0 HE2 MET A 54 6.831 7.284 -10.145 1.00 0.00 H new ATOM 0 HE3 MET A 54 5.180 6.886 -9.613 1.00 0.00 H new ATOM 809 N GLY A 55 9.801 5.954 -14.238 1.00 0.00 N ATOM 810 CA GLY A 55 10.489 5.209 -15.333 1.00 0.00 C ATOM 811 C GLY A 55 10.355 3.703 -15.087 1.00 0.00 C ATOM 812 O GLY A 55 9.533 3.041 -15.692 1.00 0.00 O ATOM 0 H GLY A 55 10.411 6.531 -13.659 1.00 0.00 H new ATOM 0 HA2 GLY A 55 10.052 5.471 -16.296 1.00 0.00 H new ATOM 0 HA3 GLY A 55 11.541 5.490 -15.373 1.00 0.00 H new ATOM 816 N ASN A 56 11.157 3.156 -14.203 1.00 0.00 N ATOM 817 CA ASN A 56 11.075 1.690 -13.917 1.00 0.00 C ATOM 818 C ASN A 56 11.579 1.386 -12.502 1.00 0.00 C ATOM 819 O ASN A 56 12.005 2.267 -11.779 1.00 0.00 O ATOM 820 CB ASN A 56 11.980 1.025 -14.951 1.00 0.00 C ATOM 821 CG ASN A 56 11.451 -0.374 -15.269 1.00 0.00 C ATOM 822 OD1 ASN A 56 10.257 -0.575 -15.376 1.00 0.00 O ATOM 823 ND2 ASN A 56 12.294 -1.357 -15.428 1.00 0.00 N ATOM 0 H ASN A 56 11.863 3.662 -13.669 1.00 0.00 H new ATOM 0 HA ASN A 56 10.049 1.326 -13.975 1.00 0.00 H new ATOM 0 HB2 ASN A 56 12.016 1.627 -15.859 1.00 0.00 H new ATOM 0 HB3 ASN A 56 12.999 0.962 -14.570 1.00 0.00 H new ATOM 0 HD21 ASN A 56 11.951 -2.293 -15.642 1.00 0.00 H new ATOM 0 HD22 ASN A 56 13.296 -1.189 -15.338 1.00 0.00 H new ATOM 830 N GLU A 57 11.533 0.138 -12.110 1.00 0.00 N ATOM 831 CA GLU A 57 12.009 -0.253 -10.747 1.00 0.00 C ATOM 832 C GLU A 57 13.157 -1.264 -10.869 1.00 0.00 C ATOM 833 O GLU A 57 13.000 -2.322 -11.449 1.00 0.00 O ATOM 834 CB GLU A 57 10.789 -0.889 -10.081 1.00 0.00 C ATOM 835 CG GLU A 57 11.118 -1.245 -8.631 1.00 0.00 C ATOM 836 CD GLU A 57 11.296 0.037 -7.814 1.00 0.00 C ATOM 837 OE1 GLU A 57 12.326 0.673 -7.962 1.00 0.00 O ATOM 838 OE2 GLU A 57 10.398 0.360 -7.054 1.00 0.00 O ATOM 0 H GLU A 57 11.184 -0.633 -12.679 1.00 0.00 H new ATOM 0 HA GLU A 57 12.391 0.590 -10.172 1.00 0.00 H new ATOM 0 HB2 GLU A 57 9.945 -0.200 -10.114 1.00 0.00 H new ATOM 0 HB3 GLU A 57 10.491 -1.784 -10.626 1.00 0.00 H new ATOM 0 HG2 GLU A 57 10.319 -1.852 -8.205 1.00 0.00 H new ATOM 0 HG3 GLU A 57 12.028 -1.843 -8.591 1.00 0.00 H new ATOM 845 N LEU A 58 14.315 -0.934 -10.351 1.00 0.00 N ATOM 846 CA LEU A 58 15.484 -1.851 -10.464 1.00 0.00 C ATOM 847 C LEU A 58 16.045 -2.166 -9.080 1.00 0.00 C ATOM 848 O LEU A 58 17.237 -2.088 -8.847 1.00 0.00 O ATOM 849 CB LEU A 58 16.513 -1.060 -11.281 1.00 0.00 C ATOM 850 CG LEU A 58 15.985 -0.703 -12.687 1.00 0.00 C ATOM 851 CD1 LEU A 58 15.340 -1.921 -13.365 1.00 0.00 C ATOM 852 CD2 LEU A 58 14.973 0.450 -12.615 1.00 0.00 C ATOM 0 H LEU A 58 14.498 -0.063 -9.853 1.00 0.00 H new ATOM 0 HA LEU A 58 15.223 -2.803 -10.927 1.00 0.00 H new ATOM 0 HB2 LEU A 58 16.773 -0.145 -10.748 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.428 -1.645 -11.375 1.00 0.00 H new ATOM 0 HG LEU A 58 16.839 -0.386 -13.285 1.00 0.00 H new ATOM 0 HD11 LEU A 58 14.978 -1.638 -14.353 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.079 -2.716 -13.463 1.00 0.00 H new ATOM 0 HD13 LEU A 58 14.505 -2.274 -12.760 1.00 0.00 H new ATOM 0 HD21 LEU A 58 14.615 0.683 -13.618 1.00 0.00 H new ATOM 0 HD22 LEU A 58 14.131 0.156 -11.989 1.00 0.00 H new ATOM 0 HD23 LEU A 58 15.454 1.330 -12.187 1.00 0.00 H new ATOM 864 N THR A 59 15.188 -2.481 -8.159 1.00 0.00 N ATOM 865 CA THR A 59 15.624 -2.761 -6.776 1.00 0.00 C ATOM 866 C THR A 59 15.317 -4.228 -6.386 1.00 0.00 C ATOM 867 O THR A 59 15.635 -5.138 -7.124 1.00 0.00 O ATOM 868 CB THR A 59 14.791 -1.760 -5.998 1.00 0.00 C ATOM 869 OG1 THR A 59 13.423 -1.929 -6.366 1.00 0.00 O ATOM 870 CG2 THR A 59 15.266 -0.333 -6.314 1.00 0.00 C ATOM 0 H THR A 59 14.182 -2.557 -8.312 1.00 0.00 H new ATOM 0 HA THR A 59 16.695 -2.661 -6.600 1.00 0.00 H new ATOM 0 HB THR A 59 14.901 -1.925 -4.926 1.00 0.00 H new ATOM 0 HG1 THR A 59 13.020 -2.631 -5.814 1.00 0.00 H new ATOM 0 HG21 THR A 59 14.665 0.383 -5.753 1.00 0.00 H new ATOM 0 HG22 THR A 59 16.314 -0.227 -6.032 1.00 0.00 H new ATOM 0 HG23 THR A 59 15.157 -0.141 -7.381 1.00 0.00 H new ATOM 878 N PHE A 60 14.722 -4.470 -5.227 1.00 0.00 N ATOM 879 CA PHE A 60 14.416 -5.873 -4.785 1.00 0.00 C ATOM 880 C PHE A 60 15.723 -6.669 -4.672 1.00 0.00 C ATOM 881 O PHE A 60 15.735 -7.878 -4.799 1.00 0.00 O ATOM 882 CB PHE A 60 13.517 -6.505 -5.866 1.00 0.00 C ATOM 883 CG PHE A 60 12.350 -5.600 -6.196 1.00 0.00 C ATOM 884 CD1 PHE A 60 11.348 -5.340 -5.225 1.00 0.00 C ATOM 885 CD2 PHE A 60 12.255 -5.016 -7.488 1.00 0.00 C ATOM 886 CE1 PHE A 60 10.249 -4.497 -5.544 1.00 0.00 C ATOM 887 CE2 PHE A 60 11.158 -4.172 -7.809 1.00 0.00 C ATOM 888 CZ PHE A 60 10.154 -3.913 -6.836 1.00 0.00 C ATOM 0 H PHE A 60 14.436 -3.746 -4.568 1.00 0.00 H new ATOM 0 HA PHE A 60 13.919 -5.878 -3.815 1.00 0.00 H new ATOM 0 HB2 PHE A 60 14.102 -6.693 -6.766 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.147 -7.470 -5.518 1.00 0.00 H new ATOM 0 HD1 PHE A 60 11.421 -5.783 -4.243 1.00 0.00 H new ATOM 0 HD2 PHE A 60 13.018 -5.214 -8.227 1.00 0.00 H new ATOM 0 HE1 PHE A 60 9.487 -4.300 -4.805 1.00 0.00 H new ATOM 0 HE2 PHE A 60 11.087 -3.728 -8.791 1.00 0.00 H new ATOM 0 HZ PHE A 60 9.319 -3.272 -7.079 1.00 0.00 H new ATOM 898 N LEU A 61 16.824 -5.992 -4.457 1.00 0.00 N ATOM 899 CA LEU A 61 18.141 -6.693 -4.355 1.00 0.00 C ATOM 900 C LEU A 61 18.215 -7.563 -3.097 1.00 0.00 C ATOM 901 O LEU A 61 18.827 -8.615 -3.103 1.00 0.00 O ATOM 902 CB LEU A 61 19.185 -5.574 -4.292 1.00 0.00 C ATOM 903 CG LEU A 61 20.593 -6.177 -4.285 1.00 0.00 C ATOM 904 CD1 LEU A 61 20.847 -6.907 -5.606 1.00 0.00 C ATOM 905 CD2 LEU A 61 21.623 -5.059 -4.116 1.00 0.00 C ATOM 0 H LEU A 61 16.867 -4.979 -4.347 1.00 0.00 H new ATOM 0 HA LEU A 61 18.301 -7.364 -5.199 1.00 0.00 H new ATOM 0 HB2 LEU A 61 19.069 -4.908 -5.147 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.033 -4.972 -3.396 1.00 0.00 H new ATOM 0 HG LEU A 61 20.680 -6.883 -3.459 1.00 0.00 H new ATOM 0 HD11 LEU A 61 21.849 -7.335 -5.598 1.00 0.00 H new ATOM 0 HD12 LEU A 61 20.113 -7.704 -5.728 1.00 0.00 H new ATOM 0 HD13 LEU A 61 20.759 -6.203 -6.433 1.00 0.00 H new ATOM 0 HD21 LEU A 61 22.626 -5.486 -4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 61 21.533 -4.354 -4.942 1.00 0.00 H new ATOM 0 HD23 LEU A 61 21.445 -4.539 -3.174 1.00 0.00 H new ATOM 917 N ASP A 62 17.636 -7.116 -2.010 1.00 0.00 N ATOM 918 CA ASP A 62 17.711 -7.911 -0.745 1.00 0.00 C ATOM 919 C ASP A 62 17.100 -9.291 -0.909 1.00 0.00 C ATOM 920 O ASP A 62 17.657 -10.283 -0.475 1.00 0.00 O ATOM 921 CB ASP A 62 16.977 -7.084 0.315 1.00 0.00 C ATOM 922 CG ASP A 62 15.524 -6.863 -0.107 1.00 0.00 C ATOM 923 OD1 ASP A 62 15.313 -6.323 -1.180 1.00 0.00 O ATOM 924 OD2 ASP A 62 14.648 -7.237 0.651 1.00 0.00 O ATOM 0 H ASP A 62 17.117 -6.240 -1.944 1.00 0.00 H new ATOM 0 HA ASP A 62 18.746 -8.091 -0.454 1.00 0.00 H new ATOM 0 HB2 ASP A 62 17.011 -7.597 1.276 1.00 0.00 H new ATOM 0 HB3 ASP A 62 17.476 -6.124 0.448 1.00 0.00 H new ATOM 929 N ASP A 63 15.986 -9.362 -1.549 1.00 0.00 N ATOM 930 CA ASP A 63 15.334 -10.671 -1.778 1.00 0.00 C ATOM 931 C ASP A 63 15.756 -11.259 -3.125 1.00 0.00 C ATOM 932 O ASP A 63 15.538 -12.421 -3.399 1.00 0.00 O ATOM 933 CB ASP A 63 13.823 -10.412 -1.742 1.00 0.00 C ATOM 934 CG ASP A 63 13.374 -10.076 -0.319 1.00 0.00 C ATOM 935 OD1 ASP A 63 14.151 -10.268 0.605 1.00 0.00 O ATOM 936 OD2 ASP A 63 12.251 -9.632 -0.180 1.00 0.00 O ATOM 0 H ASP A 63 15.486 -8.559 -1.932 1.00 0.00 H new ATOM 0 HA ASP A 63 15.625 -11.395 -1.017 1.00 0.00 H new ATOM 0 HB2 ASP A 63 13.572 -9.590 -2.413 1.00 0.00 H new ATOM 0 HB3 ASP A 63 13.288 -11.291 -2.101 1.00 0.00 H new ATOM 941 N SER A 64 16.367 -10.457 -3.954 1.00 0.00 N ATOM 942 CA SER A 64 16.836 -10.919 -5.307 1.00 0.00 C ATOM 943 C SER A 64 15.799 -11.811 -6.021 1.00 0.00 C ATOM 944 O SER A 64 16.154 -12.619 -6.860 1.00 0.00 O ATOM 945 CB SER A 64 18.108 -11.715 -5.023 1.00 0.00 C ATOM 946 OG SER A 64 18.673 -12.152 -6.252 1.00 0.00 O ATOM 0 H SER A 64 16.568 -9.478 -3.752 1.00 0.00 H new ATOM 0 HA SER A 64 16.997 -10.071 -5.973 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.823 -11.098 -4.480 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.881 -12.572 -4.389 1.00 0.00 H new ATOM 0 HG SER A 64 17.958 -12.440 -6.857 1.00 0.00 H new ATOM 952 N ILE A 67 14.530 -11.683 -5.697 1.00 0.00 N ATOM 953 CA ILE A 67 13.494 -12.537 -6.361 1.00 0.00 C ATOM 954 C ILE A 67 12.185 -11.754 -6.556 1.00 0.00 C ATOM 955 O ILE A 67 11.552 -11.846 -7.591 1.00 0.00 O ATOM 956 CB ILE A 67 13.272 -13.735 -5.425 1.00 0.00 C ATOM 957 CG1 ILE A 67 14.562 -14.568 -5.350 1.00 0.00 C ATOM 958 CG2 ILE A 67 12.126 -14.615 -5.963 1.00 0.00 C ATOM 959 CD1 ILE A 67 14.375 -15.731 -4.379 1.00 0.00 C ATOM 0 H ILE A 67 14.171 -11.026 -5.004 1.00 0.00 H new ATOM 0 HA ILE A 67 13.819 -12.857 -7.351 1.00 0.00 H new ATOM 0 HB ILE A 67 13.009 -13.371 -4.432 1.00 0.00 H new ATOM 0 HG12 ILE A 67 14.818 -14.947 -6.339 1.00 0.00 H new ATOM 0 HG13 ILE A 67 15.392 -13.941 -5.024 1.00 0.00 H new ATOM 0 HG21 ILE A 67 11.974 -15.463 -5.295 1.00 0.00 H new ATOM 0 HG22 ILE A 67 11.210 -14.027 -6.017 1.00 0.00 H new ATOM 0 HG23 ILE A 67 12.383 -14.979 -6.958 1.00 0.00 H new ATOM 0 HD11 ILE A 67 15.293 -16.316 -4.331 1.00 0.00 H new ATOM 0 HD12 ILE A 67 14.140 -15.343 -3.388 1.00 0.00 H new ATOM 0 HD13 ILE A 67 13.558 -16.365 -4.724 1.00 0.00 H new ATOM 971 N CYS A 68 11.764 -11.007 -5.563 1.00 0.00 N ATOM 972 CA CYS A 68 10.481 -10.248 -5.690 1.00 0.00 C ATOM 973 C CYS A 68 10.595 -9.133 -6.728 1.00 0.00 C ATOM 974 O CYS A 68 11.544 -8.374 -6.747 1.00 0.00 O ATOM 975 CB CYS A 68 10.205 -9.651 -4.306 1.00 0.00 C ATOM 976 SG CYS A 68 11.619 -8.649 -3.781 1.00 0.00 S ATOM 0 H CYS A 68 12.251 -10.891 -4.674 1.00 0.00 H new ATOM 0 HA CYS A 68 9.675 -10.904 -6.021 1.00 0.00 H new ATOM 0 HB2 CYS A 68 9.304 -9.038 -4.337 1.00 0.00 H new ATOM 0 HB3 CYS A 68 10.024 -10.448 -3.585 1.00 0.00 H new ATOM 981 N THR A 69 9.607 -9.023 -7.570 1.00 0.00 N ATOM 982 CA THR A 69 9.595 -7.953 -8.603 1.00 0.00 C ATOM 983 C THR A 69 8.241 -7.247 -8.539 1.00 0.00 C ATOM 984 O THR A 69 7.222 -7.884 -8.338 1.00 0.00 O ATOM 985 CB THR A 69 9.794 -8.673 -9.944 1.00 0.00 C ATOM 986 OG1 THR A 69 9.797 -7.719 -10.995 1.00 0.00 O ATOM 987 CG2 THR A 69 8.668 -9.686 -10.172 1.00 0.00 C ATOM 0 H THR A 69 8.795 -9.640 -7.586 1.00 0.00 H new ATOM 0 HA THR A 69 10.370 -7.200 -8.461 1.00 0.00 H new ATOM 0 HB THR A 69 10.746 -9.203 -9.927 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.926 -8.177 -11.852 1.00 0.00 H new ATOM 0 HG21 THR A 69 8.820 -10.190 -11.126 1.00 0.00 H new ATOM 0 HG22 THR A 69 8.672 -10.422 -9.368 1.00 0.00 H new ATOM 0 HG23 THR A 69 7.709 -9.168 -10.184 1.00 0.00 H new ATOM 995 N GLY A 70 8.213 -5.946 -8.676 1.00 0.00 N ATOM 996 CA GLY A 70 6.910 -5.230 -8.585 1.00 0.00 C ATOM 997 C GLY A 70 6.813 -4.130 -9.637 1.00 0.00 C ATOM 998 O GLY A 70 7.801 -3.633 -10.141 1.00 0.00 O ATOM 0 H GLY A 70 9.028 -5.356 -8.845 1.00 0.00 H new ATOM 0 HA2 GLY A 70 6.092 -5.938 -8.719 1.00 0.00 H new ATOM 0 HA3 GLY A 70 6.798 -4.797 -7.591 1.00 0.00 H new ATOM 1002 N THR A 71 5.608 -3.747 -9.952 1.00 0.00 N ATOM 1003 CA THR A 71 5.376 -2.676 -10.953 1.00 0.00 C ATOM 1004 C THR A 71 4.412 -1.647 -10.367 1.00 0.00 C ATOM 1005 O THR A 71 3.687 -1.932 -9.434 1.00 0.00 O ATOM 1006 CB THR A 71 4.737 -3.374 -12.139 1.00 0.00 C ATOM 1007 OG1 THR A 71 5.576 -4.430 -12.584 1.00 0.00 O ATOM 1008 CG2 THR A 71 4.511 -2.382 -13.277 1.00 0.00 C ATOM 0 H THR A 71 4.758 -4.141 -9.548 1.00 0.00 H new ATOM 0 HA THR A 71 6.292 -2.157 -11.236 1.00 0.00 H new ATOM 0 HB THR A 71 3.775 -3.782 -11.830 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.027 -5.205 -12.824 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.052 -2.896 -14.122 1.00 0.00 H new ATOM 0 HG22 THR A 71 3.853 -1.582 -12.937 1.00 0.00 H new ATOM 0 HG23 THR A 71 5.467 -1.959 -13.586 1.00 0.00 H new ATOM 1016 N SER A 72 4.396 -0.464 -10.906 1.00 0.00 N ATOM 1017 CA SER A 72 3.470 0.584 -10.385 1.00 0.00 C ATOM 1018 C SER A 72 2.987 1.479 -11.530 1.00 0.00 C ATOM 1019 O SER A 72 3.776 2.021 -12.280 1.00 0.00 O ATOM 1020 CB SER A 72 4.300 1.381 -9.379 1.00 0.00 C ATOM 1021 OG SER A 72 4.744 0.511 -8.346 1.00 0.00 O ATOM 0 H SER A 72 4.984 -0.173 -11.687 1.00 0.00 H new ATOM 0 HA SER A 72 2.578 0.160 -9.924 1.00 0.00 H new ATOM 0 HB2 SER A 72 5.154 1.840 -9.877 1.00 0.00 H new ATOM 0 HB3 SER A 72 3.704 2.191 -8.958 1.00 0.00 H new ATOM 0 HG SER A 72 5.711 0.372 -8.428 1.00 0.00 H new ATOM 1027 N SER A 73 1.694 1.639 -11.663 1.00 0.00 N ATOM 1028 CA SER A 73 1.148 2.502 -12.751 1.00 0.00 C ATOM 1029 C SER A 73 -0.033 3.316 -12.222 1.00 0.00 C ATOM 1030 O SER A 73 -0.939 2.780 -11.614 1.00 0.00 O ATOM 1031 CB SER A 73 0.688 1.529 -13.836 1.00 0.00 C ATOM 1032 OG SER A 73 0.233 2.265 -14.964 1.00 0.00 O ATOM 0 H SER A 73 0.992 1.207 -11.062 1.00 0.00 H new ATOM 0 HA SER A 73 1.883 3.211 -13.131 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.509 0.872 -14.123 1.00 0.00 H new ATOM 0 HB3 SER A 73 -0.111 0.893 -13.455 1.00 0.00 H new ATOM 0 HG SER A 73 -0.061 1.644 -15.663 1.00 0.00 H new ATOM 1038 N GLY A 74 -0.028 4.607 -12.445 1.00 0.00 N ATOM 1039 CA GLY A 74 -1.151 5.461 -11.950 1.00 0.00 C ATOM 1040 C GLY A 74 -1.239 5.346 -10.426 1.00 0.00 C ATOM 1041 O GLY A 74 -0.278 5.588 -9.722 1.00 0.00 O ATOM 0 H GLY A 74 0.705 5.106 -12.948 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.989 6.499 -12.239 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -2.090 5.147 -12.405 1.00 0.00 H new ATOM 1045 N ASN A 75 -2.383 4.969 -9.918 1.00 0.00 N ATOM 1046 CA ASN A 75 -2.543 4.821 -8.440 1.00 0.00 C ATOM 1047 C ASN A 75 -2.594 3.338 -8.045 1.00 0.00 C ATOM 1048 O ASN A 75 -3.021 2.999 -6.957 1.00 0.00 O ATOM 1049 CB ASN A 75 -3.870 5.508 -8.117 1.00 0.00 C ATOM 1050 CG ASN A 75 -3.767 6.998 -8.443 1.00 0.00 C ATOM 1051 OD1 ASN A 75 -2.895 7.682 -7.943 1.00 0.00 O ATOM 1052 ND2 ASN A 75 -4.627 7.536 -9.264 1.00 0.00 N ATOM 0 H ASN A 75 -3.217 4.756 -10.465 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.709 5.260 -7.893 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.676 5.054 -8.693 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -4.115 5.372 -7.064 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.567 8.530 -9.486 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -5.359 6.963 -9.684 1.00 0.00 H new ATOM 1059 N GLN A 76 -2.175 2.450 -8.919 1.00 0.00 N ATOM 1060 CA GLN A 76 -2.215 0.992 -8.590 1.00 0.00 C ATOM 1061 C GLN A 76 -0.814 0.378 -8.638 1.00 0.00 C ATOM 1062 O GLN A 76 -0.131 0.460 -9.643 1.00 0.00 O ATOM 1063 CB GLN A 76 -3.103 0.380 -9.673 1.00 0.00 C ATOM 1064 CG GLN A 76 -4.550 0.827 -9.460 1.00 0.00 C ATOM 1065 CD GLN A 76 -5.454 0.157 -10.498 1.00 0.00 C ATOM 1066 OE1 GLN A 76 -6.536 -0.293 -10.177 1.00 0.00 O ATOM 1067 NE2 GLN A 76 -5.055 0.071 -11.738 1.00 0.00 N ATOM 0 H GLN A 76 -1.808 2.675 -9.844 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.593 0.810 -7.584 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.757 0.689 -10.659 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.039 -0.708 -9.639 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.878 0.564 -8.454 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.622 1.911 -9.546 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.147 0.448 -12.009 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.651 -0.374 -12.436 1.00 0.00 H new ATOM 1076 N VAL A 77 -0.377 -0.239 -7.561 1.00 0.00 N ATOM 1077 CA VAL A 77 0.975 -0.857 -7.554 1.00 0.00 C ATOM 1078 C VAL A 77 0.846 -2.388 -7.676 1.00 0.00 C ATOM 1079 O VAL A 77 0.197 -3.030 -6.873 1.00 0.00 O ATOM 1080 CB VAL A 77 1.641 -0.425 -6.219 1.00 0.00 C ATOM 1081 CG1 VAL A 77 1.396 1.067 -5.937 1.00 0.00 C ATOM 1082 CG2 VAL A 77 1.137 -1.255 -5.024 1.00 0.00 C ATOM 0 H VAL A 77 -0.903 -0.337 -6.693 1.00 0.00 H new ATOM 0 HA VAL A 77 1.587 -0.532 -8.395 1.00 0.00 H new ATOM 0 HB VAL A 77 2.710 -0.604 -6.336 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.873 1.343 -4.997 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.817 1.664 -6.746 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.324 1.253 -5.868 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.630 -0.917 -4.113 1.00 0.00 H new ATOM 0 HG22 VAL A 77 0.059 -1.128 -4.922 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.364 -2.308 -5.191 1.00 0.00 H new ATOM 1092 N ASN A 78 1.442 -2.971 -8.684 1.00 0.00 N ATOM 1093 CA ASN A 78 1.336 -4.450 -8.861 1.00 0.00 C ATOM 1094 C ASN A 78 2.608 -5.165 -8.378 1.00 0.00 C ATOM 1095 O ASN A 78 3.635 -5.120 -9.023 1.00 0.00 O ATOM 1096 CB ASN A 78 1.147 -4.648 -10.368 1.00 0.00 C ATOM 1097 CG ASN A 78 0.845 -6.122 -10.646 1.00 0.00 C ATOM 1098 OD1 ASN A 78 -0.080 -6.684 -10.101 1.00 0.00 O ATOM 1099 ND2 ASN A 78 1.646 -6.752 -11.475 1.00 0.00 N ATOM 0 H ASN A 78 1.996 -2.488 -9.391 1.00 0.00 H new ATOM 0 HA ASN A 78 0.516 -4.869 -8.278 1.00 0.00 H new ATOM 0 HB2 ASN A 78 0.331 -4.022 -10.730 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.046 -4.341 -10.903 1.00 0.00 H new ATOM 0 HD22 ASN A 78 2.416 -6.252 -11.919 1.00 0.00 H new ATOM 1105 N LEU A 79 2.530 -5.851 -7.261 1.00 0.00 N ATOM 1106 CA LEU A 79 3.721 -6.603 -6.745 1.00 0.00 C ATOM 1107 C LEU A 79 3.622 -8.074 -7.161 1.00 0.00 C ATOM 1108 O LEU A 79 2.590 -8.699 -7.002 1.00 0.00 O ATOM 1109 CB LEU A 79 3.661 -6.480 -5.218 1.00 0.00 C ATOM 1110 CG LEU A 79 4.075 -5.072 -4.780 1.00 0.00 C ATOM 1111 CD1 LEU A 79 3.728 -4.879 -3.304 1.00 0.00 C ATOM 1112 CD2 LEU A 79 5.589 -4.908 -4.970 1.00 0.00 C ATOM 0 H LEU A 79 1.692 -5.923 -6.684 1.00 0.00 H new ATOM 0 HA LEU A 79 4.656 -6.208 -7.141 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.651 -6.694 -4.869 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.320 -7.219 -4.761 1.00 0.00 H new ATOM 0 HG LEU A 79 3.547 -4.331 -5.380 1.00 0.00 H new ATOM 0 HD11 LEU A 79 4.022 -3.878 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.654 -5.003 -3.163 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.260 -5.618 -2.705 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.888 -3.907 -4.659 1.00 0.00 H new ATOM 0 HD22 LEU A 79 6.114 -5.648 -4.365 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.842 -5.053 -6.020 1.00 0.00 H new ATOM 1124 N THR A 80 4.681 -8.630 -7.697 1.00 0.00 N ATOM 1125 CA THR A 80 4.640 -10.059 -8.126 1.00 0.00 C ATOM 1126 C THR A 80 5.760 -10.865 -7.461 1.00 0.00 C ATOM 1127 O THR A 80 6.884 -10.412 -7.353 1.00 0.00 O ATOM 1128 CB THR A 80 4.845 -10.026 -9.641 1.00 0.00 C ATOM 1129 OG1 THR A 80 3.860 -9.192 -10.233 1.00 0.00 O ATOM 1130 CG2 THR A 80 4.725 -11.444 -10.207 1.00 0.00 C ATOM 0 H THR A 80 5.570 -8.155 -7.855 1.00 0.00 H new ATOM 0 HA THR A 80 3.701 -10.535 -7.843 1.00 0.00 H new ATOM 0 HB THR A 80 5.836 -9.632 -9.864 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.001 -9.157 -11.202 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.871 -11.418 -11.287 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.483 -12.082 -9.753 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.735 -11.842 -9.984 1.00 0.00 H new ATOM 1138 N ILE A 81 5.459 -12.065 -7.039 1.00 0.00 N ATOM 1139 CA ILE A 81 6.495 -12.929 -6.402 1.00 0.00 C ATOM 1140 C ILE A 81 6.775 -14.136 -7.294 1.00 0.00 C ATOM 1141 O ILE A 81 5.863 -14.826 -7.704 1.00 0.00 O ATOM 1142 CB ILE A 81 5.882 -13.394 -5.078 1.00 0.00 C ATOM 1143 CG1 ILE A 81 5.652 -12.187 -4.168 1.00 0.00 C ATOM 1144 CG2 ILE A 81 6.825 -14.391 -4.387 1.00 0.00 C ATOM 1145 CD1 ILE A 81 4.774 -12.605 -2.988 1.00 0.00 C ATOM 0 H ILE A 81 4.533 -12.486 -7.109 1.00 0.00 H new ATOM 0 HA ILE A 81 7.435 -12.398 -6.251 1.00 0.00 H new ATOM 0 HB ILE A 81 4.929 -13.884 -5.277 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.606 -11.801 -3.808 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.173 -11.382 -4.726 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.383 -14.718 -3.446 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.979 -15.254 -5.034 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.783 -13.909 -4.190 1.00 0.00 H new ATOM 0 HD11 ILE A 81 4.608 -11.747 -2.336 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.816 -12.970 -3.359 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.271 -13.396 -2.427 1.00 0.00 H new ATOM 1157 N GLN A 82 8.023 -14.407 -7.574 1.00 0.00 N ATOM 1158 CA GLN A 82 8.352 -15.591 -8.413 1.00 0.00 C ATOM 1159 C GLN A 82 9.084 -16.640 -7.583 1.00 0.00 C ATOM 1160 O GLN A 82 10.165 -16.407 -7.076 1.00 0.00 O ATOM 1161 CB GLN A 82 9.262 -15.082 -9.520 1.00 0.00 C ATOM 1162 CG GLN A 82 8.506 -14.084 -10.398 1.00 0.00 C ATOM 1163 CD GLN A 82 9.457 -13.503 -11.446 1.00 0.00 C ATOM 1164 OE1 GLN A 82 9.315 -13.765 -12.624 1.00 0.00 O ATOM 1165 NE2 GLN A 82 10.428 -12.719 -11.065 1.00 0.00 N ATOM 0 H GLN A 82 8.824 -13.860 -7.258 1.00 0.00 H new ATOM 0 HA GLN A 82 7.451 -16.056 -8.813 1.00 0.00 H new ATOM 0 HB2 GLN A 82 10.143 -14.606 -9.089 1.00 0.00 H new ATOM 0 HB3 GLN A 82 9.615 -15.917 -10.125 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.666 -14.577 -10.887 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.092 -13.284 -9.784 1.00 0.00 H new ATOM 0 HE21 GLN A 82 10.548 -12.499 -10.076 1.00 0.00 H new ATOM 0 HE22 GLN A 82 11.067 -12.326 -11.756 1.00 0.00 H new ATOM 1174 N GLY A 83 8.500 -17.793 -7.457 1.00 0.00 N ATOM 1175 CA GLY A 83 9.144 -18.891 -6.674 1.00 0.00 C ATOM 1176 C GLY A 83 8.402 -19.092 -5.353 1.00 0.00 C ATOM 1177 O GLY A 83 8.999 -19.103 -4.293 1.00 0.00 O ATOM 0 H GLY A 83 7.595 -18.030 -7.865 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.134 -19.816 -7.251 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.189 -18.647 -6.481 1.00 0.00 H new ATOM 1181 N LEU A 84 7.104 -19.244 -5.409 1.00 0.00 N ATOM 1182 CA LEU A 84 6.315 -19.439 -4.159 1.00 0.00 C ATOM 1183 C LEU A 84 6.302 -20.908 -3.731 1.00 0.00 C ATOM 1184 O LEU A 84 5.999 -21.795 -4.507 1.00 0.00 O ATOM 1185 CB LEU A 84 4.903 -18.979 -4.508 1.00 0.00 C ATOM 1186 CG LEU A 84 4.890 -17.460 -4.651 1.00 0.00 C ATOM 1187 CD1 LEU A 84 3.573 -17.021 -5.286 1.00 0.00 C ATOM 1188 CD2 LEU A 84 5.026 -16.825 -3.266 1.00 0.00 C ATOM 0 H LEU A 84 6.556 -19.241 -6.270 1.00 0.00 H new ATOM 0 HA LEU A 84 6.743 -18.881 -3.326 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.575 -19.446 -5.436 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.204 -19.289 -3.731 1.00 0.00 H new ATOM 0 HG LEU A 84 5.719 -17.143 -5.283 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.562 -15.936 -5.389 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.473 -17.480 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.742 -17.334 -4.654 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.017 -15.739 -3.361 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.193 -17.141 -2.638 1.00 0.00 H new ATOM 0 HD23 LEU A 84 5.964 -17.142 -2.811 1.00 0.00 H new ATOM 1200 N ARG A 85 6.615 -21.156 -2.489 1.00 0.00 N ATOM 1201 CA ARG A 85 6.611 -22.548 -1.958 1.00 0.00 C ATOM 1202 C ARG A 85 5.481 -22.696 -0.938 1.00 0.00 C ATOM 1203 O ARG A 85 4.808 -21.737 -0.609 1.00 0.00 O ATOM 1204 CB ARG A 85 7.970 -22.720 -1.276 1.00 0.00 C ATOM 1205 CG ARG A 85 9.081 -22.609 -2.320 1.00 0.00 C ATOM 1206 CD ARG A 85 9.460 -24.008 -2.817 1.00 0.00 C ATOM 1207 NE ARG A 85 10.022 -24.713 -1.621 1.00 0.00 N ATOM 1208 CZ ARG A 85 10.662 -25.859 -1.738 1.00 0.00 C ATOM 1209 NH1 ARG A 85 10.838 -26.434 -2.906 1.00 0.00 N ATOM 1210 NH2 ARG A 85 11.134 -26.437 -0.667 1.00 0.00 N ATOM 0 H ARG A 85 6.877 -20.442 -1.810 1.00 0.00 H new ATOM 0 HA ARG A 85 6.455 -23.295 -2.737 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.102 -21.959 -0.507 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.019 -23.688 -0.778 1.00 0.00 H new ATOM 0 HG2 ARG A 85 8.749 -21.993 -3.155 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.952 -22.117 -1.888 1.00 0.00 H new ATOM 0 HD2 ARG A 85 8.591 -24.534 -3.211 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.193 -23.954 -3.622 1.00 0.00 H new ATOM 0 HE ARG A 85 9.907 -24.297 -0.697 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.475 -25.993 -3.751 1.00 0.00 H new ATOM 0 HH12 ARG A 85 11.337 -27.321 -2.968 1.00 0.00 H new ATOM 0 HH21 ARG A 85 11.005 -26.001 0.246 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.631 -27.324 -0.743 1.00 0.00 H new ATOM 1224 N ALA A 86 5.269 -23.883 -0.432 1.00 0.00 N ATOM 1225 CA ALA A 86 4.183 -24.088 0.580 1.00 0.00 C ATOM 1226 C ALA A 86 4.442 -23.211 1.804 1.00 0.00 C ATOM 1227 O ALA A 86 3.554 -22.576 2.338 1.00 0.00 O ATOM 1228 CB ALA A 86 4.285 -25.559 0.975 1.00 0.00 C ATOM 0 H ALA A 86 5.799 -24.720 -0.674 1.00 0.00 H new ATOM 0 HA ALA A 86 3.200 -23.829 0.187 1.00 0.00 H new ATOM 0 HB1 ALA A 86 3.520 -25.791 1.716 1.00 0.00 H new ATOM 0 HB2 ALA A 86 4.137 -26.183 0.094 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.271 -25.755 1.397 1.00 0.00 H new ATOM 1234 N MET A 87 5.668 -23.187 2.242 1.00 0.00 N ATOM 1235 CA MET A 87 6.043 -22.373 3.433 1.00 0.00 C ATOM 1236 C MET A 87 5.893 -20.873 3.149 1.00 0.00 C ATOM 1237 O MET A 87 5.577 -20.097 4.031 1.00 0.00 O ATOM 1238 CB MET A 87 7.506 -22.728 3.689 1.00 0.00 C ATOM 1239 CG MET A 87 7.599 -24.165 4.206 1.00 0.00 C ATOM 1240 SD MET A 87 6.763 -24.285 5.806 1.00 0.00 S ATOM 1241 CE MET A 87 7.171 -26.015 6.148 1.00 0.00 C ATOM 0 H MET A 87 6.439 -23.704 1.820 1.00 0.00 H new ATOM 0 HA MET A 87 5.404 -22.582 4.291 1.00 0.00 H new ATOM 0 HB2 MET A 87 8.083 -22.623 2.770 1.00 0.00 H new ATOM 0 HB3 MET A 87 7.936 -22.040 4.416 1.00 0.00 H new ATOM 0 HG2 MET A 87 7.141 -24.850 3.492 1.00 0.00 H new ATOM 0 HG3 MET A 87 8.644 -24.460 4.306 1.00 0.00 H new ATOM 0 HE1 MET A 87 6.745 -26.306 7.108 1.00 0.00 H new ATOM 0 HE2 MET A 87 6.760 -26.648 5.362 1.00 0.00 H new ATOM 0 HE3 MET A 87 8.254 -26.134 6.181 1.00 0.00 H new ATOM 1251 N ASP A 88 6.131 -20.461 1.931 1.00 0.00 N ATOM 1252 CA ASP A 88 6.020 -19.006 1.587 1.00 0.00 C ATOM 1253 C ASP A 88 4.576 -18.516 1.729 1.00 0.00 C ATOM 1254 O ASP A 88 4.337 -17.341 1.934 1.00 0.00 O ATOM 1255 CB ASP A 88 6.473 -18.896 0.133 1.00 0.00 C ATOM 1256 CG ASP A 88 7.949 -19.293 0.018 1.00 0.00 C ATOM 1257 OD1 ASP A 88 8.672 -19.120 0.987 1.00 0.00 O ATOM 1258 OD2 ASP A 88 8.332 -19.763 -1.041 1.00 0.00 O ATOM 0 H ASP A 88 6.398 -21.068 1.156 1.00 0.00 H new ATOM 0 HA ASP A 88 6.626 -18.393 2.254 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.863 -19.543 -0.498 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.332 -17.876 -0.225 1.00 0.00 H new ATOM 1263 N THR A 89 3.609 -19.399 1.616 1.00 0.00 N ATOM 1264 CA THR A 89 2.182 -18.984 1.740 1.00 0.00 C ATOM 1265 C THR A 89 1.972 -18.189 3.025 1.00 0.00 C ATOM 1266 O THR A 89 2.503 -18.521 4.069 1.00 0.00 O ATOM 1267 CB THR A 89 1.387 -20.272 1.777 1.00 0.00 C ATOM 1268 OG1 THR A 89 1.707 -21.063 0.641 1.00 0.00 O ATOM 1269 CG2 THR A 89 -0.107 -19.954 1.778 1.00 0.00 C ATOM 0 H THR A 89 3.753 -20.394 1.442 1.00 0.00 H new ATOM 0 HA THR A 89 1.872 -18.343 0.914 1.00 0.00 H new ATOM 0 HB THR A 89 1.638 -20.824 2.683 1.00 0.00 H new ATOM 0 HG1 THR A 89 2.372 -21.739 0.890 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.677 -20.883 1.805 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.351 -19.354 2.655 1.00 0.00 H new ATOM 0 HG23 THR A 89 -0.361 -19.398 0.875 1.00 0.00 H new ATOM 1277 N GLY A 90 1.217 -17.136 2.944 1.00 0.00 N ATOM 1278 CA GLY A 90 0.978 -16.290 4.151 1.00 0.00 C ATOM 1279 C GLY A 90 0.469 -14.913 3.728 1.00 0.00 C ATOM 1280 O GLY A 90 0.023 -14.725 2.614 1.00 0.00 O ATOM 0 H GLY A 90 0.751 -16.819 2.094 1.00 0.00 H new ATOM 0 HA2 GLY A 90 0.251 -16.771 4.805 1.00 0.00 H new ATOM 0 HA3 GLY A 90 1.901 -16.187 4.722 1.00 0.00 H new ATOM 1284 N LEU A 91 0.519 -13.955 4.620 1.00 0.00 N ATOM 1285 CA LEU A 91 0.017 -12.588 4.294 1.00 0.00 C ATOM 1286 C LEU A 91 1.136 -11.656 3.814 1.00 0.00 C ATOM 1287 O LEU A 91 2.154 -11.495 4.461 1.00 0.00 O ATOM 1288 CB LEU A 91 -0.558 -12.072 5.612 1.00 0.00 C ATOM 1289 CG LEU A 91 -1.201 -10.702 5.394 1.00 0.00 C ATOM 1290 CD1 LEU A 91 -2.576 -10.879 4.753 1.00 0.00 C ATOM 1291 CD2 LEU A 91 -1.348 -9.993 6.738 1.00 0.00 C ATOM 0 H LEU A 91 0.888 -14.064 5.565 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.711 -12.619 3.483 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.298 -12.774 5.997 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.231 -11.999 6.360 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.572 -10.104 4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.034 -9.902 4.598 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.468 -11.385 3.794 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.209 -11.476 5.409 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -1.806 -9.016 6.586 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.978 -10.590 7.397 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.365 -9.866 7.192 1.00 0.00 H new ATOM 1303 N TYR A 92 0.913 -11.001 2.702 1.00 0.00 N ATOM 1304 CA TYR A 92 1.908 -10.021 2.176 1.00 0.00 C ATOM 1305 C TYR A 92 1.294 -8.622 2.247 1.00 0.00 C ATOM 1306 O TYR A 92 0.131 -8.436 1.948 1.00 0.00 O ATOM 1307 CB TYR A 92 2.192 -10.443 0.736 1.00 0.00 C ATOM 1308 CG TYR A 92 3.014 -11.709 0.752 1.00 0.00 C ATOM 1309 CD1 TYR A 92 4.427 -11.625 0.878 1.00 0.00 C ATOM 1310 CD2 TYR A 92 2.383 -12.978 0.654 1.00 0.00 C ATOM 1311 CE1 TYR A 92 5.212 -12.808 0.902 1.00 0.00 C ATOM 1312 CE2 TYR A 92 3.168 -14.163 0.679 1.00 0.00 C ATOM 1313 CZ TYR A 92 4.582 -14.078 0.805 1.00 0.00 C ATOM 1314 OH TYR A 92 5.344 -15.229 0.829 1.00 0.00 O ATOM 0 H TYR A 92 0.074 -11.106 2.131 1.00 0.00 H new ATOM 0 HA TYR A 92 2.836 -10.002 2.748 1.00 0.00 H new ATOM 0 HB2 TYR A 92 1.257 -10.607 0.200 1.00 0.00 H new ATOM 0 HB3 TYR A 92 2.727 -9.652 0.210 1.00 0.00 H new ATOM 0 HD1 TYR A 92 4.905 -10.660 0.956 1.00 0.00 H new ATOM 0 HD2 TYR A 92 1.309 -13.042 0.561 1.00 0.00 H new ATOM 0 HE1 TYR A 92 6.286 -12.743 0.994 1.00 0.00 H new ATOM 0 HE2 TYR A 92 2.690 -15.129 0.602 1.00 0.00 H new ATOM 0 HH TYR A 92 4.771 -15.996 1.039 1.00 0.00 H new ATOM 1324 N ILE A 93 2.049 -7.649 2.687 1.00 0.00 N ATOM 1325 CA ILE A 93 1.491 -6.270 2.837 1.00 0.00 C ATOM 1326 C ILE A 93 1.957 -5.338 1.724 1.00 0.00 C ATOM 1327 O ILE A 93 3.128 -5.236 1.447 1.00 0.00 O ATOM 1328 CB ILE A 93 2.032 -5.768 4.186 1.00 0.00 C ATOM 1329 CG1 ILE A 93 1.477 -6.615 5.327 1.00 0.00 C ATOM 1330 CG2 ILE A 93 1.611 -4.308 4.419 1.00 0.00 C ATOM 1331 CD1 ILE A 93 2.236 -7.937 5.433 1.00 0.00 C ATOM 0 H ILE A 93 3.030 -7.749 2.950 1.00 0.00 H new ATOM 0 HA ILE A 93 0.402 -6.286 2.787 1.00 0.00 H new ATOM 0 HB ILE A 93 3.119 -5.843 4.162 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.557 -6.067 6.266 1.00 0.00 H new ATOM 0 HG13 ILE A 93 0.418 -6.810 5.161 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.001 -3.966 5.378 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.010 -3.682 3.621 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.523 -4.239 4.424 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.826 -8.527 6.252 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.134 -8.491 4.500 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.291 -7.737 5.622 1.00 0.00 H new ATOM 1343 N CYS A 94 1.044 -4.604 1.145 1.00 0.00 N ATOM 1344 CA CYS A 94 1.430 -3.609 0.112 1.00 0.00 C ATOM 1345 C CYS A 94 1.520 -2.252 0.813 1.00 0.00 C ATOM 1346 O CYS A 94 0.567 -1.807 1.423 1.00 0.00 O ATOM 1347 CB CYS A 94 0.296 -3.618 -0.916 1.00 0.00 C ATOM 1348 SG CYS A 94 -1.227 -3.017 -0.141 1.00 0.00 S ATOM 0 H CYS A 94 0.045 -4.654 1.346 1.00 0.00 H new ATOM 0 HA CYS A 94 2.382 -3.822 -0.375 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.557 -2.988 -1.766 1.00 0.00 H new ATOM 0 HB3 CYS A 94 0.147 -4.627 -1.300 1.00 0.00 H new ATOM 1353 N LYS A 95 2.653 -1.604 0.755 1.00 0.00 N ATOM 1354 CA LYS A 95 2.797 -0.288 1.446 1.00 0.00 C ATOM 1355 C LYS A 95 3.117 0.790 0.421 1.00 0.00 C ATOM 1356 O LYS A 95 3.805 0.537 -0.547 1.00 0.00 O ATOM 1357 CB LYS A 95 3.952 -0.482 2.427 1.00 0.00 C ATOM 1358 CG LYS A 95 3.589 -1.579 3.434 1.00 0.00 C ATOM 1359 CD LYS A 95 3.748 -1.042 4.849 1.00 0.00 C ATOM 1360 CE LYS A 95 3.255 -2.085 5.848 1.00 0.00 C ATOM 1361 NZ LYS A 95 3.838 -1.675 7.156 1.00 0.00 N ATOM 0 H LYS A 95 3.484 -1.928 0.260 1.00 0.00 H new ATOM 0 HA LYS A 95 1.889 0.025 1.962 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.859 -0.754 1.888 1.00 0.00 H new ATOM 0 HB3 LYS A 95 4.160 0.452 2.950 1.00 0.00 H new ATOM 0 HG2 LYS A 95 2.563 -1.911 3.273 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.231 -2.448 3.289 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.794 -0.803 5.043 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.183 -0.117 4.964 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.166 -2.106 5.891 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.582 -3.086 5.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 3.657 -2.415 7.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 4.864 -1.539 7.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.401 -0.784 7.467 1.00 0.00 H new ATOM 1375 N VAL A 96 2.605 1.978 0.606 1.00 0.00 N ATOM 1376 CA VAL A 96 2.866 3.067 -0.386 1.00 0.00 C ATOM 1377 C VAL A 96 3.187 4.374 0.347 1.00 0.00 C ATOM 1378 O VAL A 96 2.321 4.955 0.987 1.00 0.00 O ATOM 1379 CB VAL A 96 1.557 3.213 -1.178 1.00 0.00 C ATOM 1380 CG1 VAL A 96 1.808 4.085 -2.412 1.00 0.00 C ATOM 1381 CG2 VAL A 96 1.031 1.835 -1.618 1.00 0.00 C ATOM 0 H VAL A 96 2.019 2.243 1.398 1.00 0.00 H new ATOM 0 HA VAL A 96 3.712 2.839 -1.034 1.00 0.00 H new ATOM 0 HB VAL A 96 0.809 3.681 -0.538 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.882 4.191 -2.977 1.00 0.00 H new ATOM 0 HG12 VAL A 96 2.156 5.069 -2.098 1.00 0.00 H new ATOM 0 HG13 VAL A 96 2.565 3.616 -3.041 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.104 1.961 -2.177 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.773 1.347 -2.251 1.00 0.00 H new ATOM 0 HG23 VAL A 96 0.843 1.219 -0.738 1.00 0.00 H new ATOM 1391 N GLU A 97 4.416 4.834 0.262 1.00 0.00 N ATOM 1392 CA GLU A 97 4.792 6.099 0.958 1.00 0.00 C ATOM 1393 C GLU A 97 5.562 7.034 0.032 1.00 0.00 C ATOM 1394 O GLU A 97 6.550 6.655 -0.562 1.00 0.00 O ATOM 1395 CB GLU A 97 5.715 5.673 2.102 1.00 0.00 C ATOM 1396 CG GLU A 97 4.938 4.792 3.081 1.00 0.00 C ATOM 1397 CD GLU A 97 5.845 4.382 4.244 1.00 0.00 C ATOM 1398 OE1 GLU A 97 7.032 4.215 4.014 1.00 0.00 O ATOM 1399 OE2 GLU A 97 5.336 4.240 5.343 1.00 0.00 O ATOM 0 H GLU A 97 5.170 4.386 -0.259 1.00 0.00 H new ATOM 0 HA GLU A 97 3.903 6.631 1.297 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.573 5.128 1.708 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.104 6.552 2.616 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.069 5.331 3.458 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.565 3.905 2.569 1.00 0.00 H new ATOM 1406 N LEU A 98 5.157 8.268 -0.037 1.00 0.00 N ATOM 1407 CA LEU A 98 5.910 9.256 -0.853 1.00 0.00 C ATOM 1408 C LEU A 98 6.956 9.754 0.123 1.00 0.00 C ATOM 1409 O LEU A 98 6.785 10.758 0.781 1.00 0.00 O ATOM 1410 CB LEU A 98 4.902 10.354 -1.222 1.00 0.00 C ATOM 1411 CG LEU A 98 3.633 9.711 -1.794 1.00 0.00 C ATOM 1412 CD1 LEU A 98 2.555 10.767 -1.991 1.00 0.00 C ATOM 1413 CD2 LEU A 98 3.952 9.021 -3.122 1.00 0.00 C ATOM 0 H LEU A 98 4.333 8.637 0.439 1.00 0.00 H new ATOM 0 HA LEU A 98 6.366 8.890 -1.773 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.657 10.948 -0.342 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.340 11.034 -1.953 1.00 0.00 H new ATOM 0 HG LEU A 98 3.264 8.965 -1.091 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.658 10.300 -2.398 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.320 11.230 -1.033 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.914 11.528 -2.684 1.00 0.00 H new ATOM 0 HD21 LEU A 98 3.046 8.566 -3.523 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.334 9.756 -3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.704 8.249 -2.959 1.00 0.00 H new ATOM 1425 N MET A 99 8.028 9.018 0.253 1.00 0.00 N ATOM 1426 CA MET A 99 9.021 9.375 1.309 1.00 0.00 C ATOM 1427 C MET A 99 9.981 10.484 0.843 1.00 0.00 C ATOM 1428 O MET A 99 10.230 11.409 1.577 1.00 0.00 O ATOM 1429 CB MET A 99 9.823 8.075 1.531 1.00 0.00 C ATOM 1430 CG MET A 99 10.713 8.239 2.767 1.00 0.00 C ATOM 1431 SD MET A 99 10.644 6.737 3.771 1.00 0.00 S ATOM 1432 CE MET A 99 8.889 6.850 4.188 1.00 0.00 C ATOM 0 H MET A 99 8.257 8.201 -0.313 1.00 0.00 H new ATOM 0 HA MET A 99 8.526 9.748 2.206 1.00 0.00 H new ATOM 0 HB2 MET A 99 9.144 7.233 1.666 1.00 0.00 H new ATOM 0 HB3 MET A 99 10.433 7.856 0.655 1.00 0.00 H new ATOM 0 HG2 MET A 99 11.741 8.438 2.463 1.00 0.00 H new ATOM 0 HG3 MET A 99 10.382 9.096 3.354 1.00 0.00 H new ATOM 0 HE1 MET A 99 8.720 6.413 5.172 1.00 0.00 H new ATOM 0 HE2 MET A 99 8.584 7.896 4.199 1.00 0.00 H new ATOM 0 HE3 MET A 99 8.303 6.309 3.445 1.00 0.00 H new ATOM 1442 N TYR A 100 10.515 10.390 -0.342 1.00 0.00 N ATOM 1443 CA TYR A 100 11.488 11.431 -0.836 1.00 0.00 C ATOM 1444 C TYR A 100 10.834 12.798 -1.123 1.00 0.00 C ATOM 1445 O TYR A 100 11.396 13.826 -0.793 1.00 0.00 O ATOM 1446 CB TYR A 100 12.086 10.847 -2.119 1.00 0.00 C ATOM 1447 CG TYR A 100 12.963 9.665 -1.782 1.00 0.00 C ATOM 1448 CD1 TYR A 100 12.413 8.354 -1.716 1.00 0.00 C ATOM 1449 CD2 TYR A 100 14.347 9.864 -1.533 1.00 0.00 C ATOM 1450 CE1 TYR A 100 13.250 7.244 -1.391 1.00 0.00 C ATOM 1451 CE2 TYR A 100 15.181 8.756 -1.213 1.00 0.00 C ATOM 1452 CZ TYR A 100 14.633 7.445 -1.143 1.00 0.00 C ATOM 1453 OH TYR A 100 15.445 6.378 -0.812 1.00 0.00 O ATOM 0 H TYR A 100 10.324 9.635 -1.001 1.00 0.00 H new ATOM 0 HA TYR A 100 12.235 11.635 -0.069 1.00 0.00 H new ATOM 0 HB2 TYR A 100 11.289 10.539 -2.795 1.00 0.00 H new ATOM 0 HB3 TYR A 100 12.669 11.608 -2.639 1.00 0.00 H new ATOM 0 HD1 TYR A 100 11.362 8.199 -1.912 1.00 0.00 H new ATOM 0 HD2 TYR A 100 14.767 10.857 -1.587 1.00 0.00 H new ATOM 0 HE1 TYR A 100 12.830 6.250 -1.334 1.00 0.00 H new ATOM 0 HE2 TYR A 100 16.233 8.911 -1.023 1.00 0.00 H new ATOM 0 HH TYR A 100 16.363 6.695 -0.677 1.00 0.00 H new ATOM 1463 N PRO A 101 9.674 12.801 -1.750 1.00 0.00 N ATOM 1464 CA PRO A 101 9.026 14.094 -2.085 1.00 0.00 C ATOM 1465 C PRO A 101 8.271 14.605 -0.844 1.00 0.00 C ATOM 1466 O PRO A 101 7.662 13.813 -0.107 1.00 0.00 O ATOM 1467 CB PRO A 101 8.054 13.716 -3.225 1.00 0.00 C ATOM 1468 CG PRO A 101 7.725 12.277 -2.987 1.00 0.00 C ATOM 1469 CD PRO A 101 8.881 11.666 -2.231 1.00 0.00 C ATOM 0 HA PRO A 101 9.715 14.885 -2.381 1.00 0.00 H new ATOM 0 HB2 PRO A 101 7.157 14.336 -3.202 1.00 0.00 H new ATOM 0 HB3 PRO A 101 8.516 13.860 -4.202 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.801 12.184 -2.416 1.00 0.00 H new ATOM 0 HG3 PRO A 101 7.568 11.758 -3.933 1.00 0.00 H new ATOM 0 HD2 PRO A 101 8.528 11.053 -1.401 1.00 0.00 H new ATOM 0 HD3 PRO A 101 9.474 11.018 -2.876 1.00 0.00 H new ATOM 1477 N PRO A 102 8.272 15.926 -0.617 1.00 0.00 N ATOM 1478 CA PRO A 102 7.533 16.485 0.519 1.00 0.00 C ATOM 1479 C PRO A 102 6.024 16.906 -0.025 1.00 0.00 C ATOM 1480 O PRO A 102 5.954 16.988 -1.215 1.00 0.00 O ATOM 1481 CB PRO A 102 8.412 17.713 0.903 1.00 0.00 C ATOM 1482 CG PRO A 102 9.152 18.105 -0.353 1.00 0.00 C ATOM 1483 CD PRO A 102 8.972 16.993 -1.361 1.00 0.00 C ATOM 0 HA PRO A 102 7.375 15.826 1.373 1.00 0.00 H new ATOM 0 HB2 PRO A 102 7.796 18.536 1.265 1.00 0.00 H new ATOM 0 HB3 PRO A 102 9.108 17.460 1.703 1.00 0.00 H new ATOM 0 HG2 PRO A 102 8.765 19.044 -0.747 1.00 0.00 H new ATOM 0 HG3 PRO A 102 10.210 18.261 -0.140 1.00 0.00 H new ATOM 0 HD2 PRO A 102 8.388 17.326 -2.219 1.00 0.00 H new ATOM 0 HD3 PRO A 102 9.932 16.646 -1.744 1.00 0.00 H new ATOM 1491 N PRO A 103 4.870 17.383 0.812 1.00 0.00 N ATOM 1492 CA PRO A 103 5.556 16.913 2.089 1.00 0.00 C ATOM 1493 C PRO A 103 5.184 15.415 2.558 1.00 0.00 C ATOM 1494 O PRO A 103 4.812 15.129 3.721 1.00 0.00 O ATOM 1495 CB PRO A 103 5.317 17.887 3.149 1.00 0.00 C ATOM 1496 CG PRO A 103 4.052 18.438 2.865 1.00 0.00 C ATOM 1497 CD PRO A 103 3.549 17.427 1.777 1.00 0.00 C ATOM 0 HA PRO A 103 6.621 16.853 1.863 1.00 0.00 H new ATOM 0 HB2 PRO A 103 5.329 17.412 4.130 1.00 0.00 H new ATOM 0 HB3 PRO A 103 6.089 18.657 3.158 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.403 18.464 3.741 1.00 0.00 H new ATOM 0 HG3 PRO A 103 4.118 19.458 2.487 1.00 0.00 H new ATOM 0 HD2 PRO A 103 3.304 16.451 2.195 1.00 0.00 H new ATOM 0 HD3 PRO A 103 2.661 17.782 1.254 1.00 0.00 H new ATOM 1505 N TYR A 104 5.255 14.449 1.659 1.00 0.00 N ATOM 1506 CA TYR A 104 4.939 13.026 1.964 1.00 0.00 C ATOM 1507 C TYR A 104 3.521 12.870 2.551 1.00 0.00 C ATOM 1508 O TYR A 104 3.218 13.254 3.664 1.00 0.00 O ATOM 1509 CB TYR A 104 6.019 12.509 2.918 1.00 0.00 C ATOM 1510 CG TYR A 104 5.686 11.077 3.351 1.00 0.00 C ATOM 1511 CD1 TYR A 104 4.842 10.251 2.540 1.00 0.00 C ATOM 1512 CD2 TYR A 104 6.234 10.569 4.540 1.00 0.00 C ATOM 1513 CE1 TYR A 104 4.509 8.950 2.959 1.00 0.00 C ATOM 1514 CE2 TYR A 104 5.905 9.267 4.970 1.00 0.00 C ATOM 1515 CZ TYR A 104 5.055 8.440 4.164 1.00 0.00 C ATOM 1516 OH TYR A 104 4.754 7.160 4.582 1.00 0.00 O ATOM 0 H TYR A 104 5.532 14.608 0.690 1.00 0.00 H new ATOM 0 HA TYR A 104 4.941 12.434 1.049 1.00 0.00 H new ATOM 0 HB2 TYR A 104 6.992 12.534 2.428 1.00 0.00 H new ATOM 0 HB3 TYR A 104 6.086 13.157 3.792 1.00 0.00 H new ATOM 0 HD1 TYR A 104 4.460 10.629 1.603 1.00 0.00 H new ATOM 0 HD2 TYR A 104 6.908 11.176 5.126 1.00 0.00 H new ATOM 0 HE1 TYR A 104 3.841 8.343 2.366 1.00 0.00 H new ATOM 0 HE2 TYR A 104 6.293 8.893 5.906 1.00 0.00 H new ATOM 0 HH TYR A 104 5.215 6.975 5.427 1.00 0.00 H new ATOM 1526 N TYR A 105 2.614 12.281 1.795 1.00 0.00 N ATOM 1527 CA TYR A 105 1.206 12.077 2.290 1.00 0.00 C ATOM 1528 C TYR A 105 0.660 10.783 1.697 1.00 0.00 C ATOM 1529 O TYR A 105 0.329 10.730 0.528 1.00 0.00 O ATOM 1530 CB TYR A 105 0.382 13.211 1.705 1.00 0.00 C ATOM 1531 CG TYR A 105 -0.982 13.231 2.351 1.00 0.00 C ATOM 1532 CD1 TYR A 105 -2.038 12.497 1.770 1.00 0.00 C ATOM 1533 CD2 TYR A 105 -1.214 14.020 3.512 1.00 0.00 C ATOM 1534 CE1 TYR A 105 -3.330 12.512 2.371 1.00 0.00 C ATOM 1535 CE2 TYR A 105 -2.503 14.042 4.114 1.00 0.00 C ATOM 1536 CZ TYR A 105 -3.567 13.302 3.533 1.00 0.00 C ATOM 1537 OH TYR A 105 -4.828 13.331 4.103 1.00 0.00 O ATOM 0 H TYR A 105 2.790 11.932 0.853 1.00 0.00 H new ATOM 0 HA TYR A 105 1.172 12.044 3.379 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.887 14.163 1.869 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.283 13.084 0.627 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -1.867 11.924 0.870 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.410 14.603 3.937 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -4.130 11.924 1.946 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -2.672 14.620 5.011 1.00 0.00 H new ATOM 0 HH TYR A 105 -4.818 13.917 4.889 1.00 0.00 H new ATOM 1547 N LEU A 106 0.555 9.740 2.473 1.00 0.00 N ATOM 1548 CA LEU A 106 0.019 8.467 1.899 1.00 0.00 C ATOM 1549 C LEU A 106 -0.524 7.496 2.949 1.00 0.00 C ATOM 1550 O LEU A 106 -0.916 7.879 4.040 1.00 0.00 O ATOM 1551 CB LEU A 106 1.204 7.859 1.132 1.00 0.00 C ATOM 1552 CG LEU A 106 1.037 8.005 -0.396 1.00 0.00 C ATOM 1553 CD1 LEU A 106 1.870 6.941 -1.105 1.00 0.00 C ATOM 1554 CD2 LEU A 106 -0.423 7.866 -0.852 1.00 0.00 C ATOM 0 H LEU A 106 0.810 9.709 3.460 1.00 0.00 H new ATOM 0 HA LEU A 106 -0.843 8.667 1.263 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.127 8.347 1.444 1.00 0.00 H new ATOM 0 HB3 LEU A 106 1.299 6.804 1.388 1.00 0.00 H new ATOM 0 HG LEU A 106 1.374 9.008 -0.655 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.751 7.045 -2.184 1.00 0.00 H new ATOM 0 HD12 LEU A 106 2.920 7.066 -0.842 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.534 5.951 -0.797 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.478 7.978 -1.935 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.801 6.884 -0.569 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -1.028 8.638 -0.376 1.00 0.00 H new ATOM 1566 N GLY A 108 -0.586 6.233 2.592 1.00 0.00 N ATOM 1567 CA GLY A 108 -1.143 5.209 3.525 1.00 0.00 C ATOM 1568 C GLY A 108 -0.503 3.843 3.260 1.00 0.00 C ATOM 1569 O GLY A 108 0.495 3.735 2.571 1.00 0.00 O ATOM 0 H GLY A 108 -0.273 5.870 1.692 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.960 5.510 4.557 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.224 5.142 3.399 1.00 0.00 H new ATOM 1573 N ILE A 109 -1.063 2.802 3.823 1.00 0.00 N ATOM 1574 CA ILE A 109 -0.499 1.438 3.646 1.00 0.00 C ATOM 1575 C ILE A 109 -1.618 0.428 3.339 1.00 0.00 C ATOM 1576 O ILE A 109 -2.790 0.724 3.476 1.00 0.00 O ATOM 1577 CB ILE A 109 0.121 1.145 5.013 1.00 0.00 C ATOM 1578 CG1 ILE A 109 1.233 2.152 5.328 1.00 0.00 C ATOM 1579 CG2 ILE A 109 0.676 -0.271 5.051 1.00 0.00 C ATOM 1580 CD1 ILE A 109 2.336 2.049 4.284 1.00 0.00 C ATOM 0 H ILE A 109 -1.899 2.845 4.405 1.00 0.00 H new ATOM 0 HA ILE A 109 0.211 1.368 2.822 1.00 0.00 H new ATOM 0 HB ILE A 109 -0.659 1.239 5.769 1.00 0.00 H new ATOM 0 HG12 ILE A 109 0.827 3.163 5.342 1.00 0.00 H new ATOM 0 HG13 ILE A 109 1.640 1.959 6.320 1.00 0.00 H new ATOM 0 HG21 ILE A 109 1.114 -0.464 6.030 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -0.129 -0.982 4.867 1.00 0.00 H new ATOM 0 HG23 ILE A 109 1.441 -0.382 4.283 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.123 2.767 4.514 1.00 0.00 H new ATOM 0 HD12 ILE A 109 2.751 1.041 4.292 1.00 0.00 H new ATOM 0 HD13 ILE A 109 1.925 2.265 3.298 1.00 0.00 H new ATOM 1592 N GLY A 110 -1.253 -0.770 2.949 1.00 0.00 N ATOM 1593 CA GLY A 110 -2.275 -1.819 2.655 1.00 0.00 C ATOM 1594 C GLY A 110 -2.297 -2.817 3.815 1.00 0.00 C ATOM 1595 O GLY A 110 -1.265 -3.174 4.350 1.00 0.00 O ATOM 0 H GLY A 110 -0.285 -1.066 2.822 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.258 -1.365 2.528 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.036 -2.329 1.722 1.00 0.00 H new ATOM 1599 N ASN A 111 -3.464 -3.261 4.217 1.00 0.00 N ATOM 1600 CA ASN A 111 -3.547 -4.221 5.361 1.00 0.00 C ATOM 1601 C ASN A 111 -2.778 -5.508 5.040 1.00 0.00 C ATOM 1602 O ASN A 111 -2.137 -6.083 5.900 1.00 0.00 O ATOM 1603 CB ASN A 111 -5.036 -4.517 5.546 1.00 0.00 C ATOM 1604 CG ASN A 111 -5.241 -5.220 6.889 1.00 0.00 C ATOM 1605 OD1 ASN A 111 -5.469 -6.412 6.953 1.00 0.00 O ATOM 1606 ND2 ASN A 111 -5.161 -4.482 7.966 1.00 0.00 N ATOM 0 H ASN A 111 -4.359 -3.001 3.803 1.00 0.00 H new ATOM 0 HA ASN A 111 -3.105 -3.806 6.267 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -5.611 -3.591 5.514 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -5.399 -5.146 4.733 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -4.969 -3.483 7.887 1.00 0.00 H new ATOM 1612 N GLY A 112 -2.820 -5.950 3.807 1.00 0.00 N ATOM 1613 CA GLY A 112 -2.073 -7.183 3.424 1.00 0.00 C ATOM 1614 C GLY A 112 -2.974 -8.195 2.714 1.00 0.00 C ATOM 1615 O GLY A 112 -4.136 -8.357 3.030 1.00 0.00 O ATOM 0 H GLY A 112 -3.341 -5.508 3.050 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -1.241 -6.916 2.772 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -1.645 -7.640 4.316 1.00 0.00 H new ATOM 1619 N THR A 113 -2.410 -8.888 1.761 1.00 0.00 N ATOM 1620 CA THR A 113 -3.164 -9.924 0.999 1.00 0.00 C ATOM 1621 C THR A 113 -2.546 -11.290 1.278 1.00 0.00 C ATOM 1622 O THR A 113 -1.335 -11.427 1.273 1.00 0.00 O ATOM 1623 CB THR A 113 -2.940 -9.575 -0.478 1.00 0.00 C ATOM 1624 OG1 THR A 113 -3.435 -8.272 -0.740 1.00 0.00 O ATOM 1625 CG2 THR A 113 -3.650 -10.603 -1.376 1.00 0.00 C ATOM 0 H THR A 113 -1.438 -8.776 1.473 1.00 0.00 H new ATOM 0 HA THR A 113 -4.220 -9.951 1.267 1.00 0.00 H new ATOM 0 HB THR A 113 -1.872 -9.601 -0.695 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.289 -8.147 -0.276 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.485 -10.347 -2.423 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.249 -11.597 -1.178 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.719 -10.594 -1.164 1.00 0.00 H new ATOM 1633 N GLN A 114 -3.345 -12.304 1.485 1.00 0.00 N ATOM 1634 CA GLN A 114 -2.740 -13.649 1.715 1.00 0.00 C ATOM 1635 C GLN A 114 -2.571 -14.363 0.378 1.00 0.00 C ATOM 1636 O GLN A 114 -3.515 -14.537 -0.363 1.00 0.00 O ATOM 1637 CB GLN A 114 -3.688 -14.433 2.637 1.00 0.00 C ATOM 1638 CG GLN A 114 -3.043 -15.783 2.971 1.00 0.00 C ATOM 1639 CD GLN A 114 -3.400 -16.192 4.398 1.00 0.00 C ATOM 1640 OE1 GLN A 114 -4.455 -15.854 4.897 1.00 0.00 O ATOM 1641 NE2 GLN A 114 -2.553 -16.914 5.080 1.00 0.00 N ATOM 0 H GLN A 114 -4.364 -12.263 1.505 1.00 0.00 H new ATOM 0 HA GLN A 114 -1.758 -13.566 2.180 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.879 -13.869 3.550 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.651 -14.585 2.149 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -3.386 -16.543 2.269 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -1.960 -15.715 2.863 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -1.668 -17.196 4.658 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -2.776 -17.196 6.035 1.00 0.00 H new ATOM 1650 N ILE A 115 -1.376 -14.781 0.059 1.00 0.00 N ATOM 1651 CA ILE A 115 -1.178 -15.499 -1.225 1.00 0.00 C ATOM 1652 C ILE A 115 -1.369 -16.998 -0.964 1.00 0.00 C ATOM 1653 O ILE A 115 -0.797 -17.547 -0.034 1.00 0.00 O ATOM 1654 CB ILE A 115 0.254 -15.181 -1.673 1.00 0.00 C ATOM 1655 CG1 ILE A 115 0.372 -13.679 -1.955 1.00 0.00 C ATOM 1656 CG2 ILE A 115 0.583 -15.966 -2.947 1.00 0.00 C ATOM 1657 CD1 ILE A 115 1.821 -13.331 -2.306 1.00 0.00 C ATOM 0 H ILE A 115 -0.538 -14.657 0.628 1.00 0.00 H new ATOM 0 HA ILE A 115 -1.883 -15.200 -2.001 1.00 0.00 H new ATOM 0 HB ILE A 115 0.953 -15.464 -0.886 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.288 -13.401 -2.777 1.00 0.00 H new ATOM 0 HG13 ILE A 115 0.052 -13.109 -1.082 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.601 -15.738 -3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 115 0.495 -17.034 -2.749 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -0.113 -15.685 -3.737 1.00 0.00 H new ATOM 0 HD11 ILE A 115 1.900 -12.262 -2.506 1.00 0.00 H new ATOM 0 HD12 ILE A 115 2.471 -13.593 -1.471 1.00 0.00 H new ATOM 0 HD13 ILE A 115 2.125 -13.889 -3.192 1.00 0.00 H new ATOM 1669 N TYR A 116 -2.181 -17.654 -1.757 1.00 0.00 N ATOM 1670 CA TYR A 116 -2.431 -19.113 -1.543 1.00 0.00 C ATOM 1671 C TYR A 116 -1.617 -19.978 -2.500 1.00 0.00 C ATOM 1672 O TYR A 116 -1.506 -19.690 -3.677 1.00 0.00 O ATOM 1673 CB TYR A 116 -3.925 -19.331 -1.841 1.00 0.00 C ATOM 1674 CG TYR A 116 -4.835 -18.866 -0.703 1.00 0.00 C ATOM 1675 CD1 TYR A 116 -4.362 -18.774 0.646 1.00 0.00 C ATOM 1676 CD2 TYR A 116 -6.201 -18.555 -0.987 1.00 0.00 C ATOM 1677 CE1 TYR A 116 -5.246 -18.382 1.685 1.00 0.00 C ATOM 1678 CE2 TYR A 116 -7.074 -18.162 0.054 1.00 0.00 C ATOM 1679 CZ TYR A 116 -6.600 -18.081 1.392 1.00 0.00 C ATOM 1680 OH TYR A 116 -7.457 -17.701 2.404 1.00 0.00 O ATOM 0 H TYR A 116 -2.682 -17.241 -2.544 1.00 0.00 H new ATOM 0 HA TYR A 116 -2.147 -19.394 -0.529 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -4.190 -18.796 -2.753 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -4.101 -20.390 -2.030 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -3.331 -19.003 0.873 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -6.568 -18.620 -2.001 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -4.886 -18.313 2.701 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -8.104 -17.923 -0.168 1.00 0.00 H new ATOM 0 HH TYR A 116 -8.347 -17.530 2.032 1.00 0.00 H new ATOM 1690 N VAL A 117 -1.097 -21.071 -2.003 1.00 0.00 N ATOM 1691 CA VAL A 117 -0.344 -22.008 -2.878 1.00 0.00 C ATOM 1692 C VAL A 117 -1.320 -23.078 -3.362 1.00 0.00 C ATOM 1693 O VAL A 117 -2.433 -23.171 -2.878 1.00 0.00 O ATOM 1694 CB VAL A 117 0.768 -22.619 -2.012 1.00 0.00 C ATOM 1695 CG1 VAL A 117 0.166 -23.339 -0.800 1.00 0.00 C ATOM 1696 CG2 VAL A 117 1.570 -23.622 -2.855 1.00 0.00 C ATOM 0 H VAL A 117 -1.164 -21.352 -1.025 1.00 0.00 H new ATOM 0 HA VAL A 117 0.095 -21.520 -3.748 1.00 0.00 H new ATOM 0 HB VAL A 117 1.422 -21.822 -1.658 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.966 -23.767 -0.196 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -0.401 -22.628 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.496 -24.135 -1.141 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.361 -24.059 -2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 117 0.907 -24.411 -3.210 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.012 -23.108 -3.709 1.00 0.00 H new ATOM 1706 N ILE A 118 -0.927 -23.867 -4.315 1.00 0.00 N ATOM 1707 CA ILE A 118 -1.840 -24.914 -4.843 1.00 0.00 C ATOM 1708 C ILE A 118 -1.525 -26.277 -4.219 1.00 0.00 C ATOM 1709 O ILE A 118 -0.433 -26.796 -4.349 1.00 0.00 O ATOM 1710 CB ILE A 118 -1.557 -24.912 -6.343 1.00 0.00 C ATOM 1711 CG1 ILE A 118 -1.818 -23.517 -6.936 1.00 0.00 C ATOM 1712 CG2 ILE A 118 -2.441 -25.944 -7.046 1.00 0.00 C ATOM 1713 CD1 ILE A 118 -3.230 -23.054 -6.580 1.00 0.00 C ATOM 0 H ILE A 118 -0.007 -23.833 -4.755 1.00 0.00 H new ATOM 0 HA ILE A 118 -2.888 -24.722 -4.614 1.00 0.00 H new ATOM 0 HB ILE A 118 -0.510 -25.171 -6.498 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.086 -22.807 -6.552 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -1.698 -23.545 -8.019 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.231 -25.934 -8.116 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -2.233 -26.936 -6.644 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.490 -25.698 -6.880 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -3.406 -22.065 -7.004 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -3.957 -23.758 -6.986 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -3.335 -23.008 -5.496 1.00 0.00 H new ATOM 1725 N ASP A 119 -2.484 -26.854 -3.540 1.00 0.00 N ATOM 1726 CA ASP A 119 -2.270 -28.184 -2.898 1.00 0.00 C ATOM 1727 C ASP A 119 -3.491 -29.090 -3.145 1.00 0.00 C ATOM 1728 O ASP A 119 -4.604 -28.695 -2.860 1.00 0.00 O ATOM 1729 CB ASP A 119 -2.125 -27.876 -1.403 1.00 0.00 C ATOM 1730 CG ASP A 119 -1.797 -29.157 -0.621 1.00 0.00 C ATOM 1731 OD1 ASP A 119 -1.921 -30.234 -1.185 1.00 0.00 O ATOM 1732 OD2 ASP A 119 -1.434 -29.037 0.538 1.00 0.00 O ATOM 0 H ASP A 119 -3.413 -26.456 -3.403 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.399 -28.705 -3.296 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -1.337 -27.138 -1.252 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -3.048 -27.438 -1.024 1.00 0.00 H new ATOM 1737 N PRO A 120 -3.260 -30.279 -3.669 1.00 0.00 N ATOM 1738 CA PRO A 120 -4.389 -31.209 -3.936 1.00 0.00 C ATOM 1739 C PRO A 120 -4.983 -31.725 -2.622 1.00 0.00 C ATOM 1740 O PRO A 120 -4.349 -31.679 -1.585 1.00 0.00 O ATOM 1741 CB PRO A 120 -3.745 -32.343 -4.730 1.00 0.00 C ATOM 1742 CG PRO A 120 -2.303 -32.310 -4.342 1.00 0.00 C ATOM 1743 CD PRO A 120 -1.967 -30.872 -4.053 1.00 0.00 C ATOM 0 HA PRO A 120 -5.212 -30.738 -4.473 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.198 -33.304 -4.486 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.869 -32.195 -5.803 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.123 -32.933 -3.466 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.677 -32.700 -5.145 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -1.234 -30.786 -3.251 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -1.544 -30.377 -4.927 1.00 0.00 H new ATOM 1751 N GLU A 121 -6.198 -32.211 -2.661 1.00 0.00 N ATOM 1752 CA GLU A 121 -6.845 -32.732 -1.419 1.00 0.00 C ATOM 1753 C GLU A 121 -6.977 -34.262 -1.488 1.00 0.00 C ATOM 1754 O GLU A 121 -7.211 -34.806 -2.549 1.00 0.00 O ATOM 1755 CB GLU A 121 -8.227 -32.076 -1.387 1.00 0.00 C ATOM 1756 CG GLU A 121 -8.077 -30.558 -1.249 1.00 0.00 C ATOM 1757 CD GLU A 121 -7.425 -30.224 0.096 1.00 0.00 C ATOM 1758 OE1 GLU A 121 -7.999 -30.577 1.113 1.00 0.00 O ATOM 1759 OE2 GLU A 121 -6.364 -29.622 0.084 1.00 0.00 O ATOM 0 H GLU A 121 -6.771 -32.269 -3.503 1.00 0.00 H new ATOM 0 HA GLU A 121 -6.264 -32.504 -0.525 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -8.775 -32.315 -2.299 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -8.808 -32.471 -0.553 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -7.470 -30.167 -2.065 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -9.053 -30.078 -1.320 1.00 0.00 H new ATOM 1766 N PRO A 122 -6.812 -34.920 -0.358 1.00 0.00 N ATOM 1767 CA PRO A 122 -6.920 -36.403 -0.328 1.00 0.00 C ATOM 1768 C PRO A 122 -8.357 -36.863 -0.597 1.00 0.00 C ATOM 1769 O PRO A 122 -8.589 -37.999 -0.967 1.00 0.00 O ATOM 1770 CB PRO A 122 -6.479 -36.769 1.088 1.00 0.00 C ATOM 1771 CG PRO A 122 -6.746 -35.544 1.899 1.00 0.00 C ATOM 1772 CD PRO A 122 -6.536 -34.370 0.981 1.00 0.00 C ATOM 0 HA PRO A 122 -6.314 -36.884 -1.096 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -7.038 -37.624 1.468 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -5.424 -37.040 1.116 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -7.763 -35.553 2.292 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -6.074 -35.492 2.756 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -7.209 -33.547 1.223 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -5.520 -33.982 1.053 1.00 0.00 H new ATOM 1780 N CYS A 123 -9.324 -35.996 -0.411 1.00 0.00 N ATOM 1781 CA CYS A 123 -10.744 -36.392 -0.657 1.00 0.00 C ATOM 1782 C CYS A 123 -11.437 -35.366 -1.570 1.00 0.00 C ATOM 1783 O CYS A 123 -11.222 -34.179 -1.424 1.00 0.00 O ATOM 1784 CB CYS A 123 -11.395 -36.401 0.727 1.00 0.00 C ATOM 1785 SG CYS A 123 -10.618 -37.675 1.751 1.00 0.00 S ATOM 0 H CYS A 123 -9.190 -35.034 -0.100 1.00 0.00 H new ATOM 0 HA CYS A 123 -10.821 -37.359 -1.154 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -11.286 -35.424 1.198 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -12.464 -36.594 0.637 1.00 0.00 H new ATOM 0 HG CYS A 123 -11.170 -37.682 2.928 1.00 0.00 H new ATOM 1791 N PRO A 124 -12.253 -35.845 -2.489 1.00 0.00 N ATOM 1792 CA PRO A 124 -12.966 -34.924 -3.412 1.00 0.00 C ATOM 1793 C PRO A 124 -14.036 -34.117 -2.665 1.00 0.00 C ATOM 1794 O PRO A 124 -14.480 -33.086 -3.134 1.00 0.00 O ATOM 1795 CB PRO A 124 -13.604 -35.861 -4.436 1.00 0.00 C ATOM 1796 CG PRO A 124 -13.741 -37.168 -3.727 1.00 0.00 C ATOM 1797 CD PRO A 124 -12.595 -37.254 -2.755 1.00 0.00 C ATOM 0 HA PRO A 124 -12.304 -34.187 -3.868 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -14.573 -35.486 -4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.981 -35.957 -5.325 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -14.696 -37.227 -3.205 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -13.712 -37.997 -4.434 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -12.883 -37.775 -1.842 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -11.751 -37.797 -3.179 1.00 0.00 H new ATOM 1805 N ASP A 125 -14.454 -34.577 -1.509 1.00 0.00 N ATOM 1806 CA ASP A 125 -15.497 -33.836 -0.737 1.00 0.00 C ATOM 1807 C ASP A 125 -15.308 -34.055 0.769 1.00 0.00 C ATOM 1808 O ASP A 125 -14.461 -34.820 1.192 1.00 0.00 O ATOM 1809 CB ASP A 125 -16.835 -34.420 -1.217 1.00 0.00 C ATOM 1810 CG ASP A 125 -16.934 -35.917 -0.873 1.00 0.00 C ATOM 1811 OD1 ASP A 125 -15.968 -36.464 -0.361 1.00 0.00 O ATOM 1812 OD2 ASP A 125 -17.979 -36.491 -1.132 1.00 0.00 O ATOM 0 H ASP A 125 -14.117 -35.433 -1.069 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.445 -32.759 -0.899 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -17.660 -33.880 -0.752 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -16.931 -34.283 -2.294 1.00 0.00 H new ATOM 1817 N SER A 126 -16.092 -33.386 1.576 1.00 0.00 N ATOM 1818 CA SER A 126 -15.969 -33.547 3.057 1.00 0.00 C ATOM 1819 C SER A 126 -16.589 -34.875 3.500 1.00 0.00 C ATOM 1820 O SER A 126 -17.336 -35.495 2.766 1.00 0.00 O ATOM 1821 CB SER A 126 -16.740 -32.369 3.654 1.00 0.00 C ATOM 1822 OG SER A 126 -18.114 -32.485 3.309 1.00 0.00 O ATOM 0 H SER A 126 -16.814 -32.733 1.272 1.00 0.00 H new ATOM 0 HA SER A 126 -14.929 -33.558 3.383 1.00 0.00 H new ATOM 0 HB2 SER A 126 -16.625 -32.356 4.738 1.00 0.00 H new ATOM 0 HB3 SER A 126 -16.337 -31.428 3.279 1.00 0.00 H new ATOM 0 HG SER A 126 -18.612 -31.733 3.691 1.00 0.00 H new ATOM 1828 N ASP A 127 -16.283 -35.313 4.695 1.00 0.00 N ATOM 1829 CA ASP A 127 -16.851 -36.604 5.194 1.00 0.00 C ATOM 1830 C ASP A 127 -18.375 -36.506 5.302 1.00 0.00 C ATOM 1831 O ASP A 127 -18.911 -35.513 5.756 1.00 0.00 O ATOM 1832 CB ASP A 127 -16.227 -36.811 6.580 1.00 0.00 C ATOM 1833 CG ASP A 127 -16.536 -38.223 7.098 1.00 0.00 C ATOM 1834 OD1 ASP A 127 -17.379 -38.889 6.513 1.00 0.00 O ATOM 1835 OD2 ASP A 127 -15.925 -38.614 8.078 1.00 0.00 O ATOM 0 H ASP A 127 -15.664 -34.832 5.348 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.632 -37.434 4.523 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -15.148 -36.664 6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -16.616 -36.068 7.276 1.00 0.00 H new ATOM 1840 N GLN A 128 -19.072 -37.534 4.888 1.00 0.00 N ATOM 1841 CA GLN A 128 -20.567 -37.511 4.959 1.00 0.00 C ATOM 1842 C GLN A 128 -21.030 -37.538 6.420 1.00 0.00 C ATOM 1843 O GLN A 128 -22.015 -36.919 6.776 1.00 0.00 O ATOM 1844 CB GLN A 128 -21.024 -38.777 4.232 1.00 0.00 C ATOM 1845 CG GLN A 128 -20.620 -38.693 2.759 1.00 0.00 C ATOM 1846 CD GLN A 128 -20.989 -39.999 2.053 1.00 0.00 C ATOM 1847 OE1 GLN A 128 -20.463 -41.047 2.373 1.00 0.00 O ATOM 1848 NE2 GLN A 128 -21.879 -39.982 1.098 1.00 0.00 N ATOM 0 H GLN A 128 -18.671 -38.389 4.503 1.00 0.00 H new ATOM 0 HA GLN A 128 -20.984 -36.610 4.508 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -20.575 -39.656 4.694 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -22.105 -38.889 4.318 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.124 -37.853 2.280 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.548 -38.512 2.675 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -22.321 -39.103 0.829 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -22.132 -40.848 0.621 1.00 0.00 H new ATOM 1857 N GLU A 129 -20.327 -38.251 7.263 1.00 0.00 N ATOM 1858 CA GLU A 129 -20.724 -38.324 8.701 1.00 0.00 C ATOM 1859 C GLU A 129 -19.710 -37.560 9.572 1.00 0.00 C ATOM 1860 O GLU A 129 -18.521 -37.777 9.450 1.00 0.00 O ATOM 1861 CB GLU A 129 -20.702 -39.816 9.039 1.00 0.00 C ATOM 1862 CG GLU A 129 -21.193 -40.023 10.474 1.00 0.00 C ATOM 1863 CD GLU A 129 -21.266 -41.521 10.782 1.00 0.00 C ATOM 1864 OE1 GLU A 129 -21.545 -42.283 9.869 1.00 0.00 O ATOM 1865 OE2 GLU A 129 -21.042 -41.882 11.925 1.00 0.00 O ATOM 0 H GLU A 129 -19.494 -38.786 7.017 1.00 0.00 H new ATOM 0 HA GLU A 129 -21.701 -37.876 8.884 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -21.336 -40.366 8.344 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -19.692 -40.210 8.929 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -20.519 -39.530 11.174 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -22.175 -39.567 10.602 1.00 0.00 H new ATOM 1872 N PRO A 130 -20.200 -36.693 10.437 1.00 0.00 N ATOM 1873 CA PRO A 130 -19.287 -35.913 11.313 1.00 0.00 C ATOM 1874 C PRO A 130 -18.651 -36.827 12.367 1.00 0.00 C ATOM 1875 O PRO A 130 -19.150 -37.898 12.654 1.00 0.00 O ATOM 1876 CB PRO A 130 -20.203 -34.882 11.969 1.00 0.00 C ATOM 1877 CG PRO A 130 -21.565 -35.491 11.919 1.00 0.00 C ATOM 1878 CD PRO A 130 -21.612 -36.346 10.680 1.00 0.00 C ATOM 0 HA PRO A 130 -18.462 -35.453 10.769 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -19.898 -34.679 12.996 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -20.175 -33.932 11.435 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -21.754 -36.090 12.810 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -22.333 -34.719 11.885 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -22.222 -37.236 10.832 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -22.042 -35.805 9.837 1.00 0.00 H new ATOM 1886 N LYS A 131 -17.551 -36.407 12.940 1.00 0.00 N ATOM 1887 CA LYS A 131 -16.874 -37.241 13.977 1.00 0.00 C ATOM 1888 C LYS A 131 -16.442 -36.369 15.159 1.00 0.00 C ATOM 1889 O LYS A 131 -17.209 -35.579 15.673 1.00 0.00 O ATOM 1890 CB LYS A 131 -15.653 -37.836 13.275 1.00 0.00 C ATOM 1891 CG LYS A 131 -16.112 -38.810 12.188 1.00 0.00 C ATOM 1892 CD LYS A 131 -14.891 -39.478 11.553 1.00 0.00 C ATOM 1893 CE LYS A 131 -15.351 -40.525 10.536 1.00 0.00 C ATOM 1894 NZ LYS A 131 -14.097 -41.035 9.915 1.00 0.00 N ATOM 0 H LYS A 131 -17.092 -35.520 12.733 1.00 0.00 H new ATOM 0 HA LYS A 131 -17.530 -38.014 14.376 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -15.050 -37.041 12.835 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -15.021 -38.353 13.997 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -16.771 -39.565 12.616 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -16.686 -38.280 11.428 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -14.268 -38.730 11.063 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -14.279 -39.948 12.323 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -15.907 -41.328 11.020 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -16.012 -40.086 9.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -14.330 -41.758 9.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -13.593 -40.250 9.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -13.491 -41.454 10.649 1.00 0.00 H new TER 1908 LYS A 131 HETATM 1909 C1 NAG A 132 -4.381 -4.925 9.108 1.00 0.00 C HETATM 1910 C2 NAG A 132 -3.435 -3.804 9.542 1.00 0.00 C HETATM 1911 C3 NAG A 132 -2.669 -4.195 10.802 1.00 0.00 C HETATM 1912 C4 NAG A 132 -3.628 -4.677 11.884 1.00 0.00 C HETATM 1913 C5 NAG A 132 -4.540 -5.771 11.336 1.00 0.00 C HETATM 1914 C6 NAG A 132 -5.579 -6.213 12.350 1.00 0.00 C HETATM 1915 C7 NAG A 132 -2.111 -2.277 8.261 1.00 0.00 C HETATM 1916 C8 NAG A 132 -0.880 -2.064 7.390 1.00 0.00 C HETATM 1917 N2 NAG A 132 -2.495 -3.509 8.476 1.00 0.00 N HETATM 1918 O3 NAG A 132 -1.936 -3.077 11.281 1.00 0.00 O HETATM 1919 O4 NAG A 132 -2.876 -5.191 13.002 1.00 0.00 O HETATM 1920 O5 NAG A 132 -5.252 -5.290 10.182 1.00 0.00 O HETATM 1921 O6 NAG A 132 -6.752 -6.716 11.669 1.00 0.00 O HETATM 1922 O7 NAG A 132 -2.717 -1.339 8.740 1.00 0.00 O HETATM 0 HO3 NAG A 132 -2.067 -2.990 12.248 1.00 0.00 H new HETATM 0 HN2 NAG A 132 -2.133 -4.264 7.893 1.00 0.00 H new HETATM 0 H83 NAG A 132 -0.022 -2.557 7.847 1.00 0.00 H new HETATM 0 H82 NAG A 132 -1.057 -2.486 6.401 1.00 0.00 H new HETATM 0 H81 NAG A 132 -0.679 -0.997 7.298 1.00 0.00 H new HETATM 0 H62 NAG A 132 -5.163 -6.987 12.995 1.00 0.00 H new HETATM 0 H61 NAG A 132 -5.852 -5.375 12.992 1.00 0.00 H new HETATM 0 H5 NAG A 132 -3.895 -6.613 11.086 1.00 0.00 H new HETATM 0 H4 NAG A 132 -4.242 -3.837 12.210 1.00 0.00 H new HETATM 0 H3 NAG A 132 -1.983 -5.006 10.555 1.00 0.00 H new HETATM 0 H2 NAG A 132 -4.033 -2.919 9.758 1.00 0.00 H new HETATM 1935 C1 NAG A 133 -3.285 -4.763 14.255 1.00 0.00 C HETATM 1936 C2 NAG A 133 -2.759 -5.718 15.326 1.00 0.00 C HETATM 1937 C3 NAG A 133 -3.121 -5.185 16.721 1.00 0.00 C HETATM 1938 C4 NAG A 133 -2.687 -3.730 16.873 1.00 0.00 C HETATM 1939 C5 NAG A 133 -3.200 -2.884 15.712 1.00 0.00 C HETATM 1940 C6 NAG A 133 -2.677 -1.463 15.764 1.00 0.00 C HETATM 1941 C7 NAG A 133 -3.436 -7.920 16.064 1.00 0.00 C HETATM 1942 C8 NAG A 133 -4.839 -8.213 16.569 1.00 0.00 C HETATM 1943 N2 NAG A 133 -3.323 -7.042 15.097 1.00 0.00 N HETATM 1944 O3 NAG A 133 -2.478 -5.968 17.717 1.00 0.00 O HETATM 1945 O4 NAG A 133 -3.197 -3.202 18.113 1.00 0.00 O HETATM 1946 O5 NAG A 133 -2.773 -3.446 14.460 1.00 0.00 O HETATM 1947 O6 NAG A 133 -3.584 -0.559 15.151 1.00 0.00 O HETATM 1948 O7 NAG A 133 -2.461 -8.473 16.533 1.00 0.00 O HETATM 0 HO6 NAG A 133 -3.223 0.351 15.200 1.00 0.00 H new HETATM 0 HO3 NAG A 133 -2.832 -5.730 18.599 1.00 0.00 H new HETATM 0 HN2 NAG A 133 -3.638 -7.292 14.160 1.00 0.00 H new HETATM 0 H83 NAG A 133 -5.287 -7.296 16.952 1.00 0.00 H new HETATM 0 H82 NAG A 133 -5.447 -8.599 15.751 1.00 0.00 H new HETATM 0 H81 NAG A 133 -4.791 -8.954 17.366 1.00 0.00 H new HETATM 0 H62 NAG A 133 -2.513 -1.171 16.801 1.00 0.00 H new HETATM 0 H61 NAG A 133 -1.711 -1.410 15.262 1.00 0.00 H new HETATM 0 H5 NAG A 133 -4.287 -2.875 15.796 1.00 0.00 H new HETATM 0 H4 NAG A 133 -1.598 -3.694 16.873 1.00 0.00 H new HETATM 0 H3 NAG A 133 -4.203 -5.247 16.840 1.00 0.00 H new HETATM 0 H2 NAG A 133 -1.673 -5.789 15.270 1.00 0.00 H new HETATM 1962 C1 FUL A 134 -7.093 -8.021 12.062 1.00 0.00 C HETATM 1963 C2 FUL A 134 -7.496 -7.995 13.540 1.00 0.00 C HETATM 1964 O2 FUL A 134 -8.650 -7.186 13.726 1.00 0.00 O HETATM 1965 C3 FUL A 134 -7.787 -9.414 14.021 1.00 0.00 C HETATM 1966 O3 FUL A 134 -8.055 -9.395 15.416 1.00 0.00 O HETATM 1967 C4 FUL A 134 -6.590 -10.316 13.744 1.00 0.00 C HETATM 1968 O4 FUL A 134 -5.506 -9.926 14.574 1.00 0.00 O HETATM 1969 C5 FUL A 134 -6.163 -10.221 12.280 1.00 0.00 C HETATM 1970 C6 FUL A 134 -4.873 -10.967 12.012 1.00 0.00 C HETATM 1971 O5 FUL A 134 -5.944 -8.845 11.919 1.00 0.00 O HETATM 0 HO4 FUL A 134 -4.951 -9.271 14.101 1.00 0.00 H new HETATM 0 HO3 FUL A 134 -8.243 -10.306 15.725 1.00 0.00 H new HETATM 0 HO2 FUL A 134 -9.178 -7.536 14.473 1.00 0.00 H new HETATM 0 H63 FUL A 134 -4.076 -10.547 12.625 1.00 0.00 H new HETATM 0 H62 FUL A 134 -5.004 -12.021 12.259 1.00 0.00 H new HETATM 0 H61 FUL A 134 -4.609 -10.871 10.959 1.00 0.00 H new HETATM 0 H5 FUL A 134 -6.966 -10.666 11.692 1.00 0.00 H new HETATM 0 H4 FUL A 134 -6.876 -11.346 13.957 1.00 0.00 H new HETATM 0 H3 FUL A 134 -8.655 -9.801 13.487 1.00 0.00 H new HETATM 0 H2 FUL A 134 -6.673 -7.575 14.118 1.00 0.00 H new HETATM 1983 C1 BMA A 135 -2.284 -3.082 19.147 1.00 0.00 C HETATM 1984 C2 BMA A 135 -1.802 -1.637 19.237 1.00 0.00 C HETATM 1985 C3 BMA A 135 -0.878 -1.461 20.437 1.00 0.00 C HETATM 1986 C4 BMA A 135 -1.554 -1.975 21.704 1.00 0.00 C HETATM 1987 C5 BMA A 135 -2.064 -3.400 21.499 1.00 0.00 C HETATM 1988 C6 BMA A 135 -2.851 -3.905 22.692 1.00 0.00 C HETATM 1989 O2 BMA A 135 -2.917 -0.768 19.361 1.00 0.00 O HETATM 1990 O3 BMA A 135 -0.556 -0.087 20.593 1.00 0.00 O HETATM 1991 O4 BMA A 135 -0.626 -1.953 22.779 1.00 0.00 O HETATM 1992 O5 BMA A 135 -2.940 -3.460 20.359 1.00 0.00 O HETATM 1993 O6 BMA A 135 -3.778 -2.930 23.146 1.00 0.00 O HETATM 0 HO6 BMA A 135 -4.273 -3.282 23.915 1.00 0.00 H new HETATM 0 HO4 BMA A 135 -1.111 -1.967 23.630 1.00 0.00 H new HETATM 0 HO3 BMA A 135 0.036 0.024 21.366 1.00 0.00 H new HETATM 0 HO2 BMA A 135 -2.665 0.014 19.895 1.00 0.00 H new HETATM 0 H62 BMA A 135 -3.382 -4.817 22.421 1.00 0.00 H new HETATM 0 H61 BMA A 135 -2.166 -4.163 23.500 1.00 0.00 H new HETATM 0 H5 BMA A 135 -1.180 -4.021 21.355 1.00 0.00 H new HETATM 0 H4 BMA A 135 -2.402 -1.330 21.935 1.00 0.00 H new HETATM 0 H3 BMA A 135 0.034 -2.033 20.267 1.00 0.00 H new HETATM 0 H2 BMA A 135 -1.250 -1.393 18.329 1.00 0.00 H new HETATM 2005 C1 NAG A 136 1.211 -7.403 -12.697 1.00 0.00 C HETATM 2006 C2 NAG A 136 -0.283 -7.704 -12.696 1.00 0.00 C HETATM 2007 C3 NAG A 136 -0.724 -8.301 -14.031 1.00 0.00 C HETATM 2008 C4 NAG A 136 -0.163 -7.519 -15.212 1.00 0.00 C HETATM 2009 C5 NAG A 136 1.325 -7.213 -15.058 1.00 0.00 C HETATM 2010 C6 NAG A 136 1.793 -6.230 -16.120 1.00 0.00 C HETATM 2011 C7 NAG A 136 -1.824 -9.076 -11.470 1.00 0.00 C HETATM 2012 C8 NAG A 136 -2.926 -8.058 -11.235 1.00 0.00 C HETATM 2013 N2 NAG A 136 -0.606 -8.622 -11.619 1.00 0.00 N HETATM 2014 O3 NAG A 136 -2.142 -8.286 -14.103 1.00 0.00 O HETATM 2015 O4 NAG A 136 -0.459 -8.219 -16.451 1.00 0.00 O HETATM 2016 O5 NAG A 136 1.566 -6.580 -13.800 1.00 0.00 O HETATM 2017 O6 NAG A 136 3.214 -6.358 -16.324 1.00 0.00 O HETATM 2018 O7 NAG A 136 -2.062 -10.267 -11.520 1.00 0.00 O HETATM 0 HO3 NAG A 136 -2.430 -8.667 -14.959 1.00 0.00 H new HETATM 0 HN2 NAG A 136 0.125 -8.916 -10.971 1.00 0.00 H new HETATM 0 H83 NAG A 136 -2.714 -7.496 -10.325 1.00 0.00 H new HETATM 0 H82 NAG A 136 -2.975 -7.373 -12.081 1.00 0.00 H new HETATM 0 H81 NAG A 136 -3.881 -8.573 -11.129 1.00 0.00 H new HETATM 0 H62 NAG A 136 1.266 -6.416 -17.056 1.00 0.00 H new HETATM 0 H61 NAG A 136 1.552 -5.212 -15.815 1.00 0.00 H new HETATM 0 H5 NAG A 136 1.856 -8.161 -15.145 1.00 0.00 H new HETATM 0 H4 NAG A 136 -0.656 -6.547 -15.241 1.00 0.00 H new HETATM 0 H3 NAG A 136 -0.343 -9.321 -14.085 1.00 0.00 H new HETATM 0 H2 NAG A 136 -0.816 -6.765 -12.545 1.00 0.00 H new HETATM 2031 C1 NAG A 137 0.547 -8.839 -17.184 1.00 0.00 C HETATM 2032 C2 NAG A 137 0.520 -10.346 -16.941 1.00 0.00 C HETATM 2033 C3 NAG A 137 1.543 -11.044 -17.832 1.00 0.00 C HETATM 2034 C4 NAG A 137 1.377 -10.625 -19.291 1.00 0.00 C HETATM 2035 C5 NAG A 137 1.330 -9.105 -19.417 1.00 0.00 C HETATM 2036 C6 NAG A 137 1.016 -8.654 -20.830 1.00 0.00 C HETATM 2037 C7 NAG A 137 0.555 -11.831 -15.075 1.00 0.00 C HETATM 2038 C8 NAG A 137 1.724 -12.625 -14.517 1.00 0.00 C HETATM 2039 N2 NAG A 137 0.808 -10.642 -15.549 1.00 0.00 N HETATM 2040 O3 NAG A 137 1.392 -12.452 -17.723 1.00 0.00 O HETATM 2041 O4 NAG A 137 2.485 -11.127 -20.062 1.00 0.00 O HETATM 2042 O5 NAG A 137 0.313 -8.554 -18.563 1.00 0.00 O HETATM 2043 O6 NAG A 137 -0.095 -9.363 -21.359 1.00 0.00 O HETATM 2044 O7 NAG A 137 -0.573 -12.283 -15.082 1.00 0.00 O HETATM 0 HO6 NAG A 137 -0.278 -9.052 -22.270 1.00 0.00 H new HETATM 0 HO3 NAG A 137 2.259 -12.886 -17.868 1.00 0.00 H new HETATM 0 HN2 NAG A 137 1.206 -9.924 -14.944 1.00 0.00 H new HETATM 0 H83 NAG A 137 2.466 -12.779 -15.300 1.00 0.00 H new HETATM 0 H82 NAG A 137 2.176 -12.075 -13.691 1.00 0.00 H new HETATM 0 H81 NAG A 137 1.369 -13.591 -14.159 1.00 0.00 H new HETATM 0 H62 NAG A 137 0.805 -7.585 -20.835 1.00 0.00 H new HETATM 0 H61 NAG A 137 1.887 -8.810 -21.467 1.00 0.00 H new HETATM 0 H5 NAG A 137 2.321 -8.751 -19.131 1.00 0.00 H new HETATM 0 H4 NAG A 137 0.440 -11.038 -19.664 1.00 0.00 H new HETATM 0 H3 NAG A 137 2.539 -10.752 -17.500 1.00 0.00 H new HETATM 0 H2 NAG A 137 -0.477 -10.712 -17.183 1.00 0.00 H new HETATM 2058 C1 FUC A 138 3.939 -5.801 -15.264 1.00 0.00 C HETATM 2059 C2 FUC A 138 5.412 -5.787 -15.629 1.00 0.00 C HETATM 2060 C3 FUC A 138 5.545 -5.023 -16.946 1.00 0.00 C HETATM 2061 C4 FUC A 138 4.925 -3.623 -16.822 1.00 0.00 C HETATM 2062 C5 FUC A 138 3.521 -3.660 -16.191 1.00 0.00 C HETATM 2063 C6 FUC A 138 3.012 -2.287 -15.794 1.00 0.00 C HETATM 2064 O2 FUC A 138 5.895 -7.114 -15.778 1.00 0.00 O HETATM 2065 O3 FUC A 138 6.917 -4.905 -17.289 1.00 0.00 O HETATM 2066 O4 FUC A 138 5.785 -2.799 -16.048 1.00 0.00 O HETATM 2067 O5 FUC A 138 3.536 -4.474 -15.006 1.00 0.00 O HETATM 0 HO4 FUC A 138 5.694 -1.867 -16.338 1.00 0.00 H new HETATM 0 HO3 FUC A 138 7.284 -4.086 -16.895 1.00 0.00 H new HETATM 0 HO2 FUC A 138 5.154 -7.706 -16.025 1.00 0.00 H new HETATM 0 H63 FUC A 138 3.690 -1.844 -15.065 1.00 0.00 H new HETATM 0 H62 FUC A 138 2.961 -1.649 -16.676 1.00 0.00 H new HETATM 0 H61 FUC A 138 2.018 -2.380 -15.356 1.00 0.00 H new HETATM 0 H5 FUC A 138 2.859 -4.069 -16.954 1.00 0.00 H new HETATM 0 H4 FUC A 138 4.813 -3.215 -17.826 1.00 0.00 H new HETATM 0 H3 FUC A 138 5.016 -5.573 -17.725 1.00 0.00 H new HETATM 0 H2 FUC A 138 5.999 -5.308 -14.845 1.00 0.00 H new HETATM 2079 C1 BMA A 139 2.350 -12.402 -20.583 1.00 0.00 C HETATM 2080 C2 BMA A 139 1.926 -12.312 -22.045 1.00 0.00 C HETATM 2081 C3 BMA A 139 1.887 -13.699 -22.675 1.00 0.00 C HETATM 2082 C4 BMA A 139 3.213 -14.419 -22.450 1.00 0.00 C HETATM 2083 C5 BMA A 139 3.589 -14.403 -20.970 1.00 0.00 C HETATM 2084 C6 BMA A 139 4.961 -14.997 -20.721 1.00 0.00 C HETATM 2085 O2 BMA A 139 2.840 -11.491 -22.758 1.00 0.00 O HETATM 2086 O3 BMA A 139 1.637 -13.585 -24.068 1.00 0.00 O HETATM 2087 O4 BMA A 139 3.106 -15.763 -22.897 1.00 0.00 O HETATM 2088 O5 BMA A 139 3.619 -13.051 -20.477 1.00 0.00 O HETATM 2089 O6 BMA A 139 5.969 -14.261 -21.398 1.00 0.00 O HETATM 0 HO6 BMA A 139 5.688 -13.326 -21.486 1.00 0.00 H new HETATM 0 HO4 BMA A 139 4.002 -16.127 -23.056 1.00 0.00 H new HETATM 0 HO3 BMA A 139 1.614 -14.478 -24.470 1.00 0.00 H new HETATM 0 HO2 BMA A 139 2.954 -11.841 -23.666 1.00 0.00 H new HETATM 0 H62 BMA A 139 5.169 -15.004 -19.651 1.00 0.00 H new HETATM 0 H61 BMA A 139 4.977 -16.034 -21.056 1.00 0.00 H new HETATM 0 H5 BMA A 139 2.834 -14.999 -20.457 1.00 0.00 H new HETATM 0 H4 BMA A 139 3.990 -13.903 -23.014 1.00 0.00 H new HETATM 0 H3 BMA A 139 1.088 -14.275 -22.208 1.00 0.00 H new HETATM 0 H2 BMA A 139 0.928 -11.876 -22.093 1.00 0.00 H new