USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1021 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 124 THR OG1 : rot 64:sc= 0.386 USER MOD Set 1.2: A 132 LYS NZ :NH3+ -124:sc= 1.28 (180deg=0.203) USER MOD Set 2.1: A 73 ASN : amide:sc= -2.15 K(o=-1.7,f=-2.2!) USER MOD Set 2.2: A 112 TYR OH : rot 157:sc= 0.437 USER MOD Set 3.1: A 32 SER OG : rot -100:sc=2.79e-05 USER MOD Set 3.2: A 33 SER OG : rot 83:sc= 0.371 USER MOD Set 3.3: A 92 TYR OH : rot -107:sc= 0.279 USER MOD Set 4.1: A 18 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 22 HIS : no HE2:sc= -0.902 K(o=-0.9,f=-6.2!) USER MOD Set 5.1: A 1 ALA N :NH3+ -172:sc= 0 (180deg=0) USER MOD Set 5.2: A 3 THR OG1 : rot 180:sc= 0.00363 USER MOD Set 5.3: A 12 ASN : amide:sc= -0.802 K(o=-0.82,f=-2.3) USER MOD Set 5.4: A 14 ASN : amide:sc= -0.0241 X(o=-0.82,f=-0.79) USER MOD Single : A 5 THR OG1 : rot 180:sc=-0.00888 USER MOD Single : A 11 TYR OH : rot 30:sc= -4.48! USER MOD Single : A 13 GLN : amide:sc= -5.38! C(o=-5.4!,f=-7!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -4.79 K(o=-4.8,f=-7.6!) USER MOD Single : A 20 SER OG : rot 167:sc= 1.51 USER MOD Single : A 21 HIS : no HD1:sc= -1.06 K(o=-1.1,f=-0.19) USER MOD Single : A 26 SER OG : rot 59:sc= 0.0584 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 140:sc= -0.753 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HE2:sc= -7.48 K(o=-7.5,f=-9.9!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.0479 USER MOD Single : A 40 ASN : amide:sc= -1.71 K(o=-1.7,f=0.18) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0.00818 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HE2:sc= -3.53 X(o=-3.5,f=-3.2) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= -4.84! C(o=-4.8!,f=-2.6!) USER MOD Single : A 79 TYR OH : rot 100:sc= -0.769 USER MOD Single : A 85 THR OG1 : rot -140:sc= 0 USER MOD Single : A 90 HIS : no HE2:sc= -2.24! C(o=-1.5!,f=-11!) USER MOD Single : A 93 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0937) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -1.11 K(o=-1.1,f=-3!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 130:sc= -0.286 USER MOD Single : A 114 ASN : amide:sc= -0.198 K(o=-0.2,f=-2.4!) USER MOD Single : A 115 LYS NZ :NH3+ -131:sc= -0.063 (180deg=-0.79) USER MOD Single : A 123 HIS : no HD1:sc= -5.47! C(o=-5.5!,f=-5.1!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 ASN : amide:sc= -0.443 X(o=-0.44,f=-0.44) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 135 SER OG : rot 5:sc= 0.347 USER MOD Single : A 136 HIS : no HE2:sc= -1.7 X(o=-1.7,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 1.287 0.003 -0.032 1.00 0.00 N ATOM 2 CA ALA A 1 2.074 0.042 -1.271 1.00 0.00 C ATOM 3 C ALA A 1 2.626 -1.349 -1.503 1.00 0.00 C ATOM 4 O ALA A 1 1.888 -2.214 -1.942 1.00 0.00 O ATOM 5 CB ALA A 1 3.166 1.127 -1.208 1.00 0.00 C ATOM 0 H1 ALA A 1 0.782 0.904 0.087 1.00 0.00 H new ATOM 0 H2 ALA A 1 0.599 -0.775 -0.082 1.00 0.00 H new ATOM 0 H3 ALA A 1 1.922 -0.148 0.778 1.00 0.00 H new ATOM 0 HA ALA A 1 1.450 0.322 -2.120 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.731 1.130 -2.140 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.702 2.102 -1.062 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.839 0.918 -0.377 1.00 0.00 H new ATOM 13 N VAL A 2 3.870 -1.589 -1.109 1.00 0.00 N ATOM 14 CA VAL A 2 4.543 -2.860 -1.303 1.00 0.00 C ATOM 15 C VAL A 2 4.925 -3.407 0.065 1.00 0.00 C ATOM 16 O VAL A 2 5.393 -2.668 0.928 1.00 0.00 O ATOM 17 CB VAL A 2 5.705 -2.660 -2.291 1.00 0.00 C ATOM 18 CG1 VAL A 2 6.793 -1.747 -1.701 1.00 0.00 C ATOM 19 CG2 VAL A 2 6.267 -4.029 -2.651 1.00 0.00 C ATOM 0 H VAL A 2 4.447 -0.892 -0.638 1.00 0.00 H new ATOM 0 HA VAL A 2 3.907 -3.618 -1.760 1.00 0.00 H new ATOM 0 HB VAL A 2 5.339 -2.164 -3.190 1.00 0.00 H new ATOM 0 HG11 VAL A 2 7.599 -1.627 -2.425 1.00 0.00 H new ATOM 0 HG12 VAL A 2 6.364 -0.772 -1.470 1.00 0.00 H new ATOM 0 HG13 VAL A 2 7.188 -2.194 -0.789 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.093 -3.910 -3.352 1.00 0.00 H new ATOM 0 HG22 VAL A 2 6.625 -4.524 -1.748 1.00 0.00 H new ATOM 0 HG23 VAL A 2 5.485 -4.634 -3.111 1.00 0.00 H new ATOM 29 N THR A 3 4.638 -4.667 0.320 1.00 0.00 N ATOM 30 CA THR A 3 4.944 -5.290 1.602 1.00 0.00 C ATOM 31 C THR A 3 6.330 -5.886 1.556 1.00 0.00 C ATOM 32 O THR A 3 6.547 -6.863 0.868 1.00 0.00 O ATOM 33 CB THR A 3 3.877 -6.327 1.904 1.00 0.00 C ATOM 34 OG1 THR A 3 2.753 -5.515 2.200 1.00 0.00 O ATOM 35 CG2 THR A 3 4.175 -7.179 3.135 1.00 0.00 C ATOM 0 H THR A 3 4.188 -5.291 -0.350 1.00 0.00 H new ATOM 0 HA THR A 3 4.938 -4.554 2.406 1.00 0.00 H new ATOM 0 HB THR A 3 3.771 -7.032 1.079 1.00 0.00 H new ATOM 0 HG1 THR A 3 1.985 -6.085 2.414 1.00 0.00 H new ATOM 0 HG21 THR A 3 3.368 -7.896 3.285 1.00 0.00 H new ATOM 0 HG22 THR A 3 5.113 -7.714 2.989 1.00 0.00 H new ATOM 0 HG23 THR A 3 4.257 -6.536 4.011 1.00 0.00 H new ATOM 43 N TRP A 4 7.269 -5.279 2.269 1.00 0.00 N ATOM 44 CA TRP A 4 8.636 -5.734 2.360 1.00 0.00 C ATOM 45 C TRP A 4 8.741 -6.914 3.300 1.00 0.00 C ATOM 46 O TRP A 4 8.135 -6.925 4.356 1.00 0.00 O ATOM 47 CB TRP A 4 9.515 -4.591 2.822 1.00 0.00 C ATOM 48 CG TRP A 4 9.633 -3.474 1.830 1.00 0.00 C ATOM 49 CD1 TRP A 4 8.645 -2.643 1.448 1.00 0.00 C ATOM 50 CD2 TRP A 4 10.812 -3.060 1.091 1.00 0.00 C ATOM 51 NE1 TRP A 4 9.136 -1.748 0.508 1.00 0.00 N ATOM 52 CE2 TRP A 4 10.465 -1.976 0.243 1.00 0.00 C ATOM 53 CE3 TRP A 4 12.144 -3.489 1.076 1.00 0.00 C ATOM 54 CZ2 TRP A 4 11.385 -1.348 -0.602 1.00 0.00 C ATOM 55 CZ3 TRP A 4 13.086 -2.842 0.262 1.00 0.00 C ATOM 56 CH2 TRP A 4 12.719 -1.772 -0.578 1.00 0.00 C ATOM 0 H TRP A 4 7.089 -4.435 2.812 1.00 0.00 H new ATOM 0 HA TRP A 4 8.974 -6.064 1.378 1.00 0.00 H new ATOM 0 HB2 TRP A 4 9.116 -4.194 3.755 1.00 0.00 H new ATOM 0 HB3 TRP A 4 10.511 -4.977 3.039 1.00 0.00 H new ATOM 0 HD1 TRP A 4 7.630 -2.669 1.815 1.00 0.00 H new ATOM 0 HE1 TRP A 4 8.581 -1.014 0.069 1.00 0.00 H new ATOM 0 HE3 TRP A 4 12.448 -4.321 1.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 11.073 -0.551 -1.261 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 14.114 -3.171 0.280 1.00 0.00 H new ATOM 0 HH2 TRP A 4 13.458 -1.285 -1.196 1.00 0.00 H new ATOM 67 N THR A 5 9.546 -7.898 2.958 1.00 0.00 N ATOM 68 CA THR A 5 9.658 -9.114 3.747 1.00 0.00 C ATOM 69 C THR A 5 11.101 -9.327 4.119 1.00 0.00 C ATOM 70 O THR A 5 11.989 -9.414 3.271 1.00 0.00 O ATOM 71 CB THR A 5 9.045 -10.294 3.001 1.00 0.00 C ATOM 72 OG1 THR A 5 7.654 -10.100 3.129 1.00 0.00 O ATOM 73 CG2 THR A 5 9.398 -11.651 3.623 1.00 0.00 C ATOM 0 H THR A 5 10.140 -7.881 2.129 1.00 0.00 H new ATOM 0 HA THR A 5 9.092 -9.021 4.674 1.00 0.00 H new ATOM 0 HB THR A 5 9.413 -10.322 1.976 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.179 -10.824 2.670 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.931 -12.449 3.045 1.00 0.00 H new ATOM 0 HG22 THR A 5 10.480 -11.784 3.617 1.00 0.00 H new ATOM 0 HG23 THR A 5 9.034 -11.686 4.650 1.00 0.00 H new ATOM 81 N CYS A 6 11.360 -9.364 5.422 1.00 0.00 N ATOM 82 CA CYS A 6 12.704 -9.561 5.914 1.00 0.00 C ATOM 83 C CYS A 6 12.806 -10.989 6.394 1.00 0.00 C ATOM 84 O CYS A 6 12.965 -11.193 7.591 1.00 0.00 O ATOM 85 CB CYS A 6 12.977 -8.562 7.016 1.00 0.00 C ATOM 86 SG CYS A 6 12.859 -6.874 6.407 1.00 0.00 S ATOM 0 H CYS A 6 10.653 -9.260 6.149 1.00 0.00 H new ATOM 0 HA CYS A 6 13.453 -9.398 5.139 1.00 0.00 H new ATOM 0 HB2 CYS A 6 12.265 -8.709 7.828 1.00 0.00 H new ATOM 0 HB3 CYS A 6 13.971 -8.734 7.428 1.00 0.00 H new ATOM 91 N GLY A 7 12.672 -11.948 5.467 1.00 0.00 N ATOM 92 CA GLY A 7 12.761 -13.388 5.728 1.00 0.00 C ATOM 93 C GLY A 7 12.202 -13.782 7.089 1.00 0.00 C ATOM 94 O GLY A 7 12.935 -14.273 7.939 1.00 0.00 O ATOM 0 H GLY A 7 12.493 -11.734 4.486 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.221 -13.927 4.950 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.804 -13.699 5.666 1.00 0.00 H new ATOM 98 N GLY A 8 10.920 -13.500 7.302 1.00 0.00 N ATOM 99 CA GLY A 8 10.267 -13.719 8.579 1.00 0.00 C ATOM 100 C GLY A 8 8.891 -13.082 8.588 1.00 0.00 C ATOM 101 O GLY A 8 7.896 -13.758 8.361 1.00 0.00 O ATOM 0 H GLY A 8 10.306 -13.111 6.587 1.00 0.00 H new ATOM 0 HA2 GLY A 8 10.180 -14.788 8.771 1.00 0.00 H new ATOM 0 HA3 GLY A 8 10.874 -13.299 9.381 1.00 0.00 H new ATOM 105 N LEU A 9 8.843 -11.772 8.826 1.00 0.00 N ATOM 106 CA LEU A 9 7.618 -11.004 8.952 1.00 0.00 C ATOM 107 C LEU A 9 7.541 -10.010 7.799 1.00 0.00 C ATOM 108 O LEU A 9 8.555 -9.659 7.178 1.00 0.00 O ATOM 109 CB LEU A 9 7.515 -10.309 10.326 1.00 0.00 C ATOM 110 CG LEU A 9 8.462 -10.817 11.428 1.00 0.00 C ATOM 111 CD1 LEU A 9 8.410 -12.331 11.657 1.00 0.00 C ATOM 112 CD2 LEU A 9 9.899 -10.346 11.193 1.00 0.00 C ATOM 0 H LEU A 9 9.683 -11.205 8.939 1.00 0.00 H new ATOM 0 HA LEU A 9 6.763 -11.678 8.897 1.00 0.00 H new ATOM 0 HB2 LEU A 9 7.698 -9.244 10.184 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.490 -10.411 10.684 1.00 0.00 H new ATOM 0 HG LEU A 9 8.091 -10.369 12.350 1.00 0.00 H new ATOM 0 HD11 LEU A 9 9.107 -12.603 12.449 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.400 -12.621 11.947 1.00 0.00 H new ATOM 0 HD13 LEU A 9 8.686 -12.848 10.738 1.00 0.00 H new ATOM 0 HD21 LEU A 9 10.540 -10.723 11.990 1.00 0.00 H new ATOM 0 HD22 LEU A 9 10.253 -10.723 10.233 1.00 0.00 H new ATOM 0 HD23 LEU A 9 9.929 -9.256 11.188 1.00 0.00 H new ATOM 124 N LEU A 10 6.325 -9.558 7.529 1.00 0.00 N ATOM 125 CA LEU A 10 6.034 -8.743 6.369 1.00 0.00 C ATOM 126 C LEU A 10 5.702 -7.340 6.849 1.00 0.00 C ATOM 127 O LEU A 10 4.826 -7.146 7.679 1.00 0.00 O ATOM 128 CB LEU A 10 4.917 -9.351 5.505 1.00 0.00 C ATOM 129 CG LEU A 10 4.578 -10.843 5.663 1.00 0.00 C ATOM 130 CD1 LEU A 10 5.831 -11.743 5.640 1.00 0.00 C ATOM 131 CD2 LEU A 10 3.689 -11.048 6.905 1.00 0.00 C ATOM 0 H LEU A 10 5.512 -9.750 8.114 1.00 0.00 H new ATOM 0 HA LEU A 10 6.907 -8.702 5.717 1.00 0.00 H new ATOM 0 HB2 LEU A 10 4.006 -8.785 5.699 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.181 -9.183 4.461 1.00 0.00 H new ATOM 0 HG LEU A 10 4.003 -11.163 4.794 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.533 -12.785 5.755 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.352 -11.618 4.691 1.00 0.00 H new ATOM 0 HD13 LEU A 10 6.495 -11.463 6.458 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.452 -12.107 7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.219 -10.703 7.793 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.766 -10.479 6.790 1.00 0.00 H new ATOM 143 N TYR A 11 6.404 -6.356 6.329 1.00 0.00 N ATOM 144 CA TYR A 11 6.380 -4.974 6.743 1.00 0.00 C ATOM 145 C TYR A 11 5.872 -4.137 5.593 1.00 0.00 C ATOM 146 O TYR A 11 6.548 -3.948 4.580 1.00 0.00 O ATOM 147 CB TYR A 11 7.783 -4.539 7.151 1.00 0.00 C ATOM 148 CG TYR A 11 8.331 -5.396 8.262 1.00 0.00 C ATOM 149 CD1 TYR A 11 7.931 -5.142 9.583 1.00 0.00 C ATOM 150 CD2 TYR A 11 9.227 -6.445 7.975 1.00 0.00 C ATOM 151 CE1 TYR A 11 8.470 -5.893 10.626 1.00 0.00 C ATOM 152 CE2 TYR A 11 9.729 -7.236 9.019 1.00 0.00 C ATOM 153 CZ TYR A 11 9.393 -6.901 10.346 1.00 0.00 C ATOM 154 OH TYR A 11 10.065 -7.412 11.387 1.00 0.00 O ATOM 0 H TYR A 11 7.049 -6.514 5.554 1.00 0.00 H new ATOM 0 HA TYR A 11 5.720 -4.844 7.601 1.00 0.00 H new ATOM 0 HB2 TYR A 11 8.446 -4.594 6.288 1.00 0.00 H new ATOM 0 HB3 TYR A 11 7.762 -3.497 7.471 1.00 0.00 H new ATOM 0 HD1 TYR A 11 7.208 -4.367 9.791 1.00 0.00 H new ATOM 0 HD2 TYR A 11 9.526 -6.639 6.956 1.00 0.00 H new ATOM 0 HE1 TYR A 11 8.175 -5.696 11.646 1.00 0.00 H new ATOM 0 HE2 TYR A 11 10.361 -8.086 8.810 1.00 0.00 H new ATOM 0 HH TYR A 11 9.509 -7.360 12.192 1.00 0.00 H new ATOM 164 N ASN A 12 4.638 -3.661 5.713 1.00 0.00 N ATOM 165 CA ASN A 12 4.100 -2.799 4.682 1.00 0.00 C ATOM 166 C ASN A 12 4.977 -1.558 4.517 1.00 0.00 C ATOM 167 O ASN A 12 5.271 -0.874 5.488 1.00 0.00 O ATOM 168 CB ASN A 12 2.657 -2.438 5.013 1.00 0.00 C ATOM 169 CG ASN A 12 2.033 -1.703 3.856 1.00 0.00 C ATOM 170 OD1 ASN A 12 1.507 -0.619 3.986 1.00 0.00 O ATOM 171 ND2 ASN A 12 2.087 -2.272 2.676 1.00 0.00 N ATOM 0 H ASN A 12 4.010 -3.853 6.493 1.00 0.00 H new ATOM 0 HA ASN A 12 4.102 -3.326 3.728 1.00 0.00 H new ATOM 0 HB2 ASN A 12 2.088 -3.342 5.230 1.00 0.00 H new ATOM 0 HB3 ASN A 12 2.625 -1.818 5.909 1.00 0.00 H new ATOM 0 HD21 ASN A 12 1.686 -1.802 1.864 1.00 0.00 H new ATOM 0 HD22 ASN A 12 2.530 -3.184 2.570 1.00 0.00 H new ATOM 178 N GLN A 13 5.408 -1.250 3.297 1.00 0.00 N ATOM 179 CA GLN A 13 6.213 -0.063 3.077 1.00 0.00 C ATOM 180 C GLN A 13 5.551 1.198 3.592 1.00 0.00 C ATOM 181 O GLN A 13 6.168 1.962 4.311 1.00 0.00 O ATOM 182 CB GLN A 13 6.536 0.143 1.595 1.00 0.00 C ATOM 183 CG GLN A 13 7.509 1.312 1.338 1.00 0.00 C ATOM 184 CD GLN A 13 8.603 1.376 2.395 1.00 0.00 C ATOM 185 OE1 GLN A 13 8.872 2.366 3.042 1.00 0.00 O ATOM 186 NE2 GLN A 13 9.233 0.263 2.677 1.00 0.00 N ATOM 0 H GLN A 13 5.215 -1.800 2.460 1.00 0.00 H new ATOM 0 HA GLN A 13 7.131 -0.238 3.637 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.967 -0.774 1.194 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.609 0.325 1.050 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.961 1.199 0.353 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.956 2.251 1.329 1.00 0.00 H new ATOM 0 HE21 GLN A 13 9.028 -0.586 2.150 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.928 0.245 3.423 1.00 0.00 H new ATOM 195 N ASN A 14 4.258 1.341 3.310 1.00 0.00 N ATOM 196 CA ASN A 14 3.481 2.462 3.820 1.00 0.00 C ATOM 197 C ASN A 14 3.619 2.627 5.335 1.00 0.00 C ATOM 198 O ASN A 14 3.447 3.714 5.845 1.00 0.00 O ATOM 199 CB ASN A 14 2.003 2.223 3.526 1.00 0.00 C ATOM 200 CG ASN A 14 1.311 3.471 3.055 1.00 0.00 C ATOM 201 OD1 ASN A 14 1.155 4.453 3.747 1.00 0.00 O ATOM 202 ND2 ASN A 14 0.817 3.391 1.846 1.00 0.00 N ATOM 0 H ASN A 14 3.728 0.691 2.729 1.00 0.00 H new ATOM 0 HA ASN A 14 3.859 3.359 3.330 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.906 1.447 2.767 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.510 1.853 4.425 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.283 4.170 1.461 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.966 2.550 1.289 1.00 0.00 H new ATOM 209 N LYS A 15 3.916 1.541 6.055 1.00 0.00 N ATOM 210 CA LYS A 15 4.282 1.522 7.458 1.00 0.00 C ATOM 211 C LYS A 15 5.754 1.765 7.698 1.00 0.00 C ATOM 212 O LYS A 15 6.029 2.513 8.603 1.00 0.00 O ATOM 213 CB LYS A 15 3.861 0.206 8.102 1.00 0.00 C ATOM 214 CG LYS A 15 2.522 0.391 8.812 1.00 0.00 C ATOM 215 CD LYS A 15 1.661 -0.879 8.670 1.00 0.00 C ATOM 216 CE LYS A 15 0.500 -0.620 7.705 1.00 0.00 C ATOM 217 NZ LYS A 15 -0.666 -0.050 8.430 1.00 0.00 N ATOM 0 H LYS A 15 3.904 0.607 5.645 1.00 0.00 H new ATOM 0 HA LYS A 15 3.747 2.350 7.922 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.778 -0.572 7.343 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.619 -0.122 8.813 1.00 0.00 H new ATOM 0 HG2 LYS A 15 2.689 0.609 9.867 1.00 0.00 H new ATOM 0 HG3 LYS A 15 1.994 1.246 8.390 1.00 0.00 H new ATOM 0 HD2 LYS A 15 2.272 -1.704 8.303 1.00 0.00 H new ATOM 0 HD3 LYS A 15 1.275 -1.177 9.645 1.00 0.00 H new ATOM 0 HE2 LYS A 15 0.818 0.067 6.921 1.00 0.00 H new ATOM 0 HE3 LYS A 15 0.212 -1.551 7.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -1.443 0.119 7.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -0.980 -0.718 9.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -0.392 0.849 8.876 1.00 0.00 H new ATOM 231 N ALA A 16 6.686 1.210 6.934 1.00 0.00 N ATOM 232 CA ALA A 16 8.118 1.479 7.044 1.00 0.00 C ATOM 233 C ALA A 16 8.459 2.975 6.951 1.00 0.00 C ATOM 234 O ALA A 16 8.973 3.567 7.902 1.00 0.00 O ATOM 235 CB ALA A 16 8.844 0.716 5.940 1.00 0.00 C ATOM 0 H ALA A 16 6.462 0.540 6.198 1.00 0.00 H new ATOM 0 HA ALA A 16 8.442 1.147 8.030 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.915 0.907 6.009 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.658 -0.352 6.053 1.00 0.00 H new ATOM 0 HB3 ALA A 16 8.479 1.047 4.968 1.00 0.00 H new ATOM 241 N GLU A 17 8.170 3.604 5.812 1.00 0.00 N ATOM 242 CA GLU A 17 8.334 5.045 5.653 1.00 0.00 C ATOM 243 C GLU A 17 7.506 5.801 6.690 1.00 0.00 C ATOM 244 O GLU A 17 8.020 6.710 7.341 1.00 0.00 O ATOM 245 CB GLU A 17 7.975 5.527 4.243 1.00 0.00 C ATOM 246 CG GLU A 17 6.688 4.886 3.722 1.00 0.00 C ATOM 247 CD GLU A 17 6.020 5.700 2.630 1.00 0.00 C ATOM 248 OE1 GLU A 17 6.530 5.658 1.491 1.00 0.00 O ATOM 249 OE2 GLU A 17 4.985 6.327 2.948 1.00 0.00 O ATOM 0 H GLU A 17 7.818 3.131 4.980 1.00 0.00 H new ATOM 0 HA GLU A 17 9.392 5.257 5.810 1.00 0.00 H new ATOM 0 HB2 GLU A 17 7.862 6.611 4.250 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.795 5.296 3.563 1.00 0.00 H new ATOM 0 HG2 GLU A 17 6.914 3.891 3.339 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.991 4.758 4.550 1.00 0.00 H new ATOM 256 N SER A 18 6.256 5.385 6.922 1.00 0.00 N ATOM 257 CA SER A 18 5.417 5.980 7.959 1.00 0.00 C ATOM 258 C SER A 18 6.027 5.788 9.346 1.00 0.00 C ATOM 259 O SER A 18 5.778 6.586 10.237 1.00 0.00 O ATOM 260 CB SER A 18 4.001 5.435 7.931 1.00 0.00 C ATOM 261 OG SER A 18 3.142 5.953 8.932 1.00 0.00 O ATOM 0 H SER A 18 5.804 4.634 6.400 1.00 0.00 H new ATOM 0 HA SER A 18 5.368 7.047 7.744 1.00 0.00 H new ATOM 0 HB2 SER A 18 3.565 5.646 6.954 1.00 0.00 H new ATOM 0 HB3 SER A 18 4.043 4.351 8.034 1.00 0.00 H new ATOM 0 HG SER A 18 2.253 5.551 8.840 1.00 0.00 H new ATOM 267 N ASN A 19 6.882 4.797 9.548 1.00 0.00 N ATOM 268 CA ASN A 19 7.492 4.543 10.825 1.00 0.00 C ATOM 269 C ASN A 19 8.499 5.645 11.104 1.00 0.00 C ATOM 270 O ASN A 19 8.316 6.499 11.975 1.00 0.00 O ATOM 271 CB ASN A 19 8.142 3.150 10.847 1.00 0.00 C ATOM 272 CG ASN A 19 8.348 2.654 12.248 1.00 0.00 C ATOM 273 OD1 ASN A 19 9.411 2.228 12.633 1.00 0.00 O ATOM 274 ND2 ASN A 19 7.314 2.664 13.041 1.00 0.00 N ATOM 0 H ASN A 19 7.168 4.146 8.817 1.00 0.00 H new ATOM 0 HA ASN A 19 6.738 4.547 11.612 1.00 0.00 H new ATOM 0 HB2 ASN A 19 7.513 2.447 10.301 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.101 3.188 10.330 1.00 0.00 H new ATOM 0 HD21 ASN A 19 7.399 2.311 13.994 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.420 3.025 12.709 1.00 0.00 H new ATOM 281 N SER A 20 9.523 5.691 10.253 1.00 0.00 N ATOM 282 CA SER A 20 10.570 6.700 10.327 1.00 0.00 C ATOM 283 C SER A 20 10.011 8.102 10.117 1.00 0.00 C ATOM 284 O SER A 20 10.670 9.098 10.398 1.00 0.00 O ATOM 285 CB SER A 20 11.670 6.379 9.324 1.00 0.00 C ATOM 286 OG SER A 20 12.267 7.525 8.767 1.00 0.00 O ATOM 0 H SER A 20 9.647 5.025 9.491 1.00 0.00 H new ATOM 0 HA SER A 20 11.000 6.681 11.328 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.437 5.781 9.816 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.254 5.768 8.522 1.00 0.00 H new ATOM 0 HG SER A 20 13.091 7.271 8.301 1.00 0.00 H new ATOM 292 N HIS A 21 8.791 8.205 9.589 1.00 0.00 N ATOM 293 CA HIS A 21 8.135 9.486 9.374 1.00 0.00 C ATOM 294 C HIS A 21 7.978 10.240 10.681 1.00 0.00 C ATOM 295 O HIS A 21 8.332 11.414 10.738 1.00 0.00 O ATOM 296 CB HIS A 21 6.775 9.302 8.694 1.00 0.00 C ATOM 297 CG HIS A 21 6.772 9.510 7.205 1.00 0.00 C ATOM 298 ND1 HIS A 21 5.655 9.822 6.470 1.00 0.00 N ATOM 299 CD2 HIS A 21 7.819 9.343 6.342 1.00 0.00 C ATOM 300 CE1 HIS A 21 6.018 9.878 5.176 1.00 0.00 C ATOM 301 NE2 HIS A 21 7.330 9.585 5.076 1.00 0.00 N ATOM 0 H HIS A 21 8.234 7.401 9.300 1.00 0.00 H new ATOM 0 HA HIS A 21 8.768 10.076 8.712 1.00 0.00 H new ATOM 0 HB2 HIS A 21 6.414 8.295 8.905 1.00 0.00 H new ATOM 0 HB3 HIS A 21 6.065 9.996 9.143 1.00 0.00 H new ATOM 0 HD2 HIS A 21 8.832 9.074 6.602 1.00 0.00 H new ATOM 0 HE1 HIS A 21 5.364 10.119 4.351 1.00 0.00 H new ATOM 0 HE2 HIS A 21 7.869 9.549 4.211 1.00 0.00 H new ATOM 310 N HIS A 22 7.407 9.585 11.697 1.00 0.00 N ATOM 311 CA HIS A 22 7.231 10.174 13.009 1.00 0.00 C ATOM 312 C HIS A 22 8.545 10.229 13.765 1.00 0.00 C ATOM 313 O HIS A 22 8.815 11.228 14.420 1.00 0.00 O ATOM 314 CB HIS A 22 6.186 9.409 13.825 1.00 0.00 C ATOM 315 CG HIS A 22 5.229 8.557 13.039 1.00 0.00 C ATOM 316 ND1 HIS A 22 5.000 7.241 13.294 1.00 0.00 N ATOM 317 CD2 HIS A 22 4.459 8.905 11.973 1.00 0.00 C ATOM 318 CE1 HIS A 22 4.088 6.774 12.442 1.00 0.00 C ATOM 319 NE2 HIS A 22 3.746 7.778 11.617 1.00 0.00 N ATOM 0 H HIS A 22 7.056 8.630 11.623 1.00 0.00 H new ATOM 0 HA HIS A 22 6.874 11.193 12.861 1.00 0.00 H new ATOM 0 HB2 HIS A 22 6.707 8.771 14.538 1.00 0.00 H new ATOM 0 HB3 HIS A 22 5.608 10.129 14.404 1.00 0.00 H new ATOM 0 HD1 HIS A 22 5.456 6.695 14.025 1.00 0.00 H new ATOM 0 HD2 HIS A 22 4.414 9.874 11.498 1.00 0.00 H new ATOM 0 HE1 HIS A 22 3.694 5.769 12.419 1.00 0.00 H new ATOM 328 N ALA A 23 9.333 9.157 13.656 1.00 0.00 N ATOM 329 CA ALA A 23 10.638 9.069 14.276 1.00 0.00 C ATOM 330 C ALA A 23 11.450 10.364 14.120 1.00 0.00 C ATOM 331 O ALA A 23 11.553 10.898 13.010 1.00 0.00 O ATOM 332 CB ALA A 23 11.394 7.908 13.669 1.00 0.00 C ATOM 0 H ALA A 23 9.072 8.324 13.129 1.00 0.00 H new ATOM 0 HA ALA A 23 10.493 8.913 15.345 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.379 7.834 14.130 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.842 6.984 13.842 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.507 8.068 12.597 1.00 0.00 H new ATOM 338 N PRO A 24 12.035 10.879 15.206 1.00 0.00 N ATOM 339 CA PRO A 24 12.767 12.123 15.165 1.00 0.00 C ATOM 340 C PRO A 24 14.073 11.921 14.407 1.00 0.00 C ATOM 341 O PRO A 24 14.883 11.068 14.767 1.00 0.00 O ATOM 342 CB PRO A 24 12.984 12.535 16.609 1.00 0.00 C ATOM 343 CG PRO A 24 12.776 11.266 17.419 1.00 0.00 C ATOM 344 CD PRO A 24 12.099 10.258 16.516 1.00 0.00 C ATOM 0 HA PRO A 24 12.229 12.911 14.639 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.986 12.938 16.758 1.00 0.00 H new ATOM 0 HB3 PRO A 24 12.281 13.313 16.907 1.00 0.00 H new ATOM 0 HG2 PRO A 24 13.730 10.880 17.778 1.00 0.00 H new ATOM 0 HG3 PRO A 24 12.162 11.467 18.297 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.663 9.326 16.479 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.102 10.014 16.882 1.00 0.00 H new ATOM 352 N LEU A 25 14.275 12.721 13.360 1.00 0.00 N ATOM 353 CA LEU A 25 15.471 12.682 12.537 1.00 0.00 C ATOM 354 C LEU A 25 16.711 13.008 13.362 1.00 0.00 C ATOM 355 O LEU A 25 17.008 14.173 13.637 1.00 0.00 O ATOM 356 CB LEU A 25 15.302 13.612 11.327 1.00 0.00 C ATOM 357 CG LEU A 25 15.947 13.092 10.044 1.00 0.00 C ATOM 358 CD1 LEU A 25 15.673 11.607 9.798 1.00 0.00 C ATOM 359 CD2 LEU A 25 15.444 13.952 8.885 1.00 0.00 C ATOM 0 H LEU A 25 13.598 13.423 13.060 1.00 0.00 H new ATOM 0 HA LEU A 25 15.615 11.671 12.155 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.238 13.768 11.148 1.00 0.00 H new ATOM 0 HB3 LEU A 25 15.731 14.585 11.568 1.00 0.00 H new ATOM 0 HG LEU A 25 17.030 13.171 10.136 1.00 0.00 H new ATOM 0 HD11 LEU A 25 16.157 11.296 8.872 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.068 11.022 10.628 1.00 0.00 H new ATOM 0 HD13 LEU A 25 14.598 11.444 9.718 1.00 0.00 H new ATOM 0 HD21 LEU A 25 15.889 13.603 7.953 1.00 0.00 H new ATOM 0 HD22 LEU A 25 14.359 13.876 8.820 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.725 14.991 9.054 1.00 0.00 H new ATOM 371 N SER A 26 17.395 11.969 13.813 1.00 0.00 N ATOM 372 CA SER A 26 18.544 12.073 14.700 1.00 0.00 C ATOM 373 C SER A 26 19.053 10.678 15.049 1.00 0.00 C ATOM 374 O SER A 26 18.352 9.683 14.873 1.00 0.00 O ATOM 375 CB SER A 26 18.189 12.806 16.003 1.00 0.00 C ATOM 376 OG SER A 26 18.759 14.104 16.081 1.00 0.00 O ATOM 0 H SER A 26 17.162 11.007 13.567 1.00 0.00 H new ATOM 0 HA SER A 26 19.313 12.642 14.177 1.00 0.00 H new ATOM 0 HB2 SER A 26 17.105 12.885 16.085 1.00 0.00 H new ATOM 0 HB3 SER A 26 18.530 12.213 16.852 1.00 0.00 H new ATOM 0 HG SER A 26 18.446 14.645 15.326 1.00 0.00 H new ATOM 382 N ASP A 27 20.264 10.616 15.594 1.00 0.00 N ATOM 383 CA ASP A 27 20.907 9.389 16.056 1.00 0.00 C ATOM 384 C ASP A 27 20.826 9.308 17.563 1.00 0.00 C ATOM 385 O ASP A 27 21.287 10.227 18.228 1.00 0.00 O ATOM 386 CB ASP A 27 22.359 9.336 15.578 1.00 0.00 C ATOM 387 CG ASP A 27 23.443 8.848 16.543 1.00 0.00 C ATOM 388 OD1 ASP A 27 23.662 7.621 16.554 1.00 0.00 O ATOM 389 OD2 ASP A 27 24.206 9.668 17.088 1.00 0.00 O ATOM 0 H ASP A 27 20.844 11.444 15.731 1.00 0.00 H new ATOM 0 HA ASP A 27 20.386 8.529 15.635 1.00 0.00 H new ATOM 0 HB2 ASP A 27 22.392 8.696 14.696 1.00 0.00 H new ATOM 0 HB3 ASP A 27 22.635 10.339 15.254 1.00 0.00 H new ATOM 394 N GLY A 28 20.210 8.248 18.092 1.00 0.00 N ATOM 395 CA GLY A 28 20.177 8.021 19.535 1.00 0.00 C ATOM 396 C GLY A 28 19.755 9.262 20.315 1.00 0.00 C ATOM 397 O GLY A 28 20.533 9.854 21.059 1.00 0.00 O ATOM 0 H GLY A 28 19.729 7.536 17.542 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.487 7.206 19.755 1.00 0.00 H new ATOM 0 HA3 GLY A 28 21.164 7.703 19.872 1.00 0.00 H new ATOM 401 N LYS A 29 18.491 9.650 20.153 1.00 0.00 N ATOM 402 CA LYS A 29 17.918 10.842 20.793 1.00 0.00 C ATOM 403 C LYS A 29 16.450 10.675 21.137 1.00 0.00 C ATOM 404 O LYS A 29 15.687 11.641 21.189 1.00 0.00 O ATOM 405 CB LYS A 29 18.199 12.091 19.943 1.00 0.00 C ATOM 406 CG LYS A 29 19.449 12.824 20.444 1.00 0.00 C ATOM 407 CD LYS A 29 19.471 14.262 19.939 1.00 0.00 C ATOM 408 CE LYS A 29 18.647 15.170 20.863 1.00 0.00 C ATOM 409 NZ LYS A 29 17.581 15.872 20.117 1.00 0.00 N ATOM 0 H LYS A 29 17.826 9.143 19.569 1.00 0.00 H new ATOM 0 HA LYS A 29 18.416 10.979 21.753 1.00 0.00 H new ATOM 0 HB2 LYS A 29 18.335 11.803 18.900 1.00 0.00 H new ATOM 0 HB3 LYS A 29 17.340 12.761 19.980 1.00 0.00 H new ATOM 0 HG2 LYS A 29 19.469 12.816 21.534 1.00 0.00 H new ATOM 0 HG3 LYS A 29 20.343 12.301 20.105 1.00 0.00 H new ATOM 0 HD2 LYS A 29 20.499 14.621 19.890 1.00 0.00 H new ATOM 0 HD3 LYS A 29 19.070 14.304 18.926 1.00 0.00 H new ATOM 0 HE2 LYS A 29 18.203 14.574 21.660 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.303 15.900 21.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 17.042 16.477 20.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.008 16.459 19.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 16.942 15.174 19.685 1.00 0.00 H new ATOM 423 N THR A 30 16.054 9.439 21.382 1.00 0.00 N ATOM 424 CA THR A 30 14.670 9.071 21.634 1.00 0.00 C ATOM 425 C THR A 30 14.622 8.286 22.924 1.00 0.00 C ATOM 426 O THR A 30 15.582 7.585 23.255 1.00 0.00 O ATOM 427 CB THR A 30 14.162 8.233 20.474 1.00 0.00 C ATOM 428 OG1 THR A 30 14.925 7.052 20.460 1.00 0.00 O ATOM 429 CG2 THR A 30 14.336 8.927 19.142 1.00 0.00 C ATOM 0 H THR A 30 16.696 8.647 21.412 1.00 0.00 H new ATOM 0 HA THR A 30 14.038 9.954 21.724 1.00 0.00 H new ATOM 0 HB THR A 30 13.096 8.049 20.610 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.344 6.290 20.256 1.00 0.00 H new ATOM 0 HG21 THR A 30 13.957 8.286 18.346 1.00 0.00 H new ATOM 0 HG22 THR A 30 13.783 9.866 19.146 1.00 0.00 H new ATOM 0 HG23 THR A 30 15.394 9.130 18.973 1.00 0.00 H new ATOM 437 N GLY A 31 13.496 8.367 23.624 1.00 0.00 N ATOM 438 CA GLY A 31 13.284 7.685 24.896 1.00 0.00 C ATOM 439 C GLY A 31 13.850 6.281 24.936 1.00 0.00 C ATOM 440 O GLY A 31 14.666 5.963 25.797 1.00 0.00 O ATOM 0 H GLY A 31 12.693 8.917 23.319 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.738 8.273 25.693 1.00 0.00 H new ATOM 0 HA3 GLY A 31 12.214 7.642 25.101 1.00 0.00 H new ATOM 444 N SER A 32 13.385 5.445 24.015 1.00 0.00 N ATOM 445 CA SER A 32 13.930 4.117 23.842 1.00 0.00 C ATOM 446 C SER A 32 15.364 4.161 23.322 1.00 0.00 C ATOM 447 O SER A 32 16.289 3.805 24.053 1.00 0.00 O ATOM 448 CB SER A 32 13.060 3.319 22.901 1.00 0.00 C ATOM 449 OG SER A 32 13.722 2.112 22.690 1.00 0.00 O ATOM 0 H SER A 32 12.625 5.673 23.374 1.00 0.00 H new ATOM 0 HA SER A 32 13.946 3.633 24.818 1.00 0.00 H new ATOM 0 HB2 SER A 32 12.073 3.151 23.331 1.00 0.00 H new ATOM 0 HB3 SER A 32 12.912 3.851 21.961 1.00 0.00 H new ATOM 0 HG SER A 32 14.194 2.143 21.832 1.00 0.00 H new ATOM 455 N SER A 33 15.535 4.515 22.041 1.00 0.00 N ATOM 456 CA SER A 33 16.836 4.578 21.371 1.00 0.00 C ATOM 457 C SER A 33 16.726 4.962 19.904 1.00 0.00 C ATOM 458 O SER A 33 17.393 5.889 19.457 1.00 0.00 O ATOM 459 CB SER A 33 17.586 3.242 21.448 1.00 0.00 C ATOM 460 OG SER A 33 16.802 2.170 20.953 1.00 0.00 O ATOM 0 H SER A 33 14.757 4.770 21.432 1.00 0.00 H new ATOM 0 HA SER A 33 17.388 5.351 21.906 1.00 0.00 H new ATOM 0 HB2 SER A 33 18.511 3.311 20.875 1.00 0.00 H new ATOM 0 HB3 SER A 33 17.865 3.041 22.482 1.00 0.00 H new ATOM 0 HG SER A 33 16.877 2.133 19.977 1.00 0.00 H new ATOM 466 N TYR A 34 15.939 4.187 19.164 1.00 0.00 N ATOM 467 CA TYR A 34 15.688 4.370 17.756 1.00 0.00 C ATOM 468 C TYR A 34 14.858 5.630 17.444 1.00 0.00 C ATOM 469 O TYR A 34 13.897 5.908 18.146 1.00 0.00 O ATOM 470 CB TYR A 34 14.933 3.155 17.237 1.00 0.00 C ATOM 471 CG TYR A 34 15.622 1.837 17.491 1.00 0.00 C ATOM 472 CD1 TYR A 34 15.355 1.133 18.673 1.00 0.00 C ATOM 473 CD2 TYR A 34 16.491 1.278 16.541 1.00 0.00 C ATOM 474 CE1 TYR A 34 15.973 -0.101 18.928 1.00 0.00 C ATOM 475 CE2 TYR A 34 17.100 0.030 16.781 1.00 0.00 C ATOM 476 CZ TYR A 34 16.838 -0.662 17.975 1.00 0.00 C ATOM 477 OH TYR A 34 17.401 -1.871 18.192 1.00 0.00 O ATOM 0 H TYR A 34 15.443 3.385 19.553 1.00 0.00 H new ATOM 0 HA TYR A 34 16.656 4.491 17.269 1.00 0.00 H new ATOM 0 HB2 TYR A 34 13.947 3.130 17.700 1.00 0.00 H new ATOM 0 HB3 TYR A 34 14.779 3.269 16.164 1.00 0.00 H new ATOM 0 HD1 TYR A 34 14.666 1.545 19.396 1.00 0.00 H new ATOM 0 HD2 TYR A 34 16.694 1.807 15.622 1.00 0.00 H new ATOM 0 HE1 TYR A 34 15.783 -0.619 19.857 1.00 0.00 H new ATOM 0 HE2 TYR A 34 17.768 -0.395 16.047 1.00 0.00 H new ATOM 0 HH TYR A 34 17.971 -2.108 17.431 1.00 0.00 H new ATOM 487 N PRO A 35 15.089 6.282 16.295 1.00 0.00 N ATOM 488 CA PRO A 35 16.053 5.857 15.306 1.00 0.00 C ATOM 489 C PRO A 35 17.471 6.167 15.753 1.00 0.00 C ATOM 490 O PRO A 35 17.715 6.873 16.731 1.00 0.00 O ATOM 491 CB PRO A 35 15.689 6.550 14.006 1.00 0.00 C ATOM 492 CG PRO A 35 14.833 7.736 14.430 1.00 0.00 C ATOM 493 CD PRO A 35 14.420 7.497 15.881 1.00 0.00 C ATOM 0 HA PRO A 35 16.023 4.776 15.168 1.00 0.00 H new ATOM 0 HB2 PRO A 35 16.579 6.876 13.468 1.00 0.00 H new ATOM 0 HB3 PRO A 35 15.141 5.883 13.341 1.00 0.00 H new ATOM 0 HG2 PRO A 35 15.392 8.667 14.337 1.00 0.00 H new ATOM 0 HG3 PRO A 35 13.955 7.826 13.790 1.00 0.00 H new ATOM 0 HD2 PRO A 35 14.711 8.337 16.512 1.00 0.00 H new ATOM 0 HD3 PRO A 35 13.338 7.394 15.966 1.00 0.00 H new ATOM 501 N HIS A 36 18.416 5.555 15.065 1.00 0.00 N ATOM 502 CA HIS A 36 19.822 5.704 15.385 1.00 0.00 C ATOM 503 C HIS A 36 20.624 5.769 14.114 1.00 0.00 C ATOM 504 O HIS A 36 20.065 5.602 13.042 1.00 0.00 O ATOM 505 CB HIS A 36 20.291 4.628 16.375 1.00 0.00 C ATOM 506 CG HIS A 36 20.098 3.190 15.972 1.00 0.00 C ATOM 507 ND1 HIS A 36 21.044 2.198 16.095 1.00 0.00 N ATOM 508 CD2 HIS A 36 19.002 2.648 15.379 1.00 0.00 C ATOM 509 CE1 HIS A 36 20.522 1.064 15.601 1.00 0.00 C ATOM 510 NE2 HIS A 36 19.280 1.326 15.173 1.00 0.00 N ATOM 0 H HIS A 36 18.231 4.942 14.271 1.00 0.00 H new ATOM 0 HA HIS A 36 19.985 6.647 15.907 1.00 0.00 H new ATOM 0 HB2 HIS A 36 21.352 4.785 16.567 1.00 0.00 H new ATOM 0 HB3 HIS A 36 19.769 4.787 17.319 1.00 0.00 H new ATOM 0 HD1 HIS A 36 21.978 2.305 16.492 1.00 0.00 H new ATOM 0 HD2 HIS A 36 18.088 3.162 15.121 1.00 0.00 H new ATOM 0 HE1 HIS A 36 21.018 0.106 15.556 1.00 0.00 H new ATOM 519 N TRP A 37 21.909 6.072 14.228 1.00 0.00 N ATOM 520 CA TRP A 37 22.764 6.059 13.061 1.00 0.00 C ATOM 521 C TRP A 37 23.016 4.621 12.624 1.00 0.00 C ATOM 522 O TRP A 37 23.456 3.760 13.389 1.00 0.00 O ATOM 523 CB TRP A 37 24.050 6.807 13.358 1.00 0.00 C ATOM 524 CG TRP A 37 25.139 6.612 12.351 1.00 0.00 C ATOM 525 CD1 TRP A 37 25.100 6.870 11.026 1.00 0.00 C ATOM 526 CD2 TRP A 37 26.470 6.130 12.618 1.00 0.00 C ATOM 527 NE1 TRP A 37 26.310 6.560 10.444 1.00 0.00 N ATOM 528 CE2 TRP A 37 27.195 6.113 11.397 1.00 0.00 C ATOM 529 CE3 TRP A 37 27.112 5.698 13.788 1.00 0.00 C ATOM 530 CZ2 TRP A 37 28.509 5.674 11.321 1.00 0.00 C ATOM 531 CZ3 TRP A 37 28.436 5.242 13.726 1.00 0.00 C ATOM 532 CH2 TRP A 37 29.110 5.210 12.495 1.00 0.00 C ATOM 0 H TRP A 37 22.371 6.325 15.101 1.00 0.00 H new ATOM 0 HA TRP A 37 22.275 6.571 12.232 1.00 0.00 H new ATOM 0 HB2 TRP A 37 23.826 7.871 13.428 1.00 0.00 H new ATOM 0 HB3 TRP A 37 24.418 6.494 14.335 1.00 0.00 H new ATOM 0 HD1 TRP A 37 24.244 7.263 10.498 1.00 0.00 H new ATOM 0 HE1 TRP A 37 26.519 6.649 9.450 1.00 0.00 H new ATOM 0 HE3 TRP A 37 26.588 5.717 14.732 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 29.050 5.690 10.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 28.937 4.915 14.625 1.00 0.00 H new ATOM 0 HH2 TRP A 37 30.116 4.818 12.454 1.00 0.00 H new ATOM 543 N PHE A 38 22.765 4.388 11.350 1.00 0.00 N ATOM 544 CA PHE A 38 22.973 3.158 10.649 1.00 0.00 C ATOM 545 C PHE A 38 24.289 3.281 9.921 1.00 0.00 C ATOM 546 O PHE A 38 24.342 3.637 8.743 1.00 0.00 O ATOM 547 CB PHE A 38 21.826 2.923 9.670 1.00 0.00 C ATOM 548 CG PHE A 38 21.997 1.695 8.815 1.00 0.00 C ATOM 549 CD1 PHE A 38 22.365 0.466 9.378 1.00 0.00 C ATOM 550 CD2 PHE A 38 21.848 1.794 7.428 1.00 0.00 C ATOM 551 CE1 PHE A 38 22.566 -0.656 8.560 1.00 0.00 C ATOM 552 CE2 PHE A 38 22.025 0.670 6.615 1.00 0.00 C ATOM 553 CZ PHE A 38 22.372 -0.559 7.174 1.00 0.00 C ATOM 0 H PHE A 38 22.383 5.113 10.743 1.00 0.00 H new ATOM 0 HA PHE A 38 23.000 2.309 11.333 1.00 0.00 H new ATOM 0 HB2 PHE A 38 20.895 2.837 10.230 1.00 0.00 H new ATOM 0 HB3 PHE A 38 21.729 3.794 9.022 1.00 0.00 H new ATOM 0 HD1 PHE A 38 22.495 0.382 10.447 1.00 0.00 H new ATOM 0 HD2 PHE A 38 21.595 2.744 6.982 1.00 0.00 H new ATOM 0 HE1 PHE A 38 22.870 -1.595 8.998 1.00 0.00 H new ATOM 0 HE2 PHE A 38 21.892 0.755 5.547 1.00 0.00 H new ATOM 0 HZ PHE A 38 22.490 -1.429 6.545 1.00 0.00 H new ATOM 563 N THR A 39 25.358 2.950 10.645 1.00 0.00 N ATOM 564 CA THR A 39 26.715 2.832 10.101 1.00 0.00 C ATOM 565 C THR A 39 26.701 2.168 8.739 1.00 0.00 C ATOM 566 O THR A 39 27.525 2.496 7.906 1.00 0.00 O ATOM 567 CB THR A 39 27.626 2.029 11.046 1.00 0.00 C ATOM 568 OG1 THR A 39 27.095 0.725 11.092 1.00 0.00 O ATOM 569 CG2 THR A 39 27.551 2.561 12.474 1.00 0.00 C ATOM 0 H THR A 39 25.307 2.752 11.644 1.00 0.00 H new ATOM 0 HA THR A 39 27.109 3.844 10.002 1.00 0.00 H new ATOM 0 HB THR A 39 28.654 2.085 10.688 1.00 0.00 H new ATOM 0 HG1 THR A 39 27.644 0.169 11.683 1.00 0.00 H new ATOM 0 HG21 THR A 39 28.206 1.972 13.116 1.00 0.00 H new ATOM 0 HG22 THR A 39 27.868 3.604 12.491 1.00 0.00 H new ATOM 0 HG23 THR A 39 26.526 2.487 12.836 1.00 0.00 H new ATOM 577 N ASN A 40 25.772 1.228 8.516 1.00 0.00 N ATOM 578 CA ASN A 40 25.642 0.476 7.280 1.00 0.00 C ATOM 579 C ASN A 40 26.818 -0.470 7.095 1.00 0.00 C ATOM 580 O ASN A 40 26.922 -1.158 6.086 1.00 0.00 O ATOM 581 CB ASN A 40 25.435 1.429 6.093 1.00 0.00 C ATOM 582 CG ASN A 40 25.020 0.688 4.834 1.00 0.00 C ATOM 583 OD1 ASN A 40 24.091 -0.099 4.778 1.00 0.00 O ATOM 584 ND2 ASN A 40 25.777 0.834 3.787 1.00 0.00 N ATOM 0 H ASN A 40 25.076 0.970 9.215 1.00 0.00 H new ATOM 0 HA ASN A 40 24.754 -0.153 7.333 1.00 0.00 H new ATOM 0 HB2 ASN A 40 24.673 2.165 6.348 1.00 0.00 H new ATOM 0 HB3 ASN A 40 26.358 1.978 5.903 1.00 0.00 H new ATOM 0 HD21 ASN A 40 25.588 0.296 2.942 1.00 0.00 H new ATOM 0 HD22 ASN A 40 26.560 1.487 3.811 1.00 0.00 H new ATOM 591 N GLY A 41 27.678 -0.549 8.111 1.00 0.00 N ATOM 592 CA GLY A 41 28.933 -1.238 8.075 1.00 0.00 C ATOM 593 C GLY A 41 30.162 -0.384 8.236 1.00 0.00 C ATOM 594 O GLY A 41 31.207 -0.917 8.601 1.00 0.00 O ATOM 0 H GLY A 41 27.495 -0.110 9.013 1.00 0.00 H new ATOM 0 HA2 GLY A 41 28.933 -1.992 8.862 1.00 0.00 H new ATOM 0 HA3 GLY A 41 29.006 -1.769 7.126 1.00 0.00 H new ATOM 598 N TYR A 42 30.058 0.886 7.862 1.00 0.00 N ATOM 599 CA TYR A 42 31.118 1.863 8.010 1.00 0.00 C ATOM 600 C TYR A 42 31.592 1.919 9.473 1.00 0.00 C ATOM 601 O TYR A 42 31.077 1.239 10.358 1.00 0.00 O ATOM 602 CB TYR A 42 30.561 3.225 7.565 1.00 0.00 C ATOM 603 CG TYR A 42 30.383 3.385 6.070 1.00 0.00 C ATOM 604 CD1 TYR A 42 29.289 2.858 5.361 1.00 0.00 C ATOM 605 CD2 TYR A 42 31.360 4.091 5.374 1.00 0.00 C ATOM 606 CE1 TYR A 42 29.168 3.067 3.973 1.00 0.00 C ATOM 607 CE2 TYR A 42 31.257 4.306 3.982 1.00 0.00 C ATOM 608 CZ TYR A 42 30.149 3.801 3.280 1.00 0.00 C ATOM 609 OH TYR A 42 30.005 4.040 1.958 1.00 0.00 O ATOM 0 H TYR A 42 29.213 1.269 7.438 1.00 0.00 H new ATOM 0 HA TYR A 42 31.978 1.591 7.398 1.00 0.00 H new ATOM 0 HB2 TYR A 42 29.597 3.383 8.050 1.00 0.00 H new ATOM 0 HB3 TYR A 42 31.229 4.008 7.922 1.00 0.00 H new ATOM 0 HD1 TYR A 42 28.535 2.288 5.885 1.00 0.00 H new ATOM 0 HD2 TYR A 42 32.213 4.482 5.909 1.00 0.00 H new ATOM 0 HE1 TYR A 42 28.320 2.663 3.439 1.00 0.00 H new ATOM 0 HE2 TYR A 42 32.026 4.856 3.459 1.00 0.00 H new ATOM 0 HH TYR A 42 30.770 4.561 1.635 1.00 0.00 H new ATOM 619 N ASP A 43 32.535 2.807 9.734 1.00 0.00 N ATOM 620 CA ASP A 43 33.117 3.029 11.052 1.00 0.00 C ATOM 621 C ASP A 43 32.565 4.306 11.679 1.00 0.00 C ATOM 622 O ASP A 43 32.275 4.359 12.873 1.00 0.00 O ATOM 623 CB ASP A 43 34.646 3.135 10.949 1.00 0.00 C ATOM 624 CG ASP A 43 35.436 1.932 11.469 1.00 0.00 C ATOM 625 OD1 ASP A 43 34.835 0.859 11.707 1.00 0.00 O ATOM 626 OD2 ASP A 43 36.668 2.103 11.583 1.00 0.00 O ATOM 0 H ASP A 43 32.931 3.413 9.015 1.00 0.00 H new ATOM 0 HA ASP A 43 32.853 2.180 11.683 1.00 0.00 H new ATOM 0 HB2 ASP A 43 34.910 3.294 9.904 1.00 0.00 H new ATOM 0 HB3 ASP A 43 34.967 4.021 11.497 1.00 0.00 H new ATOM 631 N GLY A 44 32.420 5.349 10.857 1.00 0.00 N ATOM 632 CA GLY A 44 31.948 6.657 11.286 1.00 0.00 C ATOM 633 C GLY A 44 31.742 7.612 10.127 1.00 0.00 C ATOM 634 O GLY A 44 30.626 8.070 9.878 1.00 0.00 O ATOM 0 H GLY A 44 32.632 5.302 9.860 1.00 0.00 H new ATOM 0 HA2 GLY A 44 31.009 6.541 11.827 1.00 0.00 H new ATOM 0 HA3 GLY A 44 32.667 7.088 11.983 1.00 0.00 H new ATOM 638 N ASP A 45 32.821 7.905 9.409 1.00 0.00 N ATOM 639 CA ASP A 45 32.777 8.775 8.252 1.00 0.00 C ATOM 640 C ASP A 45 32.332 7.944 7.048 1.00 0.00 C ATOM 641 O ASP A 45 31.159 7.629 6.887 1.00 0.00 O ATOM 642 CB ASP A 45 34.169 9.402 8.041 1.00 0.00 C ATOM 643 CG ASP A 45 34.403 10.743 8.733 1.00 0.00 C ATOM 644 OD1 ASP A 45 33.674 11.064 9.694 1.00 0.00 O ATOM 645 OD2 ASP A 45 35.287 11.464 8.230 1.00 0.00 O ATOM 0 H ASP A 45 33.751 7.542 9.618 1.00 0.00 H new ATOM 0 HA ASP A 45 32.067 9.590 8.391 1.00 0.00 H new ATOM 0 HB2 ASP A 45 34.922 8.696 8.392 1.00 0.00 H new ATOM 0 HB3 ASP A 45 34.330 9.533 6.971 1.00 0.00 H new ATOM 650 N GLY A 46 33.304 7.514 6.248 1.00 0.00 N ATOM 651 CA GLY A 46 33.103 6.817 5.000 1.00 0.00 C ATOM 652 C GLY A 46 34.091 5.673 4.830 1.00 0.00 C ATOM 653 O GLY A 46 34.489 5.344 3.717 1.00 0.00 O ATOM 0 H GLY A 46 34.290 7.652 6.469 1.00 0.00 H new ATOM 0 HA2 GLY A 46 32.085 6.428 4.960 1.00 0.00 H new ATOM 0 HA3 GLY A 46 33.210 7.517 4.171 1.00 0.00 H new ATOM 657 N LYS A 47 34.524 5.082 5.943 1.00 0.00 N ATOM 658 CA LYS A 47 35.491 3.991 5.952 1.00 0.00 C ATOM 659 C LYS A 47 34.916 2.840 6.741 1.00 0.00 C ATOM 660 O LYS A 47 34.118 3.093 7.631 1.00 0.00 O ATOM 661 CB LYS A 47 36.833 4.470 6.515 1.00 0.00 C ATOM 662 CG LYS A 47 37.085 5.952 6.181 1.00 0.00 C ATOM 663 CD LYS A 47 38.566 6.292 6.172 1.00 0.00 C ATOM 664 CE LYS A 47 38.842 7.500 7.064 1.00 0.00 C ATOM 665 NZ LYS A 47 40.217 7.427 7.593 1.00 0.00 N ATOM 0 H LYS A 47 34.208 5.353 6.874 1.00 0.00 H new ATOM 0 HA LYS A 47 35.685 3.648 4.936 1.00 0.00 H new ATOM 0 HB2 LYS A 47 36.846 4.332 7.596 1.00 0.00 H new ATOM 0 HB3 LYS A 47 37.639 3.861 6.106 1.00 0.00 H new ATOM 0 HG2 LYS A 47 36.655 6.182 5.206 1.00 0.00 H new ATOM 0 HG3 LYS A 47 36.574 6.580 6.911 1.00 0.00 H new ATOM 0 HD2 LYS A 47 39.144 5.436 6.520 1.00 0.00 H new ATOM 0 HD3 LYS A 47 38.891 6.503 5.153 1.00 0.00 H new ATOM 0 HE2 LYS A 47 38.710 8.421 6.496 1.00 0.00 H new ATOM 0 HE3 LYS A 47 38.127 7.527 7.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 40.400 8.252 8.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 40.329 6.556 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 40.893 7.422 6.803 1.00 0.00 H new ATOM 679 N LEU A 48 35.276 1.616 6.384 1.00 0.00 N ATOM 680 CA LEU A 48 34.760 0.426 7.039 1.00 0.00 C ATOM 681 C LEU A 48 35.912 -0.301 7.744 1.00 0.00 C ATOM 682 O LEU A 48 37.078 -0.097 7.381 1.00 0.00 O ATOM 683 CB LEU A 48 34.020 -0.469 6.023 1.00 0.00 C ATOM 684 CG LEU A 48 33.144 0.265 4.979 1.00 0.00 C ATOM 685 CD1 LEU A 48 33.555 -0.167 3.573 1.00 0.00 C ATOM 686 CD2 LEU A 48 31.655 0.012 5.180 1.00 0.00 C ATOM 0 H LEU A 48 35.935 1.421 5.631 1.00 0.00 H new ATOM 0 HA LEU A 48 34.028 0.701 7.798 1.00 0.00 H new ATOM 0 HB2 LEU A 48 34.759 -1.067 5.490 1.00 0.00 H new ATOM 0 HB3 LEU A 48 33.386 -1.163 6.575 1.00 0.00 H new ATOM 0 HG LEU A 48 33.309 1.334 5.111 1.00 0.00 H new ATOM 0 HD11 LEU A 48 32.938 0.350 2.838 1.00 0.00 H new ATOM 0 HD12 LEU A 48 34.603 0.083 3.407 1.00 0.00 H new ATOM 0 HD13 LEU A 48 33.418 -1.243 3.468 1.00 0.00 H new ATOM 0 HD21 LEU A 48 31.089 0.551 4.420 1.00 0.00 H new ATOM 0 HD22 LEU A 48 31.453 -1.056 5.094 1.00 0.00 H new ATOM 0 HD23 LEU A 48 31.357 0.360 6.169 1.00 0.00 H new ATOM 698 N PRO A 49 35.606 -1.173 8.715 1.00 0.00 N ATOM 699 CA PRO A 49 36.620 -1.939 9.399 1.00 0.00 C ATOM 700 C PRO A 49 37.233 -2.969 8.449 1.00 0.00 C ATOM 701 O PRO A 49 36.625 -3.377 7.452 1.00 0.00 O ATOM 702 CB PRO A 49 35.919 -2.560 10.601 1.00 0.00 C ATOM 703 CG PRO A 49 34.420 -2.513 10.297 1.00 0.00 C ATOM 704 CD PRO A 49 34.268 -1.559 9.127 1.00 0.00 C ATOM 0 HA PRO A 49 37.460 -1.332 9.737 1.00 0.00 H new ATOM 0 HB2 PRO A 49 36.252 -3.586 10.758 1.00 0.00 H new ATOM 0 HB3 PRO A 49 36.148 -2.008 11.513 1.00 0.00 H new ATOM 0 HG2 PRO A 49 34.040 -3.503 10.046 1.00 0.00 H new ATOM 0 HG3 PRO A 49 33.856 -2.165 11.162 1.00 0.00 H new ATOM 0 HD2 PRO A 49 33.735 -2.038 8.306 1.00 0.00 H new ATOM 0 HD3 PRO A 49 33.686 -0.684 9.417 1.00 0.00 H new ATOM 712 N LYS A 50 38.455 -3.410 8.774 1.00 0.00 N ATOM 713 CA LYS A 50 39.175 -4.450 8.037 1.00 0.00 C ATOM 714 C LYS A 50 38.272 -5.667 7.814 1.00 0.00 C ATOM 715 O LYS A 50 38.056 -6.454 8.727 1.00 0.00 O ATOM 716 CB LYS A 50 40.500 -4.788 8.730 1.00 0.00 C ATOM 717 CG LYS A 50 40.969 -6.226 8.435 1.00 0.00 C ATOM 718 CD LYS A 50 42.461 -6.439 8.632 1.00 0.00 C ATOM 719 CE LYS A 50 42.786 -6.571 10.122 1.00 0.00 C ATOM 720 NZ LYS A 50 43.214 -5.275 10.699 1.00 0.00 N ATOM 0 H LYS A 50 38.978 -3.046 9.571 1.00 0.00 H new ATOM 0 HA LYS A 50 39.440 -4.078 7.047 1.00 0.00 H new ATOM 0 HB2 LYS A 50 41.267 -4.085 8.404 1.00 0.00 H new ATOM 0 HB3 LYS A 50 40.387 -4.660 9.806 1.00 0.00 H new ATOM 0 HG2 LYS A 50 40.425 -6.915 9.081 1.00 0.00 H new ATOM 0 HG3 LYS A 50 40.708 -6.479 7.407 1.00 0.00 H new ATOM 0 HD2 LYS A 50 42.780 -7.336 8.102 1.00 0.00 H new ATOM 0 HD3 LYS A 50 43.014 -5.603 8.205 1.00 0.00 H new ATOM 0 HE2 LYS A 50 41.909 -6.937 10.656 1.00 0.00 H new ATOM 0 HE3 LYS A 50 43.575 -7.311 10.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 43.427 -5.398 11.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 44.065 -4.939 10.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 42.451 -4.577 10.589 1.00 0.00 H new ATOM 734 N GLY A 51 37.784 -5.813 6.588 1.00 0.00 N ATOM 735 CA GLY A 51 36.824 -6.850 6.241 1.00 0.00 C ATOM 736 C GLY A 51 35.404 -6.463 6.635 1.00 0.00 C ATOM 737 O GLY A 51 34.931 -6.810 7.713 1.00 0.00 O ATOM 0 H GLY A 51 38.045 -5.213 5.805 1.00 0.00 H new ATOM 0 HA2 GLY A 51 36.865 -7.038 5.168 1.00 0.00 H new ATOM 0 HA3 GLY A 51 37.098 -7.780 6.739 1.00 0.00 H new ATOM 741 N ARG A 52 34.704 -5.771 5.737 1.00 0.00 N ATOM 742 CA ARG A 52 33.297 -5.424 5.916 1.00 0.00 C ATOM 743 C ARG A 52 32.602 -5.311 4.574 1.00 0.00 C ATOM 744 O ARG A 52 33.240 -4.987 3.579 1.00 0.00 O ATOM 745 CB ARG A 52 33.200 -4.101 6.687 1.00 0.00 C ATOM 746 CG ARG A 52 32.111 -4.197 7.760 1.00 0.00 C ATOM 747 CD ARG A 52 30.791 -3.689 7.214 1.00 0.00 C ATOM 748 NE ARG A 52 29.666 -4.176 8.040 1.00 0.00 N ATOM 749 CZ ARG A 52 28.399 -4.239 7.667 1.00 0.00 C ATOM 750 NH1 ARG A 52 28.021 -3.817 6.510 1.00 0.00 N ATOM 751 NH2 ARG A 52 27.466 -4.659 8.462 1.00 0.00 N ATOM 0 H ARG A 52 35.101 -5.434 4.860 1.00 0.00 H new ATOM 0 HA ARG A 52 32.800 -6.210 6.485 1.00 0.00 H new ATOM 0 HB2 ARG A 52 34.159 -3.870 7.151 1.00 0.00 H new ATOM 0 HB3 ARG A 52 32.974 -3.286 6.000 1.00 0.00 H new ATOM 0 HG2 ARG A 52 32.003 -5.231 8.088 1.00 0.00 H new ATOM 0 HG3 ARG A 52 32.400 -3.614 8.635 1.00 0.00 H new ATOM 0 HD2 ARG A 52 30.793 -2.599 7.198 1.00 0.00 H new ATOM 0 HD3 ARG A 52 30.664 -4.023 6.184 1.00 0.00 H new ATOM 0 HE ARG A 52 29.887 -4.492 8.984 1.00 0.00 H new ATOM 0 HH11 ARG A 52 28.704 -3.425 5.862 1.00 0.00 H new ATOM 0 HH12 ARG A 52 27.039 -3.875 6.242 1.00 0.00 H new ATOM 0 HH21 ARG A 52 27.699 -4.955 9.410 1.00 0.00 H new ATOM 0 HH22 ARG A 52 26.499 -4.694 8.140 1.00 0.00 H new ATOM 765 N THR A 53 31.287 -5.503 4.584 1.00 0.00 N ATOM 766 CA THR A 53 30.466 -5.407 3.382 1.00 0.00 C ATOM 767 C THR A 53 29.145 -4.688 3.663 1.00 0.00 C ATOM 768 O THR A 53 28.245 -5.284 4.261 1.00 0.00 O ATOM 769 CB THR A 53 30.276 -6.798 2.794 1.00 0.00 C ATOM 770 OG1 THR A 53 31.507 -7.093 2.165 1.00 0.00 O ATOM 771 CG2 THR A 53 29.168 -6.882 1.743 1.00 0.00 C ATOM 0 H THR A 53 30.760 -5.730 5.427 1.00 0.00 H new ATOM 0 HA THR A 53 30.976 -4.796 2.637 1.00 0.00 H new ATOM 0 HB THR A 53 29.988 -7.489 3.586 1.00 0.00 H new ATOM 0 HG1 THR A 53 31.462 -7.984 1.760 1.00 0.00 H new ATOM 0 HG21 THR A 53 29.095 -7.904 1.372 1.00 0.00 H new ATOM 0 HG22 THR A 53 28.218 -6.590 2.191 1.00 0.00 H new ATOM 0 HG23 THR A 53 29.400 -6.212 0.915 1.00 0.00 H new ATOM 779 N PRO A 54 29.029 -3.395 3.292 1.00 0.00 N ATOM 780 CA PRO A 54 27.819 -2.615 3.452 1.00 0.00 C ATOM 781 C PRO A 54 26.691 -3.125 2.573 1.00 0.00 C ATOM 782 O PRO A 54 26.913 -3.748 1.533 1.00 0.00 O ATOM 783 CB PRO A 54 28.205 -1.173 3.160 1.00 0.00 C ATOM 784 CG PRO A 54 29.480 -1.233 2.332 1.00 0.00 C ATOM 785 CD PRO A 54 30.008 -2.650 2.509 1.00 0.00 C ATOM 0 HA PRO A 54 27.422 -2.699 4.463 1.00 0.00 H new ATOM 0 HB2 PRO A 54 27.412 -0.660 2.616 1.00 0.00 H new ATOM 0 HB3 PRO A 54 28.367 -0.619 4.084 1.00 0.00 H new ATOM 0 HG2 PRO A 54 29.278 -1.017 1.283 1.00 0.00 H new ATOM 0 HG3 PRO A 54 30.207 -0.497 2.675 1.00 0.00 H new ATOM 0 HD2 PRO A 54 30.163 -3.124 1.540 1.00 0.00 H new ATOM 0 HD3 PRO A 54 30.973 -2.638 3.016 1.00 0.00 H new ATOM 793 N ILE A 55 25.466 -2.865 3.020 1.00 0.00 N ATOM 794 CA ILE A 55 24.290 -3.278 2.281 1.00 0.00 C ATOM 795 C ILE A 55 24.273 -2.470 0.987 1.00 0.00 C ATOM 796 O ILE A 55 24.422 -1.253 1.015 1.00 0.00 O ATOM 797 CB ILE A 55 23.025 -3.103 3.130 1.00 0.00 C ATOM 798 CG1 ILE A 55 23.245 -3.687 4.540 1.00 0.00 C ATOM 799 CG2 ILE A 55 21.850 -3.793 2.435 1.00 0.00 C ATOM 800 CD1 ILE A 55 21.960 -3.877 5.332 1.00 0.00 C ATOM 0 H ILE A 55 25.268 -2.371 3.890 1.00 0.00 H new ATOM 0 HA ILE A 55 24.318 -4.339 2.035 1.00 0.00 H new ATOM 0 HB ILE A 55 22.801 -2.042 3.235 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.751 -4.648 4.450 1.00 0.00 H new ATOM 0 HG13 ILE A 55 23.910 -3.027 5.097 1.00 0.00 H new ATOM 0 HG21 ILE A 55 20.949 -3.671 3.036 1.00 0.00 H new ATOM 0 HG22 ILE A 55 21.695 -3.346 1.453 1.00 0.00 H new ATOM 0 HG23 ILE A 55 22.068 -4.855 2.320 1.00 0.00 H new ATOM 0 HD11 ILE A 55 22.195 -4.291 6.313 1.00 0.00 H new ATOM 0 HD12 ILE A 55 21.462 -2.915 5.454 1.00 0.00 H new ATOM 0 HD13 ILE A 55 21.301 -4.561 4.798 1.00 0.00 H new ATOM 812 N LYS A 56 24.163 -3.158 -0.147 1.00 0.00 N ATOM 813 CA LYS A 56 24.050 -2.503 -1.440 1.00 0.00 C ATOM 814 C LYS A 56 22.582 -2.389 -1.808 1.00 0.00 C ATOM 815 O LYS A 56 21.834 -3.367 -1.756 1.00 0.00 O ATOM 816 CB LYS A 56 24.885 -3.261 -2.470 1.00 0.00 C ATOM 817 CG LYS A 56 24.576 -2.838 -3.915 1.00 0.00 C ATOM 818 CD LYS A 56 23.375 -3.616 -4.479 1.00 0.00 C ATOM 819 CE LYS A 56 23.429 -3.702 -5.995 1.00 0.00 C ATOM 820 NZ LYS A 56 22.980 -5.039 -6.442 1.00 0.00 N ATOM 0 H LYS A 56 24.150 -4.177 -0.192 1.00 0.00 H new ATOM 0 HA LYS A 56 24.449 -1.489 -1.408 1.00 0.00 H new ATOM 0 HB2 LYS A 56 25.943 -3.095 -2.266 1.00 0.00 H new ATOM 0 HB3 LYS A 56 24.703 -4.330 -2.363 1.00 0.00 H new ATOM 0 HG2 LYS A 56 24.367 -1.769 -3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 56 25.451 -3.010 -4.542 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.361 -4.621 -4.057 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.449 -3.129 -4.174 1.00 0.00 H new ATOM 0 HE2 LYS A 56 22.796 -2.931 -6.434 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.445 -3.516 -6.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 23.020 -5.090 -7.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 23.601 -5.768 -6.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 22.003 -5.201 -6.125 1.00 0.00 H new ATOM 834 N PHE A 57 22.206 -1.209 -2.275 1.00 0.00 N ATOM 835 CA PHE A 57 20.845 -0.883 -2.675 1.00 0.00 C ATOM 836 C PHE A 57 20.798 -0.488 -4.145 1.00 0.00 C ATOM 837 O PHE A 57 20.072 -1.083 -4.936 1.00 0.00 O ATOM 838 CB PHE A 57 20.338 0.242 -1.773 1.00 0.00 C ATOM 839 CG PHE A 57 20.779 0.151 -0.331 1.00 0.00 C ATOM 840 CD1 PHE A 57 22.039 0.636 0.060 1.00 0.00 C ATOM 841 CD2 PHE A 57 19.907 -0.362 0.632 1.00 0.00 C ATOM 842 CE1 PHE A 57 22.407 0.619 1.413 1.00 0.00 C ATOM 843 CE2 PHE A 57 20.285 -0.392 1.988 1.00 0.00 C ATOM 844 CZ PHE A 57 21.546 0.076 2.371 1.00 0.00 C ATOM 0 H PHE A 57 22.855 -0.431 -2.390 1.00 0.00 H new ATOM 0 HA PHE A 57 20.199 -1.754 -2.562 1.00 0.00 H new ATOM 0 HB2 PHE A 57 20.675 1.195 -2.181 1.00 0.00 H new ATOM 0 HB3 PHE A 57 19.248 0.250 -1.804 1.00 0.00 H new ATOM 0 HD1 PHE A 57 22.723 1.022 -0.681 1.00 0.00 H new ATOM 0 HD2 PHE A 57 18.939 -0.737 0.335 1.00 0.00 H new ATOM 0 HE1 PHE A 57 23.360 1.027 1.716 1.00 0.00 H new ATOM 0 HE2 PHE A 57 19.602 -0.776 2.731 1.00 0.00 H new ATOM 0 HZ PHE A 57 21.854 0.018 3.405 1.00 0.00 H new ATOM 854 N GLY A 58 21.609 0.509 -4.500 1.00 0.00 N ATOM 855 CA GLY A 58 21.668 1.103 -5.832 1.00 0.00 C ATOM 856 C GLY A 58 21.354 2.594 -5.846 1.00 0.00 C ATOM 857 O GLY A 58 21.369 3.223 -6.899 1.00 0.00 O ATOM 0 H GLY A 58 22.263 0.938 -3.846 1.00 0.00 H new ATOM 0 HA2 GLY A 58 22.663 0.945 -6.248 1.00 0.00 H new ATOM 0 HA3 GLY A 58 20.964 0.585 -6.484 1.00 0.00 H new ATOM 861 N LYS A 59 21.011 3.161 -4.686 1.00 0.00 N ATOM 862 CA LYS A 59 20.823 4.604 -4.544 1.00 0.00 C ATOM 863 C LYS A 59 22.130 5.353 -4.731 1.00 0.00 C ATOM 864 O LYS A 59 23.161 4.753 -4.962 1.00 0.00 O ATOM 865 CB LYS A 59 20.130 4.877 -3.205 1.00 0.00 C ATOM 866 CG LYS A 59 18.651 5.187 -3.436 1.00 0.00 C ATOM 867 CD LYS A 59 18.451 6.683 -3.713 1.00 0.00 C ATOM 868 CE LYS A 59 17.735 6.959 -5.027 1.00 0.00 C ATOM 869 NZ LYS A 59 16.298 6.602 -4.919 1.00 0.00 N ATOM 0 H LYS A 59 20.857 2.635 -3.826 1.00 0.00 H new ATOM 0 HA LYS A 59 20.174 4.985 -5.333 1.00 0.00 H new ATOM 0 HB2 LYS A 59 20.231 4.011 -2.551 1.00 0.00 H new ATOM 0 HB3 LYS A 59 20.611 5.715 -2.701 1.00 0.00 H new ATOM 0 HG2 LYS A 59 18.278 4.603 -4.277 1.00 0.00 H new ATOM 0 HG3 LYS A 59 18.071 4.893 -2.561 1.00 0.00 H new ATOM 0 HD2 LYS A 59 17.880 7.124 -2.896 1.00 0.00 H new ATOM 0 HD3 LYS A 59 19.423 7.177 -3.726 1.00 0.00 H new ATOM 0 HE2 LYS A 59 17.836 8.012 -5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 59 18.199 6.385 -5.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 15.823 6.796 -5.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 16.208 5.591 -4.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 15.855 7.168 -4.167 1.00 0.00 H new ATOM 883 N SER A 60 22.052 6.675 -4.668 1.00 0.00 N ATOM 884 CA SER A 60 23.227 7.528 -4.771 1.00 0.00 C ATOM 885 C SER A 60 23.626 8.073 -3.418 1.00 0.00 C ATOM 886 O SER A 60 24.783 8.009 -3.049 1.00 0.00 O ATOM 887 CB SER A 60 22.958 8.692 -5.717 1.00 0.00 C ATOM 888 OG SER A 60 21.706 9.284 -5.370 1.00 0.00 O ATOM 0 H SER A 60 21.177 7.184 -4.545 1.00 0.00 H new ATOM 0 HA SER A 60 24.042 6.919 -5.161 1.00 0.00 H new ATOM 0 HB2 SER A 60 23.757 9.430 -5.646 1.00 0.00 H new ATOM 0 HB3 SER A 60 22.938 8.343 -6.749 1.00 0.00 H new ATOM 0 HG SER A 60 21.522 10.036 -5.971 1.00 0.00 H new ATOM 894 N ASP A 61 22.657 8.589 -2.661 1.00 0.00 N ATOM 895 CA ASP A 61 22.886 9.103 -1.314 1.00 0.00 C ATOM 896 C ASP A 61 23.010 7.967 -0.315 1.00 0.00 C ATOM 897 O ASP A 61 23.842 8.024 0.582 1.00 0.00 O ATOM 898 CB ASP A 61 21.726 10.003 -0.879 1.00 0.00 C ATOM 899 CG ASP A 61 21.899 11.442 -1.349 1.00 0.00 C ATOM 900 OD1 ASP A 61 22.187 11.643 -2.550 1.00 0.00 O ATOM 901 OD2 ASP A 61 21.885 12.341 -0.484 1.00 0.00 O ATOM 0 H ASP A 61 21.687 8.662 -2.968 1.00 0.00 H new ATOM 0 HA ASP A 61 23.814 9.674 -1.336 1.00 0.00 H new ATOM 0 HB2 ASP A 61 20.792 9.604 -1.275 1.00 0.00 H new ATOM 0 HB3 ASP A 61 21.644 9.986 0.208 1.00 0.00 H new ATOM 906 N CYS A 62 22.160 6.947 -0.465 1.00 0.00 N ATOM 907 CA CYS A 62 22.177 5.766 0.402 1.00 0.00 C ATOM 908 C CYS A 62 23.368 4.866 0.068 1.00 0.00 C ATOM 909 O CYS A 62 23.772 4.045 0.882 1.00 0.00 O ATOM 910 CB CYS A 62 20.823 5.056 0.287 1.00 0.00 C ATOM 911 SG CYS A 62 20.760 3.338 0.761 1.00 0.00 S ATOM 0 H CYS A 62 21.442 6.917 -1.189 1.00 0.00 H new ATOM 0 HA CYS A 62 22.314 6.055 1.444 1.00 0.00 H new ATOM 0 HB2 CYS A 62 20.103 5.601 0.897 1.00 0.00 H new ATOM 0 HB3 CYS A 62 20.488 5.133 -0.747 1.00 0.00 H new ATOM 916 N ASP A 63 23.958 5.061 -1.110 1.00 0.00 N ATOM 917 CA ASP A 63 25.210 4.410 -1.494 1.00 0.00 C ATOM 918 C ASP A 63 26.433 5.202 -1.051 1.00 0.00 C ATOM 919 O ASP A 63 27.432 4.625 -0.624 1.00 0.00 O ATOM 920 CB ASP A 63 25.221 4.283 -3.008 1.00 0.00 C ATOM 921 CG ASP A 63 26.551 3.831 -3.602 1.00 0.00 C ATOM 922 OD1 ASP A 63 26.922 2.665 -3.341 1.00 0.00 O ATOM 923 OD2 ASP A 63 27.147 4.654 -4.332 1.00 0.00 O ATOM 0 H ASP A 63 23.579 5.678 -1.829 1.00 0.00 H new ATOM 0 HA ASP A 63 25.261 3.437 -1.005 1.00 0.00 H new ATOM 0 HB2 ASP A 63 24.447 3.575 -3.305 1.00 0.00 H new ATOM 0 HB3 ASP A 63 24.954 5.247 -3.441 1.00 0.00 H new ATOM 928 N ARG A 64 26.359 6.537 -1.138 1.00 0.00 N ATOM 929 CA ARG A 64 27.472 7.391 -0.781 1.00 0.00 C ATOM 930 C ARG A 64 27.946 7.126 0.653 1.00 0.00 C ATOM 931 O ARG A 64 27.198 6.646 1.505 1.00 0.00 O ATOM 932 CB ARG A 64 27.092 8.860 -0.983 1.00 0.00 C ATOM 933 CG ARG A 64 26.876 9.649 0.318 1.00 0.00 C ATOM 934 CD ARG A 64 26.186 10.979 0.126 1.00 0.00 C ATOM 935 NE ARG A 64 26.365 11.525 -1.219 1.00 0.00 N ATOM 936 CZ ARG A 64 25.522 12.330 -1.819 1.00 0.00 C ATOM 937 NH1 ARG A 64 24.497 12.816 -1.194 1.00 0.00 N ATOM 938 NH2 ARG A 64 25.714 12.636 -3.066 1.00 0.00 N ATOM 0 H ARG A 64 25.530 7.040 -1.456 1.00 0.00 H new ATOM 0 HA ARG A 64 28.309 7.158 -1.439 1.00 0.00 H new ATOM 0 HB2 ARG A 64 27.875 9.348 -1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 64 26.179 8.907 -1.577 1.00 0.00 H new ATOM 0 HG2 ARG A 64 26.286 9.042 1.005 1.00 0.00 H new ATOM 0 HG3 ARG A 64 27.843 9.819 0.792 1.00 0.00 H new ATOM 0 HD2 ARG A 64 25.121 10.862 0.326 1.00 0.00 H new ATOM 0 HD3 ARG A 64 26.571 11.691 0.856 1.00 0.00 H new ATOM 0 HE ARG A 64 27.208 11.260 -1.728 1.00 0.00 H new ATOM 0 HH11 ARG A 64 24.334 12.574 -0.217 1.00 0.00 H new ATOM 0 HH12 ARG A 64 23.853 13.441 -1.679 1.00 0.00 H new ATOM 0 HH21 ARG A 64 26.514 12.251 -3.568 1.00 0.00 H new ATOM 0 HH22 ARG A 64 25.065 13.261 -3.543 1.00 0.00 H new ATOM 952 N PRO A 65 29.152 7.595 0.989 1.00 0.00 N ATOM 953 CA PRO A 65 29.632 7.469 2.340 1.00 0.00 C ATOM 954 C PRO A 65 28.877 8.387 3.313 1.00 0.00 C ATOM 955 O PRO A 65 28.613 9.549 2.981 1.00 0.00 O ATOM 956 CB PRO A 65 31.109 7.772 2.252 1.00 0.00 C ATOM 957 CG PRO A 65 31.331 8.515 0.929 1.00 0.00 C ATOM 958 CD PRO A 65 30.064 8.322 0.122 1.00 0.00 C ATOM 0 HA PRO A 65 29.460 6.473 2.749 1.00 0.00 H new ATOM 0 HB2 PRO A 65 31.429 8.382 3.096 1.00 0.00 H new ATOM 0 HB3 PRO A 65 31.695 6.853 2.282 1.00 0.00 H new ATOM 0 HG2 PRO A 65 31.524 9.573 1.104 1.00 0.00 H new ATOM 0 HG3 PRO A 65 32.196 8.116 0.398 1.00 0.00 H new ATOM 0 HD2 PRO A 65 29.640 9.281 -0.176 1.00 0.00 H new ATOM 0 HD3 PRO A 65 30.264 7.764 -0.793 1.00 0.00 H new ATOM 966 N PRO A 66 28.538 7.913 4.521 1.00 0.00 N ATOM 967 CA PRO A 66 27.905 8.727 5.537 1.00 0.00 C ATOM 968 C PRO A 66 28.851 9.805 6.080 1.00 0.00 C ATOM 969 O PRO A 66 30.010 9.940 5.687 1.00 0.00 O ATOM 970 CB PRO A 66 27.409 7.727 6.581 1.00 0.00 C ATOM 971 CG PRO A 66 28.185 6.427 6.366 1.00 0.00 C ATOM 972 CD PRO A 66 28.843 6.579 5.009 1.00 0.00 C ATOM 0 HA PRO A 66 27.071 9.314 5.154 1.00 0.00 H new ATOM 0 HB2 PRO A 66 27.572 8.110 7.588 1.00 0.00 H new ATOM 0 HB3 PRO A 66 26.338 7.558 6.473 1.00 0.00 H new ATOM 0 HG2 PRO A 66 28.928 6.277 7.150 1.00 0.00 H new ATOM 0 HG3 PRO A 66 27.521 5.563 6.387 1.00 0.00 H new ATOM 0 HD2 PRO A 66 29.921 6.437 5.088 1.00 0.00 H new ATOM 0 HD3 PRO A 66 28.472 5.824 4.316 1.00 0.00 H new ATOM 980 N LYS A 67 28.322 10.661 6.948 1.00 0.00 N ATOM 981 CA LYS A 67 29.138 11.652 7.633 1.00 0.00 C ATOM 982 C LYS A 67 28.721 11.701 9.092 1.00 0.00 C ATOM 983 O LYS A 67 28.317 12.742 9.556 1.00 0.00 O ATOM 984 CB LYS A 67 29.031 12.985 6.875 1.00 0.00 C ATOM 985 CG LYS A 67 29.771 14.141 7.580 1.00 0.00 C ATOM 986 CD LYS A 67 30.993 14.583 6.800 1.00 0.00 C ATOM 987 CE LYS A 67 31.824 15.519 7.681 1.00 0.00 C ATOM 988 NZ LYS A 67 32.631 16.431 6.845 1.00 0.00 N ATOM 0 H LYS A 67 27.332 10.687 7.192 1.00 0.00 H new ATOM 0 HA LYS A 67 30.198 11.396 7.636 1.00 0.00 H new ATOM 0 HB2 LYS A 67 29.437 12.859 5.871 1.00 0.00 H new ATOM 0 HB3 LYS A 67 27.980 13.249 6.762 1.00 0.00 H new ATOM 0 HG2 LYS A 67 29.093 14.985 7.703 1.00 0.00 H new ATOM 0 HG3 LYS A 67 30.072 13.825 8.579 1.00 0.00 H new ATOM 0 HD2 LYS A 67 31.586 13.718 6.504 1.00 0.00 H new ATOM 0 HD3 LYS A 67 30.693 15.093 5.884 1.00 0.00 H new ATOM 0 HE2 LYS A 67 31.166 16.097 8.330 1.00 0.00 H new ATOM 0 HE3 LYS A 67 32.478 14.934 8.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 33.189 17.060 7.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 33.272 15.875 6.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 32.001 17.001 6.245 1.00 0.00 H new ATOM 1002 N HIS A 68 28.758 10.577 9.801 1.00 0.00 N ATOM 1003 CA HIS A 68 28.408 10.618 11.221 1.00 0.00 C ATOM 1004 C HIS A 68 29.566 11.184 12.041 1.00 0.00 C ATOM 1005 O HIS A 68 30.701 11.238 11.583 1.00 0.00 O ATOM 1006 CB HIS A 68 27.994 9.219 11.656 1.00 0.00 C ATOM 1007 CG HIS A 68 27.633 9.066 13.111 1.00 0.00 C ATOM 1008 ND1 HIS A 68 28.519 8.697 14.090 1.00 0.00 N ATOM 1009 CD2 HIS A 68 26.414 9.264 13.697 1.00 0.00 C ATOM 1010 CE1 HIS A 68 27.841 8.660 15.252 1.00 0.00 C ATOM 1011 NE2 HIS A 68 26.553 8.994 15.042 1.00 0.00 N ATOM 0 H HIS A 68 29.016 9.660 9.437 1.00 0.00 H new ATOM 0 HA HIS A 68 27.565 11.288 11.393 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.139 8.910 11.054 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.809 8.532 11.429 1.00 0.00 H new ATOM 0 HD1 HIS A 68 29.509 8.489 13.961 1.00 0.00 H new ATOM 0 HD2 HIS A 68 25.508 9.575 13.198 1.00 0.00 H new ATOM 0 HE1 HIS A 68 28.266 8.401 16.210 1.00 0.00 H new ATOM 1020 N SER A 69 29.288 11.563 13.283 1.00 0.00 N ATOM 1021 CA SER A 69 30.279 12.088 14.214 1.00 0.00 C ATOM 1022 C SER A 69 29.847 11.874 15.658 1.00 0.00 C ATOM 1023 O SER A 69 28.947 11.084 15.940 1.00 0.00 O ATOM 1024 CB SER A 69 30.541 13.564 13.909 1.00 0.00 C ATOM 1025 OG SER A 69 31.924 13.710 13.664 1.00 0.00 O ATOM 0 H SER A 69 28.349 11.513 13.678 1.00 0.00 H new ATOM 0 HA SER A 69 31.213 11.541 14.084 1.00 0.00 H new ATOM 0 HB2 SER A 69 29.963 13.885 13.042 1.00 0.00 H new ATOM 0 HB3 SER A 69 30.232 14.189 14.747 1.00 0.00 H new ATOM 0 HG SER A 69 32.123 14.648 13.463 1.00 0.00 H new ATOM 1031 N LYS A 70 30.493 12.548 16.600 1.00 0.00 N ATOM 1032 CA LYS A 70 30.113 12.501 18.008 1.00 0.00 C ATOM 1033 C LYS A 70 28.996 13.495 18.310 1.00 0.00 C ATOM 1034 O LYS A 70 29.244 14.514 18.932 1.00 0.00 O ATOM 1035 CB LYS A 70 31.375 12.693 18.859 1.00 0.00 C ATOM 1036 CG LYS A 70 31.628 11.456 19.718 1.00 0.00 C ATOM 1037 CD LYS A 70 31.005 11.654 21.101 1.00 0.00 C ATOM 1038 CE LYS A 70 31.181 10.384 21.934 1.00 0.00 C ATOM 1039 NZ LYS A 70 31.581 10.705 23.325 1.00 0.00 N ATOM 0 H LYS A 70 31.298 13.145 16.410 1.00 0.00 H new ATOM 0 HA LYS A 70 29.691 11.529 18.263 1.00 0.00 H new ATOM 0 HB2 LYS A 70 32.233 12.877 18.213 1.00 0.00 H new ATOM 0 HB3 LYS A 70 31.262 13.570 19.496 1.00 0.00 H new ATOM 0 HG2 LYS A 70 31.201 10.575 19.239 1.00 0.00 H new ATOM 0 HG3 LYS A 70 32.699 11.280 19.813 1.00 0.00 H new ATOM 0 HD2 LYS A 70 31.476 12.498 21.605 1.00 0.00 H new ATOM 0 HD3 LYS A 70 29.946 11.892 21.002 1.00 0.00 H new ATOM 0 HE2 LYS A 70 30.249 9.820 21.942 1.00 0.00 H new ATOM 0 HE3 LYS A 70 31.936 9.746 21.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 31.693 9.824 23.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 32.483 11.223 23.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 30.848 11.294 23.770 1.00 0.00 H new ATOM 1053 N ASP A 71 27.790 13.162 17.865 1.00 0.00 N ATOM 1054 CA ASP A 71 26.594 13.985 18.090 1.00 0.00 C ATOM 1055 C ASP A 71 25.347 13.315 17.532 1.00 0.00 C ATOM 1056 O ASP A 71 24.288 13.302 18.151 1.00 0.00 O ATOM 1057 CB ASP A 71 26.751 15.363 17.409 1.00 0.00 C ATOM 1058 CG ASP A 71 26.849 16.550 18.374 1.00 0.00 C ATOM 1059 OD1 ASP A 71 26.813 16.336 19.608 1.00 0.00 O ATOM 1060 OD2 ASP A 71 26.942 17.674 17.838 1.00 0.00 O ATOM 0 H ASP A 71 27.607 12.310 17.335 1.00 0.00 H new ATOM 0 HA ASP A 71 26.486 14.107 19.168 1.00 0.00 H new ATOM 0 HB2 ASP A 71 27.645 15.345 16.786 1.00 0.00 H new ATOM 0 HB3 ASP A 71 25.902 15.523 16.744 1.00 0.00 H new ATOM 1065 N GLY A 72 25.501 12.768 16.329 1.00 0.00 N ATOM 1066 CA GLY A 72 24.429 12.125 15.605 1.00 0.00 C ATOM 1067 C GLY A 72 24.221 12.763 14.264 1.00 0.00 C ATOM 1068 O GLY A 72 24.290 12.087 13.254 1.00 0.00 O ATOM 0 H GLY A 72 26.391 12.763 15.830 1.00 0.00 H new ATOM 0 HA2 GLY A 72 24.657 11.067 15.476 1.00 0.00 H new ATOM 0 HA3 GLY A 72 23.508 12.184 16.185 1.00 0.00 H new ATOM 1072 N ASN A 73 24.054 14.071 14.237 1.00 0.00 N ATOM 1073 CA ASN A 73 23.857 14.821 13.027 1.00 0.00 C ATOM 1074 C ASN A 73 24.471 16.195 13.254 1.00 0.00 C ATOM 1075 O ASN A 73 23.776 17.088 13.725 1.00 0.00 O ATOM 1076 CB ASN A 73 22.359 14.914 12.755 1.00 0.00 C ATOM 1077 CG ASN A 73 22.073 15.972 11.733 1.00 0.00 C ATOM 1078 OD1 ASN A 73 22.720 16.084 10.705 1.00 0.00 O ATOM 1079 ND2 ASN A 73 21.108 16.796 12.041 1.00 0.00 N ATOM 0 H ASN A 73 24.053 14.648 15.078 1.00 0.00 H new ATOM 0 HA ASN A 73 24.327 14.351 12.163 1.00 0.00 H new ATOM 0 HB2 ASN A 73 21.987 13.951 12.404 1.00 0.00 H new ATOM 0 HB3 ASN A 73 21.829 15.142 13.680 1.00 0.00 H new ATOM 0 HD21 ASN A 73 20.874 17.565 11.413 1.00 0.00 H new ATOM 0 HD22 ASN A 73 20.588 16.671 12.910 1.00 0.00 H new ATOM 1086 N GLY A 74 25.768 16.329 13.006 1.00 0.00 N ATOM 1087 CA GLY A 74 26.471 17.597 13.112 1.00 0.00 C ATOM 1088 C GLY A 74 25.967 18.643 12.124 1.00 0.00 C ATOM 1089 O GLY A 74 24.866 19.165 12.229 1.00 0.00 O ATOM 0 H GLY A 74 26.365 15.552 12.723 1.00 0.00 H new ATOM 0 HA2 GLY A 74 26.364 17.982 14.126 1.00 0.00 H new ATOM 0 HA3 GLY A 74 27.535 17.431 12.945 1.00 0.00 H new ATOM 1093 N LYS A 75 26.798 19.010 11.148 1.00 0.00 N ATOM 1094 CA LYS A 75 26.382 19.954 10.104 1.00 0.00 C ATOM 1095 C LYS A 75 25.254 19.397 9.227 1.00 0.00 C ATOM 1096 O LYS A 75 24.073 19.521 9.518 1.00 0.00 O ATOM 1097 CB LYS A 75 27.615 20.409 9.305 1.00 0.00 C ATOM 1098 CG LYS A 75 28.328 21.586 9.979 1.00 0.00 C ATOM 1099 CD LYS A 75 28.724 22.615 8.920 1.00 0.00 C ATOM 1100 CE LYS A 75 29.417 23.807 9.575 1.00 0.00 C ATOM 1101 NZ LYS A 75 29.595 24.918 8.610 1.00 0.00 N ATOM 0 H LYS A 75 27.756 18.673 11.056 1.00 0.00 H new ATOM 0 HA LYS A 75 25.948 20.836 10.576 1.00 0.00 H new ATOM 0 HB2 LYS A 75 28.309 19.575 9.201 1.00 0.00 H new ATOM 0 HB3 LYS A 75 27.310 20.697 8.299 1.00 0.00 H new ATOM 0 HG2 LYS A 75 27.674 22.045 10.721 1.00 0.00 H new ATOM 0 HG3 LYS A 75 29.213 21.234 10.509 1.00 0.00 H new ATOM 0 HD2 LYS A 75 29.388 22.156 8.188 1.00 0.00 H new ATOM 0 HD3 LYS A 75 27.839 22.951 8.381 1.00 0.00 H new ATOM 0 HE2 LYS A 75 28.829 24.151 10.426 1.00 0.00 H new ATOM 0 HE3 LYS A 75 30.388 23.499 9.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 30.068 25.715 9.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 30.176 24.594 7.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 28.665 25.226 8.260 1.00 0.00 H new ATOM 1115 N THR A 76 25.629 18.841 8.081 1.00 0.00 N ATOM 1116 CA THR A 76 24.681 18.233 7.145 1.00 0.00 C ATOM 1117 C THR A 76 24.862 16.723 7.118 1.00 0.00 C ATOM 1118 O THR A 76 24.443 16.087 6.154 1.00 0.00 O ATOM 1119 CB THR A 76 24.783 18.913 5.767 1.00 0.00 C ATOM 1120 OG1 THR A 76 23.497 19.142 5.239 1.00 0.00 O ATOM 1121 CG2 THR A 76 25.563 18.151 4.688 1.00 0.00 C ATOM 0 H THR A 76 26.600 18.797 7.771 1.00 0.00 H new ATOM 0 HA THR A 76 23.658 18.400 7.481 1.00 0.00 H new ATOM 0 HB THR A 76 25.337 19.826 5.983 1.00 0.00 H new ATOM 0 HG1 THR A 76 23.575 19.576 4.364 1.00 0.00 H new ATOM 0 HG21 THR A 76 25.565 18.729 3.764 1.00 0.00 H new ATOM 0 HG22 THR A 76 26.589 17.996 5.022 1.00 0.00 H new ATOM 0 HG23 THR A 76 25.090 17.185 4.511 1.00 0.00 H new ATOM 1129 N ASP A 77 25.551 16.162 8.123 1.00 0.00 N ATOM 1130 CA ASP A 77 25.884 14.754 8.242 1.00 0.00 C ATOM 1131 C ASP A 77 24.832 13.917 7.558 1.00 0.00 C ATOM 1132 O ASP A 77 23.738 13.818 8.059 1.00 0.00 O ATOM 1133 CB ASP A 77 25.925 14.330 9.711 1.00 0.00 C ATOM 1134 CG ASP A 77 27.035 15.003 10.522 1.00 0.00 C ATOM 1135 OD1 ASP A 77 27.571 16.038 10.043 1.00 0.00 O ATOM 1136 OD2 ASP A 77 27.317 14.499 11.633 1.00 0.00 O ATOM 0 H ASP A 77 25.903 16.712 8.906 1.00 0.00 H new ATOM 0 HA ASP A 77 26.860 14.605 7.781 1.00 0.00 H new ATOM 0 HB2 ASP A 77 24.964 14.558 10.171 1.00 0.00 H new ATOM 0 HB3 ASP A 77 26.055 13.249 9.763 1.00 0.00 H new ATOM 1141 N HIS A 78 25.112 13.367 6.381 1.00 0.00 N ATOM 1142 CA HIS A 78 24.116 12.620 5.600 1.00 0.00 C ATOM 1143 C HIS A 78 24.100 11.158 6.026 1.00 0.00 C ATOM 1144 O HIS A 78 23.674 10.279 5.281 1.00 0.00 O ATOM 1145 CB HIS A 78 24.371 12.776 4.099 1.00 0.00 C ATOM 1146 CG HIS A 78 25.832 12.847 3.749 1.00 0.00 C ATOM 1147 ND1 HIS A 78 26.559 11.836 3.176 1.00 0.00 N ATOM 1148 CD2 HIS A 78 26.664 13.914 3.949 1.00 0.00 C ATOM 1149 CE1 HIS A 78 27.807 12.299 2.977 1.00 0.00 C ATOM 1150 NE2 HIS A 78 27.902 13.551 3.462 1.00 0.00 N ATOM 0 H HIS A 78 26.029 13.422 5.938 1.00 0.00 H new ATOM 0 HA HIS A 78 23.128 13.034 5.801 1.00 0.00 H new ATOM 0 HB2 HIS A 78 23.918 11.937 3.571 1.00 0.00 H new ATOM 0 HB3 HIS A 78 23.875 13.680 3.745 1.00 0.00 H new ATOM 0 HD2 HIS A 78 26.402 14.859 4.401 1.00 0.00 H new ATOM 0 HE1 HIS A 78 28.608 11.751 2.502 1.00 0.00 H new ATOM 0 HE2 HIS A 78 28.742 14.130 3.468 1.00 0.00 H new ATOM 1159 N TYR A 79 24.690 10.905 7.191 1.00 0.00 N ATOM 1160 CA TYR A 79 24.677 9.652 7.893 1.00 0.00 C ATOM 1161 C TYR A 79 23.333 8.939 7.733 1.00 0.00 C ATOM 1162 O TYR A 79 22.263 9.543 7.784 1.00 0.00 O ATOM 1163 CB TYR A 79 25.053 9.914 9.348 1.00 0.00 C ATOM 1164 CG TYR A 79 23.931 10.446 10.209 1.00 0.00 C ATOM 1165 CD1 TYR A 79 23.142 11.520 9.794 1.00 0.00 C ATOM 1166 CD2 TYR A 79 23.604 9.838 11.415 1.00 0.00 C ATOM 1167 CE1 TYR A 79 22.100 12.045 10.562 1.00 0.00 C ATOM 1168 CE2 TYR A 79 22.545 10.324 12.193 1.00 0.00 C ATOM 1169 CZ TYR A 79 21.799 11.442 11.782 1.00 0.00 C ATOM 1170 OH TYR A 79 20.781 11.926 12.518 1.00 0.00 O ATOM 0 H TYR A 79 25.218 11.621 7.689 1.00 0.00 H new ATOM 0 HA TYR A 79 25.413 8.969 7.467 1.00 0.00 H new ATOM 0 HB2 TYR A 79 25.419 8.986 9.786 1.00 0.00 H new ATOM 0 HB3 TYR A 79 25.879 10.625 9.372 1.00 0.00 H new ATOM 0 HD1 TYR A 79 23.347 11.967 8.832 1.00 0.00 H new ATOM 0 HD2 TYR A 79 24.171 8.984 11.755 1.00 0.00 H new ATOM 0 HE1 TYR A 79 21.539 12.901 10.217 1.00 0.00 H new ATOM 0 HE2 TYR A 79 22.298 9.832 13.122 1.00 0.00 H new ATOM 0 HH TYR A 79 19.987 11.366 12.386 1.00 0.00 H new ATOM 1180 N LEU A 80 23.402 7.649 7.445 1.00 0.00 N ATOM 1181 CA LEU A 80 22.188 6.863 7.344 1.00 0.00 C ATOM 1182 C LEU A 80 21.660 6.554 8.730 1.00 0.00 C ATOM 1183 O LEU A 80 22.444 6.488 9.664 1.00 0.00 O ATOM 1184 CB LEU A 80 22.520 5.590 6.578 1.00 0.00 C ATOM 1185 CG LEU A 80 22.117 5.721 5.102 1.00 0.00 C ATOM 1186 CD1 LEU A 80 23.133 5.052 4.182 1.00 0.00 C ATOM 1187 CD2 LEU A 80 20.770 5.056 4.874 1.00 0.00 C ATOM 0 H LEU A 80 24.267 7.135 7.280 1.00 0.00 H new ATOM 0 HA LEU A 80 21.409 7.411 6.814 1.00 0.00 H new ATOM 0 HB2 LEU A 80 23.588 5.384 6.651 1.00 0.00 H new ATOM 0 HB3 LEU A 80 22.001 4.744 7.028 1.00 0.00 H new ATOM 0 HG LEU A 80 22.070 6.785 4.872 1.00 0.00 H new ATOM 0 HD11 LEU A 80 22.815 5.165 3.146 1.00 0.00 H new ATOM 0 HD12 LEU A 80 24.108 5.520 4.315 1.00 0.00 H new ATOM 0 HD13 LEU A 80 23.203 3.992 4.427 1.00 0.00 H new ATOM 0 HD21 LEU A 80 20.490 5.152 3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 80 20.836 4.000 5.136 1.00 0.00 H new ATOM 0 HD23 LEU A 80 20.016 5.538 5.497 1.00 0.00 H new ATOM 1199 N LEU A 81 20.361 6.336 8.868 1.00 0.00 N ATOM 1200 CA LEU A 81 19.745 5.983 10.133 1.00 0.00 C ATOM 1201 C LEU A 81 18.675 4.933 9.904 1.00 0.00 C ATOM 1202 O LEU A 81 17.907 5.016 8.944 1.00 0.00 O ATOM 1203 CB LEU A 81 19.130 7.224 10.797 1.00 0.00 C ATOM 1204 CG LEU A 81 20.159 8.297 11.187 1.00 0.00 C ATOM 1205 CD1 LEU A 81 19.994 9.524 10.292 1.00 0.00 C ATOM 1206 CD2 LEU A 81 20.115 8.582 12.687 1.00 0.00 C ATOM 0 H LEU A 81 19.699 6.401 8.094 1.00 0.00 H new ATOM 0 HA LEU A 81 20.510 5.580 10.796 1.00 0.00 H new ATOM 0 HB2 LEU A 81 18.401 7.664 10.117 1.00 0.00 H new ATOM 0 HB3 LEU A 81 18.587 6.914 11.690 1.00 0.00 H new ATOM 0 HG LEU A 81 21.170 7.931 11.008 1.00 0.00 H new ATOM 0 HD11 LEU A 81 20.726 10.281 10.574 1.00 0.00 H new ATOM 0 HD12 LEU A 81 20.149 9.239 9.251 1.00 0.00 H new ATOM 0 HD13 LEU A 81 18.989 9.929 10.412 1.00 0.00 H new ATOM 0 HD21 LEU A 81 20.853 9.345 12.934 1.00 0.00 H new ATOM 0 HD22 LEU A 81 19.121 8.936 12.961 1.00 0.00 H new ATOM 0 HD23 LEU A 81 20.339 7.668 13.238 1.00 0.00 H new ATOM 1218 N GLU A 82 18.617 3.956 10.801 1.00 0.00 N ATOM 1219 CA GLU A 82 17.648 2.883 10.743 1.00 0.00 C ATOM 1220 C GLU A 82 16.562 3.062 11.794 1.00 0.00 C ATOM 1221 O GLU A 82 16.796 3.603 12.883 1.00 0.00 O ATOM 1222 CB GLU A 82 18.327 1.515 10.891 1.00 0.00 C ATOM 1223 CG GLU A 82 18.836 1.176 12.261 1.00 0.00 C ATOM 1224 CD GLU A 82 20.223 1.748 12.477 1.00 0.00 C ATOM 1225 OE1 GLU A 82 20.291 2.940 12.817 1.00 0.00 O ATOM 1226 OE2 GLU A 82 21.175 0.957 12.390 1.00 0.00 O ATOM 0 H GLU A 82 19.252 3.891 11.597 1.00 0.00 H new ATOM 0 HA GLU A 82 17.175 2.921 9.762 1.00 0.00 H new ATOM 0 HB2 GLU A 82 17.617 0.745 10.588 1.00 0.00 H new ATOM 0 HB3 GLU A 82 19.163 1.470 10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 82 18.154 1.569 13.015 1.00 0.00 H new ATOM 0 HG3 GLU A 82 18.860 0.094 12.387 1.00 0.00 H new ATOM 1233 N PHE A 83 15.391 2.496 11.514 1.00 0.00 N ATOM 1234 CA PHE A 83 14.270 2.596 12.432 1.00 0.00 C ATOM 1235 C PHE A 83 13.446 1.301 12.507 1.00 0.00 C ATOM 1236 O PHE A 83 13.068 0.772 11.461 1.00 0.00 O ATOM 1237 CB PHE A 83 13.389 3.754 11.987 1.00 0.00 C ATOM 1238 CG PHE A 83 12.489 4.268 13.059 1.00 0.00 C ATOM 1239 CD1 PHE A 83 12.990 4.559 14.330 1.00 0.00 C ATOM 1240 CD2 PHE A 83 11.126 4.399 12.798 1.00 0.00 C ATOM 1241 CE1 PHE A 83 12.135 5.022 15.328 1.00 0.00 C ATOM 1242 CE2 PHE A 83 10.256 4.819 13.813 1.00 0.00 C ATOM 1243 CZ PHE A 83 10.787 5.190 15.044 1.00 0.00 C ATOM 0 H PHE A 83 15.198 1.967 10.663 1.00 0.00 H new ATOM 0 HA PHE A 83 14.663 2.768 13.434 1.00 0.00 H new ATOM 0 HB2 PHE A 83 14.024 4.568 11.636 1.00 0.00 H new ATOM 0 HB3 PHE A 83 12.784 3.434 11.139 1.00 0.00 H new ATOM 0 HD1 PHE A 83 14.041 4.425 14.539 1.00 0.00 H new ATOM 0 HD2 PHE A 83 10.741 4.177 11.814 1.00 0.00 H new ATOM 0 HE1 PHE A 83 12.517 5.248 16.312 1.00 0.00 H new ATOM 0 HE2 PHE A 83 9.190 4.854 13.642 1.00 0.00 H new ATOM 0 HZ PHE A 83 10.137 5.617 15.794 1.00 0.00 H new ATOM 1253 N PRO A 84 13.215 0.733 13.705 1.00 0.00 N ATOM 1254 CA PRO A 84 12.499 -0.510 13.906 1.00 0.00 C ATOM 1255 C PRO A 84 11.014 -0.310 13.693 1.00 0.00 C ATOM 1256 O PRO A 84 10.321 0.227 14.557 1.00 0.00 O ATOM 1257 CB PRO A 84 12.813 -0.995 15.310 1.00 0.00 C ATOM 1258 CG PRO A 84 13.326 0.231 16.040 1.00 0.00 C ATOM 1259 CD PRO A 84 13.629 1.273 14.975 1.00 0.00 C ATOM 0 HA PRO A 84 12.813 -1.262 13.182 1.00 0.00 H new ATOM 0 HB2 PRO A 84 11.926 -1.401 15.795 1.00 0.00 H new ATOM 0 HB3 PRO A 84 13.560 -1.788 15.296 1.00 0.00 H new ATOM 0 HG2 PRO A 84 12.582 0.602 16.745 1.00 0.00 H new ATOM 0 HG3 PRO A 84 14.220 -0.006 16.616 1.00 0.00 H new ATOM 0 HD2 PRO A 84 13.099 2.202 15.187 1.00 0.00 H new ATOM 0 HD3 PRO A 84 14.693 1.509 14.962 1.00 0.00 H new ATOM 1267 N THR A 85 10.553 -0.785 12.543 1.00 0.00 N ATOM 1268 CA THR A 85 9.173 -0.686 12.124 1.00 0.00 C ATOM 1269 C THR A 85 8.489 -2.024 12.281 1.00 0.00 C ATOM 1270 O THR A 85 8.887 -3.014 11.671 1.00 0.00 O ATOM 1271 CB THR A 85 9.081 -0.142 10.693 1.00 0.00 C ATOM 1272 OG1 THR A 85 7.763 -0.295 10.223 1.00 0.00 O ATOM 1273 CG2 THR A 85 9.999 -0.814 9.683 1.00 0.00 C ATOM 0 H THR A 85 11.148 -1.260 11.864 1.00 0.00 H new ATOM 0 HA THR A 85 8.649 0.025 12.763 1.00 0.00 H new ATOM 0 HB THR A 85 9.395 0.899 10.767 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.781 -0.573 9.283 1.00 0.00 H new ATOM 0 HG21 THR A 85 9.858 -0.358 8.703 1.00 0.00 H new ATOM 0 HG22 THR A 85 11.036 -0.690 9.995 1.00 0.00 H new ATOM 0 HG23 THR A 85 9.762 -1.876 9.626 1.00 0.00 H new ATOM 1281 N PHE A 86 7.446 -2.067 13.101 1.00 0.00 N ATOM 1282 CA PHE A 86 6.661 -3.277 13.277 1.00 0.00 C ATOM 1283 C PHE A 86 5.627 -3.492 12.167 1.00 0.00 C ATOM 1284 O PHE A 86 5.214 -2.534 11.509 1.00 0.00 O ATOM 1285 CB PHE A 86 5.963 -3.184 14.624 1.00 0.00 C ATOM 1286 CG PHE A 86 6.931 -3.099 15.755 1.00 0.00 C ATOM 1287 CD1 PHE A 86 7.792 -4.174 16.054 1.00 0.00 C ATOM 1288 CD2 PHE A 86 6.953 -1.934 16.523 1.00 0.00 C ATOM 1289 CE1 PHE A 86 8.661 -4.085 17.154 1.00 0.00 C ATOM 1290 CE2 PHE A 86 7.762 -1.896 17.656 1.00 0.00 C ATOM 1291 CZ PHE A 86 8.629 -2.939 17.955 1.00 0.00 C ATOM 0 H PHE A 86 7.125 -1.273 13.655 1.00 0.00 H new ATOM 0 HA PHE A 86 7.335 -4.132 13.231 1.00 0.00 H new ATOM 0 HB2 PHE A 86 5.315 -2.308 14.636 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.323 -4.056 14.761 1.00 0.00 H new ATOM 0 HD1 PHE A 86 7.784 -5.062 15.440 1.00 0.00 H new ATOM 0 HD2 PHE A 86 6.355 -1.079 16.244 1.00 0.00 H new ATOM 0 HE1 PHE A 86 9.345 -4.891 17.378 1.00 0.00 H new ATOM 0 HE2 PHE A 86 7.714 -1.041 18.314 1.00 0.00 H new ATOM 0 HZ PHE A 86 9.283 -2.865 18.812 1.00 0.00 H new ATOM 1301 N PRO A 87 5.170 -4.745 11.985 1.00 0.00 N ATOM 1302 CA PRO A 87 4.165 -5.071 10.993 1.00 0.00 C ATOM 1303 C PRO A 87 2.767 -4.635 11.386 1.00 0.00 C ATOM 1304 O PRO A 87 2.068 -4.096 10.528 1.00 0.00 O ATOM 1305 CB PRO A 87 4.194 -6.576 10.841 1.00 0.00 C ATOM 1306 CG PRO A 87 4.886 -7.123 12.085 1.00 0.00 C ATOM 1307 CD PRO A 87 5.545 -5.929 12.754 1.00 0.00 C ATOM 0 HA PRO A 87 4.395 -4.542 10.068 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.184 -6.976 10.751 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.733 -6.865 9.939 1.00 0.00 H new ATOM 0 HG2 PRO A 87 4.169 -7.599 12.754 1.00 0.00 H new ATOM 0 HG3 PRO A 87 5.625 -7.879 11.820 1.00 0.00 H new ATOM 0 HD2 PRO A 87 5.215 -5.837 13.789 1.00 0.00 H new ATOM 0 HD3 PRO A 87 6.628 -6.048 12.774 1.00 0.00 H new ATOM 1315 N ASP A 88 2.385 -4.845 12.663 1.00 0.00 N ATOM 1316 CA ASP A 88 1.103 -4.387 13.238 1.00 0.00 C ATOM 1317 C ASP A 88 0.777 -2.978 12.725 1.00 0.00 C ATOM 1318 O ASP A 88 -0.339 -2.634 12.355 1.00 0.00 O ATOM 1319 CB ASP A 88 1.177 -4.437 14.773 1.00 0.00 C ATOM 1320 CG ASP A 88 0.006 -3.782 15.521 1.00 0.00 C ATOM 1321 OD1 ASP A 88 -1.074 -3.610 14.929 1.00 0.00 O ATOM 1322 OD2 ASP A 88 0.214 -3.438 16.694 1.00 0.00 O ATOM 0 H ASP A 88 2.968 -5.345 13.334 1.00 0.00 H new ATOM 0 HA ASP A 88 0.296 -5.048 12.922 1.00 0.00 H new ATOM 0 HB2 ASP A 88 1.242 -5.481 15.081 1.00 0.00 H new ATOM 0 HB3 ASP A 88 2.101 -3.953 15.089 1.00 0.00 H new ATOM 1327 N GLY A 89 1.826 -2.170 12.586 1.00 0.00 N ATOM 1328 CA GLY A 89 1.709 -0.804 12.139 1.00 0.00 C ATOM 1329 C GLY A 89 1.695 0.173 13.287 1.00 0.00 C ATOM 1330 O GLY A 89 1.627 1.382 13.071 1.00 0.00 O ATOM 0 H GLY A 89 2.784 -2.457 12.785 1.00 0.00 H new ATOM 0 HA2 GLY A 89 2.540 -0.569 11.474 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.794 -0.691 11.557 1.00 0.00 H new ATOM 1334 N HIS A 90 1.751 -0.366 14.505 1.00 0.00 N ATOM 1335 CA HIS A 90 1.819 0.423 15.710 1.00 0.00 C ATOM 1336 C HIS A 90 3.144 1.173 15.708 1.00 0.00 C ATOM 1337 O HIS A 90 4.215 0.588 15.519 1.00 0.00 O ATOM 1338 CB HIS A 90 1.566 -0.446 16.957 1.00 0.00 C ATOM 1339 CG HIS A 90 2.695 -1.377 17.376 1.00 0.00 C ATOM 1340 ND1 HIS A 90 2.659 -2.746 17.321 1.00 0.00 N ATOM 1341 CD2 HIS A 90 3.909 -1.038 17.898 1.00 0.00 C ATOM 1342 CE1 HIS A 90 3.825 -3.248 17.747 1.00 0.00 C ATOM 1343 NE2 HIS A 90 4.602 -2.215 18.120 1.00 0.00 N ATOM 0 H HIS A 90 1.750 -1.372 14.672 1.00 0.00 H new ATOM 0 HA HIS A 90 1.025 1.169 15.743 1.00 0.00 H new ATOM 0 HB2 HIS A 90 1.341 0.215 17.794 1.00 0.00 H new ATOM 0 HB3 HIS A 90 0.675 -1.049 16.778 1.00 0.00 H new ATOM 0 HD1 HIS A 90 1.863 -3.299 17.003 1.00 0.00 H new ATOM 0 HD2 HIS A 90 4.263 -0.038 18.100 1.00 0.00 H new ATOM 0 HE1 HIS A 90 4.093 -4.293 17.784 1.00 0.00 H new ATOM 1352 N ASP A 91 3.064 2.482 15.879 1.00 0.00 N ATOM 1353 CA ASP A 91 4.230 3.316 16.091 1.00 0.00 C ATOM 1354 C ASP A 91 4.917 2.811 17.352 1.00 0.00 C ATOM 1355 O ASP A 91 4.349 2.834 18.440 1.00 0.00 O ATOM 1356 CB ASP A 91 3.777 4.772 16.173 1.00 0.00 C ATOM 1357 CG ASP A 91 4.866 5.740 16.615 1.00 0.00 C ATOM 1358 OD1 ASP A 91 5.140 5.846 17.829 1.00 0.00 O ATOM 1359 OD2 ASP A 91 5.435 6.379 15.722 1.00 0.00 O ATOM 0 H ASP A 91 2.183 2.996 15.874 1.00 0.00 H new ATOM 0 HA ASP A 91 4.951 3.265 15.275 1.00 0.00 H new ATOM 0 HB2 ASP A 91 3.406 5.081 15.196 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.940 4.842 16.868 1.00 0.00 H new ATOM 1364 N TYR A 92 6.044 2.129 17.167 1.00 0.00 N ATOM 1365 CA TYR A 92 6.893 1.691 18.250 1.00 0.00 C ATOM 1366 C TYR A 92 6.964 2.772 19.337 1.00 0.00 C ATOM 1367 O TYR A 92 7.064 3.952 19.059 1.00 0.00 O ATOM 1368 CB TYR A 92 8.278 1.377 17.664 1.00 0.00 C ATOM 1369 CG TYR A 92 9.334 1.066 18.712 1.00 0.00 C ATOM 1370 CD1 TYR A 92 9.022 0.352 19.893 1.00 0.00 C ATOM 1371 CD2 TYR A 92 10.642 1.526 18.513 1.00 0.00 C ATOM 1372 CE1 TYR A 92 10.002 0.085 20.854 1.00 0.00 C ATOM 1373 CE2 TYR A 92 11.625 1.280 19.479 1.00 0.00 C ATOM 1374 CZ TYR A 92 11.310 0.540 20.633 1.00 0.00 C ATOM 1375 OH TYR A 92 12.293 0.208 21.490 1.00 0.00 O ATOM 0 H TYR A 92 6.390 1.866 16.244 1.00 0.00 H new ATOM 0 HA TYR A 92 6.491 0.794 18.722 1.00 0.00 H new ATOM 0 HB2 TYR A 92 8.191 0.527 16.987 1.00 0.00 H new ATOM 0 HB3 TYR A 92 8.611 2.227 17.068 1.00 0.00 H new ATOM 0 HD1 TYR A 92 8.011 0.008 20.055 1.00 0.00 H new ATOM 0 HD2 TYR A 92 10.892 2.070 17.614 1.00 0.00 H new ATOM 0 HE1 TYR A 92 9.756 -0.463 21.752 1.00 0.00 H new ATOM 0 HE2 TYR A 92 12.626 1.659 19.338 1.00 0.00 H new ATOM 0 HH TYR A 92 12.540 0.992 22.024 1.00 0.00 H new ATOM 1385 N LYS A 93 6.942 2.380 20.604 1.00 0.00 N ATOM 1386 CA LYS A 93 7.148 3.314 21.698 1.00 0.00 C ATOM 1387 C LYS A 93 8.624 3.703 21.845 1.00 0.00 C ATOM 1388 O LYS A 93 9.240 3.495 22.888 1.00 0.00 O ATOM 1389 CB LYS A 93 6.543 2.742 22.964 1.00 0.00 C ATOM 1390 CG LYS A 93 6.967 1.281 23.187 1.00 0.00 C ATOM 1391 CD LYS A 93 6.797 0.883 24.644 1.00 0.00 C ATOM 1392 CE LYS A 93 5.502 1.429 25.232 1.00 0.00 C ATOM 1393 NZ LYS A 93 5.049 0.604 26.367 1.00 0.00 N ATOM 0 H LYS A 93 6.783 1.416 20.898 1.00 0.00 H new ATOM 0 HA LYS A 93 6.633 4.250 21.480 1.00 0.00 H new ATOM 0 HB2 LYS A 93 6.850 3.345 23.819 1.00 0.00 H new ATOM 0 HB3 LYS A 93 5.456 2.801 22.907 1.00 0.00 H new ATOM 0 HG2 LYS A 93 6.370 0.624 22.554 1.00 0.00 H new ATOM 0 HG3 LYS A 93 8.007 1.151 22.889 1.00 0.00 H new ATOM 0 HD2 LYS A 93 6.804 -0.204 24.727 1.00 0.00 H new ATOM 0 HD3 LYS A 93 7.643 1.253 25.223 1.00 0.00 H new ATOM 0 HE2 LYS A 93 5.653 2.457 25.562 1.00 0.00 H new ATOM 0 HE3 LYS A 93 4.730 1.451 24.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 4.278 1.093 26.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 4.707 -0.313 26.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 5.842 0.450 27.022 1.00 0.00 H new ATOM 1407 N PHE A 94 9.188 4.259 20.784 1.00 0.00 N ATOM 1408 CA PHE A 94 10.545 4.763 20.763 1.00 0.00 C ATOM 1409 C PHE A 94 10.692 6.063 21.545 1.00 0.00 C ATOM 1410 O PHE A 94 11.808 6.445 21.886 1.00 0.00 O ATOM 1411 CB PHE A 94 11.003 4.959 19.323 1.00 0.00 C ATOM 1412 CG PHE A 94 10.071 5.778 18.474 1.00 0.00 C ATOM 1413 CD1 PHE A 94 10.131 7.178 18.444 1.00 0.00 C ATOM 1414 CD2 PHE A 94 9.105 5.113 17.725 1.00 0.00 C ATOM 1415 CE1 PHE A 94 9.201 7.899 17.669 1.00 0.00 C ATOM 1416 CE2 PHE A 94 8.165 5.821 16.971 1.00 0.00 C ATOM 1417 CZ PHE A 94 8.213 7.220 16.935 1.00 0.00 C ATOM 0 H PHE A 94 8.701 4.373 19.895 1.00 0.00 H new ATOM 0 HA PHE A 94 11.177 4.022 21.252 1.00 0.00 H new ATOM 0 HB2 PHE A 94 11.982 5.438 19.329 1.00 0.00 H new ATOM 0 HB3 PHE A 94 11.130 3.980 18.860 1.00 0.00 H new ATOM 0 HD1 PHE A 94 10.886 7.701 19.012 1.00 0.00 H new ATOM 0 HD2 PHE A 94 9.081 4.033 17.726 1.00 0.00 H new ATOM 0 HE1 PHE A 94 9.247 8.978 17.639 1.00 0.00 H new ATOM 0 HE2 PHE A 94 7.404 5.291 16.418 1.00 0.00 H new ATOM 0 HZ PHE A 94 7.496 7.774 16.347 1.00 0.00 H new ATOM 1427 N ASP A 95 9.573 6.708 21.869 1.00 0.00 N ATOM 1428 CA ASP A 95 9.545 7.967 22.607 1.00 0.00 C ATOM 1429 C ASP A 95 9.504 7.725 24.118 1.00 0.00 C ATOM 1430 O ASP A 95 10.127 8.407 24.928 1.00 0.00 O ATOM 1431 CB ASP A 95 8.294 8.764 22.202 1.00 0.00 C ATOM 1432 CG ASP A 95 8.500 10.283 22.265 1.00 0.00 C ATOM 1433 OD1 ASP A 95 9.669 10.718 22.389 1.00 0.00 O ATOM 1434 OD2 ASP A 95 7.474 10.988 22.189 1.00 0.00 O ATOM 0 H ASP A 95 8.645 6.364 21.621 1.00 0.00 H new ATOM 0 HA ASP A 95 10.452 8.522 22.366 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.005 8.485 21.189 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.467 8.488 22.857 1.00 0.00 H new ATOM 1439 N SER A 96 8.771 6.684 24.518 1.00 0.00 N ATOM 1440 CA SER A 96 8.678 6.283 25.914 1.00 0.00 C ATOM 1441 C SER A 96 9.916 5.483 26.287 1.00 0.00 C ATOM 1442 O SER A 96 10.060 4.325 25.903 1.00 0.00 O ATOM 1443 CB SER A 96 7.412 5.465 26.172 1.00 0.00 C ATOM 1444 OG SER A 96 6.380 6.284 26.686 1.00 0.00 O ATOM 0 H SER A 96 8.228 6.100 23.882 1.00 0.00 H new ATOM 0 HA SER A 96 8.621 7.177 26.535 1.00 0.00 H new ATOM 0 HB2 SER A 96 7.082 4.995 25.245 1.00 0.00 H new ATOM 0 HB3 SER A 96 7.630 4.662 26.876 1.00 0.00 H new ATOM 0 HG SER A 96 5.579 5.741 26.842 1.00 0.00 H new ATOM 1450 N LYS A 97 10.811 6.096 27.070 1.00 0.00 N ATOM 1451 CA LYS A 97 12.014 5.411 27.562 1.00 0.00 C ATOM 1452 C LYS A 97 11.664 4.162 28.363 1.00 0.00 C ATOM 1453 O LYS A 97 12.231 3.092 28.170 1.00 0.00 O ATOM 1454 CB LYS A 97 12.907 6.387 28.343 1.00 0.00 C ATOM 1455 CG LYS A 97 12.562 6.483 29.837 1.00 0.00 C ATOM 1456 CD LYS A 97 13.489 7.391 30.608 1.00 0.00 C ATOM 1457 CE LYS A 97 13.041 8.839 30.458 1.00 0.00 C ATOM 1458 NZ LYS A 97 14.049 9.742 31.049 1.00 0.00 N ATOM 0 H LYS A 97 10.726 7.065 27.377 1.00 0.00 H new ATOM 0 HA LYS A 97 12.588 5.064 26.703 1.00 0.00 H new ATOM 0 HB2 LYS A 97 13.947 6.076 28.239 1.00 0.00 H new ATOM 0 HB3 LYS A 97 12.824 7.378 27.896 1.00 0.00 H new ATOM 0 HG2 LYS A 97 11.539 6.844 29.944 1.00 0.00 H new ATOM 0 HG3 LYS A 97 12.595 5.485 30.275 1.00 0.00 H new ATOM 0 HD2 LYS A 97 13.494 7.110 31.661 1.00 0.00 H new ATOM 0 HD3 LYS A 97 14.510 7.278 30.243 1.00 0.00 H new ATOM 0 HE2 LYS A 97 12.900 9.078 29.404 1.00 0.00 H new ATOM 0 HE3 LYS A 97 12.079 8.984 30.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 13.736 10.728 30.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 14.163 9.522 32.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 14.959 9.613 30.562 1.00 0.00 H new ATOM 1472 N LYS A 98 10.723 4.341 29.295 1.00 0.00 N ATOM 1473 CA LYS A 98 10.243 3.314 30.191 1.00 0.00 C ATOM 1474 C LYS A 98 8.709 3.393 30.318 1.00 0.00 C ATOM 1475 O LYS A 98 8.164 4.450 30.642 1.00 0.00 O ATOM 1476 CB LYS A 98 11.030 3.294 31.515 1.00 0.00 C ATOM 1477 CG LYS A 98 10.256 2.617 32.657 1.00 0.00 C ATOM 1478 CD LYS A 98 9.391 3.648 33.399 1.00 0.00 C ATOM 1479 CE LYS A 98 7.996 3.089 33.704 1.00 0.00 C ATOM 1480 NZ LYS A 98 7.029 4.181 33.968 1.00 0.00 N ATOM 0 H LYS A 98 10.266 5.241 29.442 1.00 0.00 H new ATOM 0 HA LYS A 98 10.443 2.330 29.768 1.00 0.00 H new ATOM 0 HB2 LYS A 98 11.975 2.772 31.363 1.00 0.00 H new ATOM 0 HB3 LYS A 98 11.273 4.317 31.803 1.00 0.00 H new ATOM 0 HG2 LYS A 98 9.625 1.823 32.257 1.00 0.00 H new ATOM 0 HG3 LYS A 98 10.954 2.150 33.352 1.00 0.00 H new ATOM 0 HD2 LYS A 98 9.881 3.935 34.329 1.00 0.00 H new ATOM 0 HD3 LYS A 98 9.299 4.551 32.795 1.00 0.00 H new ATOM 0 HE2 LYS A 98 7.650 2.488 32.863 1.00 0.00 H new ATOM 0 HE3 LYS A 98 8.047 2.427 34.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.094 3.775 34.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 7.350 4.738 34.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 6.965 4.797 33.133 1.00 0.00 H new ATOM 1494 N PRO A 99 8.017 2.256 30.161 1.00 0.00 N ATOM 1495 CA PRO A 99 8.617 1.018 29.693 1.00 0.00 C ATOM 1496 C PRO A 99 9.026 1.145 28.222 1.00 0.00 C ATOM 1497 O PRO A 99 8.715 2.142 27.573 1.00 0.00 O ATOM 1498 CB PRO A 99 7.599 -0.068 29.935 1.00 0.00 C ATOM 1499 CG PRO A 99 6.259 0.659 30.062 1.00 0.00 C ATOM 1500 CD PRO A 99 6.573 2.141 30.251 1.00 0.00 C ATOM 0 HA PRO A 99 9.536 0.778 30.228 1.00 0.00 H new ATOM 0 HB2 PRO A 99 7.583 -0.783 29.112 1.00 0.00 H new ATOM 0 HB3 PRO A 99 7.830 -0.629 30.840 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.650 0.504 29.171 1.00 0.00 H new ATOM 0 HG3 PRO A 99 5.690 0.274 30.908 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.085 2.744 29.486 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.212 2.497 31.216 1.00 0.00 H new ATOM 1508 N LYS A 100 9.688 0.121 27.705 1.00 0.00 N ATOM 1509 CA LYS A 100 10.147 0.056 26.327 1.00 0.00 C ATOM 1510 C LYS A 100 9.899 -1.348 25.826 1.00 0.00 C ATOM 1511 O LYS A 100 10.434 -2.300 26.380 1.00 0.00 O ATOM 1512 CB LYS A 100 11.606 0.520 26.252 1.00 0.00 C ATOM 1513 CG LYS A 100 12.373 -0.132 25.100 1.00 0.00 C ATOM 1514 CD LYS A 100 13.835 0.299 25.112 1.00 0.00 C ATOM 1515 CE LYS A 100 14.530 -0.297 23.884 1.00 0.00 C ATOM 1516 NZ LYS A 100 14.973 -1.684 24.121 1.00 0.00 N ATOM 0 H LYS A 100 9.927 -0.709 28.247 1.00 0.00 H new ATOM 0 HA LYS A 100 9.599 0.731 25.669 1.00 0.00 H new ATOM 0 HB2 LYS A 100 11.633 1.603 26.134 1.00 0.00 H new ATOM 0 HB3 LYS A 100 12.106 0.289 27.193 1.00 0.00 H new ATOM 0 HG2 LYS A 100 12.308 -1.217 25.182 1.00 0.00 H new ATOM 0 HG3 LYS A 100 11.915 0.144 24.150 1.00 0.00 H new ATOM 0 HD2 LYS A 100 13.909 1.386 25.098 1.00 0.00 H new ATOM 0 HD3 LYS A 100 14.322 -0.042 26.025 1.00 0.00 H new ATOM 0 HE2 LYS A 100 13.848 -0.274 23.034 1.00 0.00 H new ATOM 0 HE3 LYS A 100 15.390 0.318 23.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 15.438 -2.051 23.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 15.644 -1.703 24.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 14.150 -2.277 24.349 1.00 0.00 H new ATOM 1530 N GLU A 101 9.047 -1.461 24.820 1.00 0.00 N ATOM 1531 CA GLU A 101 8.832 -2.754 24.185 1.00 0.00 C ATOM 1532 C GLU A 101 10.070 -3.176 23.386 1.00 0.00 C ATOM 1533 O GLU A 101 10.990 -2.375 23.173 1.00 0.00 O ATOM 1534 CB GLU A 101 7.539 -2.703 23.341 1.00 0.00 C ATOM 1535 CG GLU A 101 7.109 -4.063 22.770 1.00 0.00 C ATOM 1536 CD GLU A 101 7.059 -5.132 23.869 1.00 0.00 C ATOM 1537 OE1 GLU A 101 6.743 -4.762 25.020 1.00 0.00 O ATOM 1538 OE2 GLU A 101 7.434 -6.274 23.537 1.00 0.00 O ATOM 0 H GLU A 101 8.502 -0.691 24.431 1.00 0.00 H new ATOM 0 HA GLU A 101 8.690 -3.526 24.941 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.731 -2.308 23.957 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.683 -2.004 22.517 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.129 -3.971 22.303 1.00 0.00 H new ATOM 0 HG3 GLU A 101 7.806 -4.371 21.991 1.00 0.00 H new ATOM 1545 N ASN A 102 10.107 -4.447 22.977 1.00 0.00 N ATOM 1546 CA ASN A 102 11.124 -4.992 22.097 1.00 0.00 C ATOM 1547 C ASN A 102 11.453 -4.041 20.937 1.00 0.00 C ATOM 1548 O ASN A 102 10.600 -3.272 20.511 1.00 0.00 O ATOM 1549 CB ASN A 102 10.664 -6.354 21.533 1.00 0.00 C ATOM 1550 CG ASN A 102 11.659 -7.470 21.787 1.00 0.00 C ATOM 1551 OD1 ASN A 102 12.599 -7.373 22.561 1.00 0.00 O ATOM 1552 ND2 ASN A 102 11.518 -8.550 21.062 1.00 0.00 N ATOM 0 H ASN A 102 9.410 -5.136 23.260 1.00 0.00 H new ATOM 0 HA ASN A 102 12.029 -5.122 22.690 1.00 0.00 H new ATOM 0 HB2 ASN A 102 9.706 -6.621 21.980 1.00 0.00 H new ATOM 0 HB3 ASN A 102 10.500 -6.259 20.460 1.00 0.00 H new ATOM 0 HD21 ASN A 102 12.193 -9.311 21.143 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.733 -8.631 20.416 1.00 0.00 H new ATOM 1559 N PRO A 103 12.672 -4.109 20.383 1.00 0.00 N ATOM 1560 CA PRO A 103 13.088 -3.251 19.292 1.00 0.00 C ATOM 1561 C PRO A 103 12.431 -3.627 17.970 1.00 0.00 C ATOM 1562 O PRO A 103 11.445 -3.034 17.568 1.00 0.00 O ATOM 1563 CB PRO A 103 14.607 -3.368 19.254 1.00 0.00 C ATOM 1564 CG PRO A 103 14.955 -4.674 19.979 1.00 0.00 C ATOM 1565 CD PRO A 103 13.707 -5.061 20.750 1.00 0.00 C ATOM 0 HA PRO A 103 12.774 -2.219 19.450 1.00 0.00 H new ATOM 0 HB2 PRO A 103 14.970 -3.385 18.226 1.00 0.00 H new ATOM 0 HB3 PRO A 103 15.075 -2.514 19.744 1.00 0.00 H new ATOM 0 HG2 PRO A 103 15.234 -5.453 19.270 1.00 0.00 H new ATOM 0 HG3 PRO A 103 15.803 -4.535 20.650 1.00 0.00 H new ATOM 0 HD2 PRO A 103 13.401 -6.078 20.504 1.00 0.00 H new ATOM 0 HD3 PRO A 103 13.893 -5.035 21.824 1.00 0.00 H new ATOM 1573 N GLY A 104 12.994 -4.596 17.262 1.00 0.00 N ATOM 1574 CA GLY A 104 12.457 -5.031 15.994 1.00 0.00 C ATOM 1575 C GLY A 104 13.578 -5.465 15.057 1.00 0.00 C ATOM 1576 O GLY A 104 14.655 -4.855 15.068 1.00 0.00 O ATOM 0 H GLY A 104 13.833 -5.097 17.555 1.00 0.00 H new ATOM 0 HA2 GLY A 104 11.766 -5.859 16.151 1.00 0.00 H new ATOM 0 HA3 GLY A 104 11.887 -4.222 15.538 1.00 0.00 H new ATOM 1580 N PRO A 105 13.346 -6.524 14.263 1.00 0.00 N ATOM 1581 CA PRO A 105 14.326 -7.050 13.326 1.00 0.00 C ATOM 1582 C PRO A 105 14.449 -6.141 12.107 1.00 0.00 C ATOM 1583 O PRO A 105 15.497 -5.522 11.890 1.00 0.00 O ATOM 1584 CB PRO A 105 13.862 -8.460 12.972 1.00 0.00 C ATOM 1585 CG PRO A 105 12.390 -8.513 13.362 1.00 0.00 C ATOM 1586 CD PRO A 105 12.111 -7.296 14.226 1.00 0.00 C ATOM 0 HA PRO A 105 15.326 -7.087 13.757 1.00 0.00 H new ATOM 0 HB2 PRO A 105 13.994 -8.661 11.909 1.00 0.00 H new ATOM 0 HB3 PRO A 105 14.439 -9.210 13.513 1.00 0.00 H new ATOM 0 HG2 PRO A 105 11.756 -8.509 12.475 1.00 0.00 H new ATOM 0 HG3 PRO A 105 12.169 -9.431 13.907 1.00 0.00 H new ATOM 0 HD2 PRO A 105 11.296 -6.704 13.811 1.00 0.00 H new ATOM 0 HD3 PRO A 105 11.809 -7.594 15.230 1.00 0.00 H new ATOM 1594 N ALA A 106 13.395 -6.105 11.287 1.00 0.00 N ATOM 1595 CA ALA A 106 13.373 -5.262 10.115 1.00 0.00 C ATOM 1596 C ALA A 106 13.325 -3.797 10.496 1.00 0.00 C ATOM 1597 O ALA A 106 12.589 -3.384 11.398 1.00 0.00 O ATOM 1598 CB ALA A 106 12.164 -5.592 9.290 1.00 0.00 C ATOM 0 H ALA A 106 12.548 -6.657 11.424 1.00 0.00 H new ATOM 0 HA ALA A 106 14.285 -5.443 9.546 1.00 0.00 H new ATOM 0 HB1 ALA A 106 12.144 -4.957 8.404 1.00 0.00 H new ATOM 0 HB2 ALA A 106 12.205 -6.638 8.986 1.00 0.00 H new ATOM 0 HB3 ALA A 106 11.263 -5.421 9.880 1.00 0.00 H new ATOM 1604 N ARG A 107 14.084 -3.007 9.748 1.00 0.00 N ATOM 1605 CA ARG A 107 14.193 -1.582 9.975 1.00 0.00 C ATOM 1606 C ARG A 107 14.263 -0.830 8.669 1.00 0.00 C ATOM 1607 O ARG A 107 14.867 -1.310 7.710 1.00 0.00 O ATOM 1608 CB ARG A 107 15.425 -1.275 10.827 1.00 0.00 C ATOM 1609 CG ARG A 107 15.366 -1.955 12.202 1.00 0.00 C ATOM 1610 CD ARG A 107 15.931 -1.064 13.309 1.00 0.00 C ATOM 1611 NE ARG A 107 16.940 -1.781 14.090 1.00 0.00 N ATOM 1612 CZ ARG A 107 18.064 -2.280 13.619 1.00 0.00 C ATOM 1613 NH1 ARG A 107 18.363 -2.194 12.359 1.00 0.00 N ATOM 1614 NH2 ARG A 107 18.917 -2.843 14.422 1.00 0.00 N ATOM 0 H ARG A 107 14.642 -3.344 8.964 1.00 0.00 H new ATOM 0 HA ARG A 107 13.301 -1.254 10.509 1.00 0.00 H new ATOM 0 HB2 ARG A 107 16.320 -1.604 10.299 1.00 0.00 H new ATOM 0 HB3 ARG A 107 15.512 -0.197 10.961 1.00 0.00 H new ATOM 0 HG2 ARG A 107 14.332 -2.211 12.435 1.00 0.00 H new ATOM 0 HG3 ARG A 107 15.926 -2.890 12.168 1.00 0.00 H new ATOM 0 HD2 ARG A 107 16.372 -0.169 12.871 1.00 0.00 H new ATOM 0 HD3 ARG A 107 15.124 -0.735 13.964 1.00 0.00 H new ATOM 0 HE ARG A 107 16.757 -1.905 15.086 1.00 0.00 H new ATOM 0 HH11 ARG A 107 17.722 -1.733 11.713 1.00 0.00 H new ATOM 0 HH12 ARG A 107 19.239 -2.587 12.015 1.00 0.00 H new ATOM 0 HH21 ARG A 107 18.717 -2.899 15.421 1.00 0.00 H new ATOM 0 HH22 ARG A 107 19.787 -3.228 14.054 1.00 0.00 H new ATOM 1628 N VAL A 108 13.656 0.344 8.656 1.00 0.00 N ATOM 1629 CA VAL A 108 13.644 1.219 7.494 1.00 0.00 C ATOM 1630 C VAL A 108 14.945 1.999 7.445 1.00 0.00 C ATOM 1631 O VAL A 108 15.327 2.642 8.420 1.00 0.00 O ATOM 1632 CB VAL A 108 12.421 2.145 7.526 1.00 0.00 C ATOM 1633 CG1 VAL A 108 12.285 2.930 8.823 1.00 0.00 C ATOM 1634 CG2 VAL A 108 12.392 3.069 6.307 1.00 0.00 C ATOM 0 H VAL A 108 13.153 0.721 9.459 1.00 0.00 H new ATOM 0 HA VAL A 108 13.565 0.623 6.585 1.00 0.00 H new ATOM 0 HB VAL A 108 11.549 1.492 7.482 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.399 3.563 8.774 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.190 2.237 9.659 1.00 0.00 H new ATOM 0 HG13 VAL A 108 13.168 3.553 8.966 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.514 3.712 6.359 1.00 0.00 H new ATOM 0 HG22 VAL A 108 13.292 3.684 6.295 1.00 0.00 H new ATOM 0 HG23 VAL A 108 12.350 2.470 5.397 1.00 0.00 H new ATOM 1644 N ILE A 109 15.644 1.903 6.321 1.00 0.00 N ATOM 1645 CA ILE A 109 16.908 2.601 6.130 1.00 0.00 C ATOM 1646 C ILE A 109 16.741 3.781 5.208 1.00 0.00 C ATOM 1647 O ILE A 109 16.020 3.694 4.211 1.00 0.00 O ATOM 1648 CB ILE A 109 17.956 1.621 5.610 1.00 0.00 C ATOM 1649 CG1 ILE A 109 18.187 0.469 6.587 1.00 0.00 C ATOM 1650 CG2 ILE A 109 19.261 2.351 5.351 1.00 0.00 C ATOM 1651 CD1 ILE A 109 18.122 0.864 8.042 1.00 0.00 C ATOM 0 H ILE A 109 15.352 1.342 5.520 1.00 0.00 H new ATOM 0 HA ILE A 109 17.248 2.995 7.088 1.00 0.00 H new ATOM 0 HB ILE A 109 17.583 1.196 4.678 1.00 0.00 H new ATOM 0 HG12 ILE A 109 17.443 -0.305 6.400 1.00 0.00 H new ATOM 0 HG13 ILE A 109 19.163 0.028 6.386 1.00 0.00 H new ATOM 0 HG21 ILE A 109 20.005 1.646 4.980 1.00 0.00 H new ATOM 0 HG22 ILE A 109 19.100 3.132 4.608 1.00 0.00 H new ATOM 0 HG23 ILE A 109 19.617 2.800 6.278 1.00 0.00 H new ATOM 0 HD11 ILE A 109 18.297 -0.013 8.665 1.00 0.00 H new ATOM 0 HD12 ILE A 109 18.885 1.615 8.250 1.00 0.00 H new ATOM 0 HD13 ILE A 109 17.137 1.276 8.264 1.00 0.00 H new ATOM 1663 N TYR A 110 17.430 4.870 5.532 1.00 0.00 N ATOM 1664 CA TYR A 110 17.326 6.104 4.800 1.00 0.00 C ATOM 1665 C TYR A 110 18.466 7.051 5.148 1.00 0.00 C ATOM 1666 O TYR A 110 19.026 7.023 6.248 1.00 0.00 O ATOM 1667 CB TYR A 110 15.987 6.745 5.165 1.00 0.00 C ATOM 1668 CG TYR A 110 15.904 7.145 6.622 1.00 0.00 C ATOM 1669 CD1 TYR A 110 16.637 8.245 7.099 1.00 0.00 C ATOM 1670 CD2 TYR A 110 15.107 6.424 7.521 1.00 0.00 C ATOM 1671 CE1 TYR A 110 16.599 8.641 8.436 1.00 0.00 C ATOM 1672 CE2 TYR A 110 15.054 6.821 8.871 1.00 0.00 C ATOM 1673 CZ TYR A 110 15.776 7.942 9.326 1.00 0.00 C ATOM 1674 OH TYR A 110 15.618 8.408 10.583 1.00 0.00 O ATOM 0 H TYR A 110 18.079 4.910 6.318 1.00 0.00 H new ATOM 0 HA TYR A 110 17.386 5.903 3.730 1.00 0.00 H new ATOM 0 HB2 TYR A 110 15.830 7.625 4.542 1.00 0.00 H new ATOM 0 HB3 TYR A 110 15.182 6.046 4.939 1.00 0.00 H new ATOM 0 HD1 TYR A 110 17.251 8.803 6.407 1.00 0.00 H new ATOM 0 HD2 TYR A 110 14.538 5.571 7.181 1.00 0.00 H new ATOM 0 HE1 TYR A 110 17.195 9.474 8.779 1.00 0.00 H new ATOM 0 HE2 TYR A 110 14.451 6.258 9.568 1.00 0.00 H new ATOM 0 HH TYR A 110 15.017 7.814 11.079 1.00 0.00 H new ATOM 1684 N THR A 111 18.801 7.914 4.205 1.00 0.00 N ATOM 1685 CA THR A 111 19.876 8.881 4.389 1.00 0.00 C ATOM 1686 C THR A 111 19.328 10.146 5.010 1.00 0.00 C ATOM 1687 O THR A 111 18.121 10.364 5.007 1.00 0.00 O ATOM 1688 CB THR A 111 20.584 9.144 3.067 1.00 0.00 C ATOM 1689 OG1 THR A 111 19.956 10.131 2.277 1.00 0.00 O ATOM 1690 CG2 THR A 111 20.594 7.888 2.217 1.00 0.00 C ATOM 0 H THR A 111 18.341 7.967 3.296 1.00 0.00 H new ATOM 0 HA THR A 111 20.621 8.475 5.074 1.00 0.00 H new ATOM 0 HB THR A 111 21.584 9.478 3.346 1.00 0.00 H new ATOM 0 HG1 THR A 111 20.621 10.791 1.988 1.00 0.00 H new ATOM 0 HG21 THR A 111 21.103 8.090 1.275 1.00 0.00 H new ATOM 0 HG22 THR A 111 21.117 7.093 2.749 1.00 0.00 H new ATOM 0 HG23 THR A 111 19.569 7.577 2.016 1.00 0.00 H new ATOM 1698 N TYR A 112 20.212 10.998 5.502 1.00 0.00 N ATOM 1699 CA TYR A 112 19.806 12.279 6.045 1.00 0.00 C ATOM 1700 C TYR A 112 20.209 13.457 5.127 1.00 0.00 C ATOM 1701 O TYR A 112 21.180 13.355 4.372 1.00 0.00 O ATOM 1702 CB TYR A 112 20.335 12.370 7.483 1.00 0.00 C ATOM 1703 CG TYR A 112 20.404 13.766 8.073 1.00 0.00 C ATOM 1704 CD1 TYR A 112 21.265 14.719 7.515 1.00 0.00 C ATOM 1705 CD2 TYR A 112 19.590 14.150 9.152 1.00 0.00 C ATOM 1706 CE1 TYR A 112 21.323 16.025 7.988 1.00 0.00 C ATOM 1707 CE2 TYR A 112 19.614 15.479 9.627 1.00 0.00 C ATOM 1708 CZ TYR A 112 20.460 16.430 9.009 1.00 0.00 C ATOM 1709 OH TYR A 112 20.581 17.703 9.444 1.00 0.00 O ATOM 0 H TYR A 112 21.216 10.823 5.536 1.00 0.00 H new ATOM 0 HA TYR A 112 18.719 12.356 6.083 1.00 0.00 H new ATOM 0 HB2 TYR A 112 19.701 11.756 8.123 1.00 0.00 H new ATOM 0 HB3 TYR A 112 21.334 11.934 7.511 1.00 0.00 H new ATOM 0 HD1 TYR A 112 21.903 14.431 6.693 1.00 0.00 H new ATOM 0 HD2 TYR A 112 18.942 13.424 9.621 1.00 0.00 H new ATOM 0 HE1 TYR A 112 22.032 16.723 7.568 1.00 0.00 H new ATOM 0 HE2 TYR A 112 18.989 15.769 10.459 1.00 0.00 H new ATOM 0 HH TYR A 112 19.739 17.989 9.857 1.00 0.00 H new ATOM 1719 N PRO A 113 19.513 14.606 5.240 1.00 0.00 N ATOM 1720 CA PRO A 113 18.282 14.746 6.006 1.00 0.00 C ATOM 1721 C PRO A 113 17.131 14.054 5.315 1.00 0.00 C ATOM 1722 O PRO A 113 16.464 13.208 5.906 1.00 0.00 O ATOM 1723 CB PRO A 113 18.029 16.226 6.190 1.00 0.00 C ATOM 1724 CG PRO A 113 18.884 16.909 5.120 1.00 0.00 C ATOM 1725 CD PRO A 113 19.885 15.863 4.616 1.00 0.00 C ATOM 0 HA PRO A 113 18.377 14.267 6.980 1.00 0.00 H new ATOM 0 HB2 PRO A 113 16.973 16.465 6.063 1.00 0.00 H new ATOM 0 HB3 PRO A 113 18.312 16.554 7.190 1.00 0.00 H new ATOM 0 HG2 PRO A 113 18.262 17.273 4.303 1.00 0.00 H new ATOM 0 HG3 PRO A 113 19.404 17.773 5.534 1.00 0.00 H new ATOM 0 HD2 PRO A 113 19.849 15.783 3.530 1.00 0.00 H new ATOM 0 HD3 PRO A 113 20.905 16.142 4.882 1.00 0.00 H new ATOM 1733 N ASN A 114 16.918 14.396 4.046 1.00 0.00 N ATOM 1734 CA ASN A 114 15.891 13.780 3.232 1.00 0.00 C ATOM 1735 C ASN A 114 15.926 12.269 3.409 1.00 0.00 C ATOM 1736 O ASN A 114 16.894 11.650 2.986 1.00 0.00 O ATOM 1737 CB ASN A 114 16.118 14.113 1.751 1.00 0.00 C ATOM 1738 CG ASN A 114 14.814 14.378 1.030 1.00 0.00 C ATOM 1739 OD1 ASN A 114 13.753 14.565 1.609 1.00 0.00 O ATOM 1740 ND2 ASN A 114 14.873 14.358 -0.277 1.00 0.00 N ATOM 0 H ASN A 114 17.458 15.111 3.559 1.00 0.00 H new ATOM 0 HA ASN A 114 14.922 14.166 3.547 1.00 0.00 H new ATOM 0 HB2 ASN A 114 16.763 14.988 1.670 1.00 0.00 H new ATOM 0 HB3 ASN A 114 16.639 13.287 1.268 1.00 0.00 H new ATOM 0 HD21 ASN A 114 14.026 14.500 -0.828 1.00 0.00 H new ATOM 0 HD22 ASN A 114 15.766 14.201 -0.745 1.00 0.00 H new ATOM 1747 N LYS A 115 14.890 11.707 4.044 1.00 0.00 N ATOM 1748 CA LYS A 115 14.764 10.287 4.338 1.00 0.00 C ATOM 1749 C LYS A 115 14.717 9.536 3.022 1.00 0.00 C ATOM 1750 O LYS A 115 13.645 9.193 2.534 1.00 0.00 O ATOM 1751 CB LYS A 115 13.527 10.022 5.224 1.00 0.00 C ATOM 1752 CG LYS A 115 13.932 9.684 6.653 1.00 0.00 C ATOM 1753 CD LYS A 115 13.057 10.301 7.724 1.00 0.00 C ATOM 1754 CE LYS A 115 13.354 11.793 7.798 1.00 0.00 C ATOM 1755 NZ LYS A 115 12.304 12.604 7.168 1.00 0.00 N ATOM 0 H LYS A 115 14.094 12.252 4.375 1.00 0.00 H new ATOM 0 HA LYS A 115 15.622 9.932 4.909 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.882 10.901 5.225 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.946 9.201 4.805 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.919 8.601 6.773 1.00 0.00 H new ATOM 0 HG3 LYS A 115 14.960 10.010 6.811 1.00 0.00 H new ATOM 0 HD2 LYS A 115 12.005 10.136 7.493 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.250 9.829 8.688 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.460 12.088 8.842 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.308 11.996 7.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.738 13.292 6.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.660 11.985 6.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.769 13.110 7.902 1.00 0.00 H new ATOM 1769 N VAL A 116 15.877 9.322 2.418 1.00 0.00 N ATOM 1770 CA VAL A 116 16.036 8.658 1.142 1.00 0.00 C ATOM 1771 C VAL A 116 15.881 7.180 1.438 1.00 0.00 C ATOM 1772 O VAL A 116 16.857 6.444 1.520 1.00 0.00 O ATOM 1773 CB VAL A 116 17.377 9.028 0.478 1.00 0.00 C ATOM 1774 CG1 VAL A 116 17.792 8.048 -0.622 1.00 0.00 C ATOM 1775 CG2 VAL A 116 17.356 10.451 -0.104 1.00 0.00 C ATOM 0 H VAL A 116 16.765 9.619 2.823 1.00 0.00 H new ATOM 0 HA VAL A 116 15.291 8.971 0.410 1.00 0.00 H new ATOM 0 HB VAL A 116 18.114 8.974 1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 116 18.744 8.363 -1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 116 17.898 7.049 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 116 17.031 8.033 -1.402 1.00 0.00 H new ATOM 0 HG21 VAL A 116 18.320 10.671 -0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 116 16.571 10.525 -0.857 1.00 0.00 H new ATOM 0 HG23 VAL A 116 17.162 11.168 0.694 1.00 0.00 H new ATOM 1785 N PHE A 117 14.645 6.779 1.704 1.00 0.00 N ATOM 1786 CA PHE A 117 14.258 5.416 1.961 1.00 0.00 C ATOM 1787 C PHE A 117 14.891 4.512 0.906 1.00 0.00 C ATOM 1788 O PHE A 117 14.564 4.582 -0.281 1.00 0.00 O ATOM 1789 CB PHE A 117 12.732 5.329 1.945 1.00 0.00 C ATOM 1790 CG PHE A 117 12.235 3.936 1.723 1.00 0.00 C ATOM 1791 CD1 PHE A 117 12.313 3.015 2.769 1.00 0.00 C ATOM 1792 CD2 PHE A 117 11.788 3.543 0.452 1.00 0.00 C ATOM 1793 CE1 PHE A 117 11.910 1.691 2.561 1.00 0.00 C ATOM 1794 CE2 PHE A 117 11.382 2.221 0.239 1.00 0.00 C ATOM 1795 CZ PHE A 117 11.465 1.301 1.291 1.00 0.00 C ATOM 0 H PHE A 117 13.859 7.428 1.746 1.00 0.00 H new ATOM 0 HA PHE A 117 14.608 5.085 2.939 1.00 0.00 H new ATOM 0 HB2 PHE A 117 12.341 5.703 2.891 1.00 0.00 H new ATOM 0 HB3 PHE A 117 12.343 5.978 1.160 1.00 0.00 H new ATOM 0 HD1 PHE A 117 12.683 3.323 3.736 1.00 0.00 H new ATOM 0 HD2 PHE A 117 11.758 4.257 -0.357 1.00 0.00 H new ATOM 0 HE1 PHE A 117 11.942 0.977 3.371 1.00 0.00 H new ATOM 0 HE2 PHE A 117 11.009 1.914 -0.727 1.00 0.00 H new ATOM 0 HZ PHE A 117 11.181 0.273 1.121 1.00 0.00 H new ATOM 1805 N CYS A 118 15.885 3.736 1.322 1.00 0.00 N ATOM 1806 CA CYS A 118 16.565 2.825 0.435 1.00 0.00 C ATOM 1807 C CYS A 118 15.782 1.526 0.322 1.00 0.00 C ATOM 1808 O CYS A 118 15.458 1.053 -0.768 1.00 0.00 O ATOM 1809 CB CYS A 118 17.986 2.607 0.942 1.00 0.00 C ATOM 1810 SG CYS A 118 19.174 2.831 -0.365 1.00 0.00 S ATOM 0 H CYS A 118 16.234 3.727 2.280 1.00 0.00 H new ATOM 0 HA CYS A 118 16.627 3.245 -0.569 1.00 0.00 H new ATOM 0 HB2 CYS A 118 18.197 3.304 1.753 1.00 0.00 H new ATOM 0 HB3 CYS A 118 18.078 1.602 1.353 1.00 0.00 H new ATOM 1815 N GLY A 119 15.489 0.958 1.485 1.00 0.00 N ATOM 1816 CA GLY A 119 14.742 -0.265 1.594 1.00 0.00 C ATOM 1817 C GLY A 119 14.633 -0.689 3.039 1.00 0.00 C ATOM 1818 O GLY A 119 14.536 0.139 3.946 1.00 0.00 O ATOM 0 H GLY A 119 15.772 1.348 2.384 1.00 0.00 H new ATOM 0 HA2 GLY A 119 13.746 -0.129 1.172 1.00 0.00 H new ATOM 0 HA3 GLY A 119 15.229 -1.049 1.014 1.00 0.00 H new ATOM 1822 N ILE A 120 14.632 -1.993 3.260 1.00 0.00 N ATOM 1823 CA ILE A 120 14.470 -2.525 4.603 1.00 0.00 C ATOM 1824 C ILE A 120 15.626 -3.461 4.845 1.00 0.00 C ATOM 1825 O ILE A 120 16.106 -4.102 3.921 1.00 0.00 O ATOM 1826 CB ILE A 120 13.111 -3.206 4.761 1.00 0.00 C ATOM 1827 CG1 ILE A 120 11.956 -2.375 4.176 1.00 0.00 C ATOM 1828 CG2 ILE A 120 12.860 -3.578 6.232 1.00 0.00 C ATOM 1829 CD1 ILE A 120 11.165 -1.560 5.176 1.00 0.00 C ATOM 0 H ILE A 120 14.741 -2.699 2.532 1.00 0.00 H new ATOM 0 HA ILE A 120 14.482 -1.732 5.350 1.00 0.00 H new ATOM 0 HB ILE A 120 13.142 -4.126 4.177 1.00 0.00 H new ATOM 0 HG12 ILE A 120 12.363 -1.699 3.424 1.00 0.00 H new ATOM 0 HG13 ILE A 120 11.271 -3.049 3.661 1.00 0.00 H new ATOM 0 HG21 ILE A 120 11.888 -4.062 6.324 1.00 0.00 H new ATOM 0 HG22 ILE A 120 13.639 -4.261 6.573 1.00 0.00 H new ATOM 0 HG23 ILE A 120 12.876 -2.676 6.843 1.00 0.00 H new ATOM 0 HD11 ILE A 120 10.377 -1.014 4.658 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.720 -2.225 5.916 1.00 0.00 H new ATOM 0 HD13 ILE A 120 11.828 -0.854 5.675 1.00 0.00 H new ATOM 1841 N ILE A 121 16.098 -3.547 6.070 1.00 0.00 N ATOM 1842 CA ILE A 121 17.221 -4.398 6.405 1.00 0.00 C ATOM 1843 C ILE A 121 16.870 -5.194 7.646 1.00 0.00 C ATOM 1844 O ILE A 121 16.118 -4.723 8.496 1.00 0.00 O ATOM 1845 CB ILE A 121 18.505 -3.569 6.587 1.00 0.00 C ATOM 1846 CG1 ILE A 121 18.554 -2.887 7.967 1.00 0.00 C ATOM 1847 CG2 ILE A 121 18.706 -2.570 5.432 1.00 0.00 C ATOM 1848 CD1 ILE A 121 19.891 -2.208 8.211 1.00 0.00 C ATOM 0 H ILE A 121 15.715 -3.030 6.861 1.00 0.00 H new ATOM 0 HA ILE A 121 17.421 -5.093 5.589 1.00 0.00 H new ATOM 0 HB ILE A 121 19.346 -4.261 6.552 1.00 0.00 H new ATOM 0 HG12 ILE A 121 17.754 -2.151 8.038 1.00 0.00 H new ATOM 0 HG13 ILE A 121 18.375 -3.628 8.746 1.00 0.00 H new ATOM 0 HG21 ILE A 121 19.623 -2.003 5.596 1.00 0.00 H new ATOM 0 HG22 ILE A 121 18.779 -3.113 4.490 1.00 0.00 H new ATOM 0 HG23 ILE A 121 17.859 -1.885 5.391 1.00 0.00 H new ATOM 0 HD11 ILE A 121 19.886 -1.738 9.195 1.00 0.00 H new ATOM 0 HD12 ILE A 121 20.689 -2.949 8.166 1.00 0.00 H new ATOM 0 HD13 ILE A 121 20.058 -1.449 7.447 1.00 0.00 H new ATOM 1860 N ALA A 122 17.448 -6.377 7.791 1.00 0.00 N ATOM 1861 CA ALA A 122 17.227 -7.228 8.957 1.00 0.00 C ATOM 1862 C ALA A 122 18.117 -8.465 8.903 1.00 0.00 C ATOM 1863 O ALA A 122 18.431 -8.953 7.818 1.00 0.00 O ATOM 1864 CB ALA A 122 15.761 -7.656 9.012 1.00 0.00 C ATOM 0 H ALA A 122 18.086 -6.777 7.103 1.00 0.00 H new ATOM 0 HA ALA A 122 17.478 -6.658 9.851 1.00 0.00 H new ATOM 0 HB1 ALA A 122 15.600 -8.291 9.883 1.00 0.00 H new ATOM 0 HB2 ALA A 122 15.127 -6.773 9.084 1.00 0.00 H new ATOM 0 HB3 ALA A 122 15.510 -8.210 8.108 1.00 0.00 H new ATOM 1870 N HIS A 123 18.506 -8.975 10.070 1.00 0.00 N ATOM 1871 CA HIS A 123 19.408 -10.115 10.164 1.00 0.00 C ATOM 1872 C HIS A 123 18.586 -11.392 10.179 1.00 0.00 C ATOM 1873 O HIS A 123 18.074 -11.785 11.216 1.00 0.00 O ATOM 1874 CB HIS A 123 20.307 -10.036 11.415 1.00 0.00 C ATOM 1875 CG HIS A 123 20.804 -8.660 11.775 1.00 0.00 C ATOM 1876 ND1 HIS A 123 22.095 -8.213 11.615 1.00 0.00 N ATOM 1877 CD2 HIS A 123 20.057 -7.632 12.286 1.00 0.00 C ATOM 1878 CE1 HIS A 123 22.137 -6.930 12.018 1.00 0.00 C ATOM 1879 NE2 HIS A 123 20.904 -6.551 12.411 1.00 0.00 N ATOM 0 H HIS A 123 18.204 -8.609 10.973 1.00 0.00 H new ATOM 0 HA HIS A 123 20.070 -10.107 9.298 1.00 0.00 H new ATOM 0 HB2 HIS A 123 19.753 -10.436 12.264 1.00 0.00 H new ATOM 0 HB3 HIS A 123 21.169 -10.685 11.262 1.00 0.00 H new ATOM 0 HD2 HIS A 123 19.008 -7.662 12.541 1.00 0.00 H new ATOM 0 HE1 HIS A 123 23.017 -6.304 12.026 1.00 0.00 H new ATOM 0 HE2 HIS A 123 20.642 -5.623 12.744 1.00 0.00 H new ATOM 1888 N THR A 124 18.438 -12.011 9.024 1.00 0.00 N ATOM 1889 CA THR A 124 17.632 -13.229 8.827 1.00 0.00 C ATOM 1890 C THR A 124 18.542 -14.443 8.758 1.00 0.00 C ATOM 1891 O THR A 124 18.465 -15.262 7.850 1.00 0.00 O ATOM 1892 CB THR A 124 16.818 -13.106 7.550 1.00 0.00 C ATOM 1893 OG1 THR A 124 17.660 -12.520 6.592 1.00 0.00 O ATOM 1894 CG2 THR A 124 15.659 -12.162 7.753 1.00 0.00 C ATOM 0 H THR A 124 18.881 -11.683 8.166 1.00 0.00 H new ATOM 0 HA THR A 124 16.949 -13.350 9.668 1.00 0.00 H new ATOM 0 HB THR A 124 16.444 -14.086 7.252 1.00 0.00 H new ATOM 0 HG1 THR A 124 18.414 -13.119 6.409 1.00 0.00 H new ATOM 0 HG21 THR A 124 15.086 -12.085 6.829 1.00 0.00 H new ATOM 0 HG22 THR A 124 15.016 -12.541 8.548 1.00 0.00 H new ATOM 0 HG23 THR A 124 16.036 -11.177 8.029 1.00 0.00 H new ATOM 1902 N LYS A 125 19.477 -14.492 9.700 1.00 0.00 N ATOM 1903 CA LYS A 125 20.396 -15.612 9.866 1.00 0.00 C ATOM 1904 C LYS A 125 20.062 -16.429 11.102 1.00 0.00 C ATOM 1905 O LYS A 125 20.392 -17.601 11.133 1.00 0.00 O ATOM 1906 CB LYS A 125 21.835 -15.093 9.841 1.00 0.00 C ATOM 1907 CG LYS A 125 22.847 -16.236 9.996 1.00 0.00 C ATOM 1908 CD LYS A 125 24.071 -16.011 9.116 1.00 0.00 C ATOM 1909 CE LYS A 125 25.261 -16.823 9.632 1.00 0.00 C ATOM 1910 NZ LYS A 125 26.388 -15.932 9.999 1.00 0.00 N ATOM 0 H LYS A 125 19.620 -13.745 10.379 1.00 0.00 H new ATOM 0 HA LYS A 125 20.286 -16.306 9.033 1.00 0.00 H new ATOM 0 HB2 LYS A 125 22.018 -14.568 8.903 1.00 0.00 H new ATOM 0 HB3 LYS A 125 21.976 -14.369 10.644 1.00 0.00 H new ATOM 0 HG2 LYS A 125 23.155 -16.314 11.039 1.00 0.00 H new ATOM 0 HG3 LYS A 125 22.375 -17.182 9.732 1.00 0.00 H new ATOM 0 HD2 LYS A 125 23.845 -16.299 8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 125 24.326 -14.951 9.102 1.00 0.00 H new ATOM 0 HE2 LYS A 125 24.958 -17.409 10.499 1.00 0.00 H new ATOM 0 HE3 LYS A 125 25.584 -17.529 8.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 27.184 -16.504 10.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 26.689 -15.391 9.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 26.082 -15.275 10.745 1.00 0.00 H new ATOM 1924 N GLU A 126 19.403 -15.809 12.081 1.00 0.00 N ATOM 1925 CA GLU A 126 18.970 -16.458 13.311 1.00 0.00 C ATOM 1926 C GLU A 126 18.117 -15.485 14.141 1.00 0.00 C ATOM 1927 O GLU A 126 16.896 -15.452 14.056 1.00 0.00 O ATOM 1928 CB GLU A 126 20.209 -17.000 14.065 1.00 0.00 C ATOM 1929 CG GLU A 126 20.039 -18.481 14.408 1.00 0.00 C ATOM 1930 CD GLU A 126 19.038 -18.708 15.550 1.00 0.00 C ATOM 1931 OE1 GLU A 126 17.907 -18.186 15.432 1.00 0.00 O ATOM 1932 OE2 GLU A 126 19.420 -19.406 16.512 1.00 0.00 O ATOM 0 H GLU A 126 19.152 -14.821 12.037 1.00 0.00 H new ATOM 0 HA GLU A 126 18.332 -17.315 13.096 1.00 0.00 H new ATOM 0 HB2 GLU A 126 21.100 -16.865 13.452 1.00 0.00 H new ATOM 0 HB3 GLU A 126 20.362 -16.427 14.979 1.00 0.00 H new ATOM 0 HG2 GLU A 126 19.703 -19.020 13.522 1.00 0.00 H new ATOM 0 HG3 GLU A 126 21.006 -18.899 14.688 1.00 0.00 H new ATOM 1939 N ASN A 127 18.795 -14.553 14.806 1.00 0.00 N ATOM 1940 CA ASN A 127 18.222 -13.560 15.705 1.00 0.00 C ATOM 1941 C ASN A 127 18.919 -12.213 15.526 1.00 0.00 C ATOM 1942 O ASN A 127 18.300 -11.159 15.379 1.00 0.00 O ATOM 1943 CB ASN A 127 18.331 -14.059 17.161 1.00 0.00 C ATOM 1944 CG ASN A 127 19.601 -14.857 17.436 1.00 0.00 C ATOM 1945 OD1 ASN A 127 19.686 -16.060 17.368 1.00 0.00 O ATOM 1946 ND2 ASN A 127 20.687 -14.186 17.724 1.00 0.00 N ATOM 0 H ASN A 127 19.808 -14.467 14.727 1.00 0.00 H new ATOM 0 HA ASN A 127 17.168 -13.419 15.465 1.00 0.00 H new ATOM 0 HB2 ASN A 127 18.297 -13.202 17.834 1.00 0.00 H new ATOM 0 HB3 ASN A 127 17.465 -14.679 17.390 1.00 0.00 H new ATOM 0 HD21 ASN A 127 21.565 -14.680 17.882 1.00 0.00 H new ATOM 0 HD22 ASN A 127 20.655 -13.169 17.790 1.00 0.00 H new ATOM 1953 N GLN A 128 20.250 -12.260 15.511 1.00 0.00 N ATOM 1954 CA GLN A 128 21.120 -11.112 15.400 1.00 0.00 C ATOM 1955 C GLN A 128 22.499 -11.576 14.923 1.00 0.00 C ATOM 1956 O GLN A 128 23.412 -11.795 15.708 1.00 0.00 O ATOM 1957 CB GLN A 128 21.131 -10.332 16.728 1.00 0.00 C ATOM 1958 CG GLN A 128 22.340 -9.391 16.831 1.00 0.00 C ATOM 1959 CD GLN A 128 22.109 -8.099 17.582 1.00 0.00 C ATOM 1960 OE1 GLN A 128 21.058 -7.471 17.551 1.00 0.00 O ATOM 1961 NE2 GLN A 128 23.159 -7.609 18.193 1.00 0.00 N ATOM 0 H GLN A 128 20.763 -13.139 15.579 1.00 0.00 H new ATOM 0 HA GLN A 128 20.756 -10.407 14.652 1.00 0.00 H new ATOM 0 HB2 GLN A 128 20.212 -9.753 16.816 1.00 0.00 H new ATOM 0 HB3 GLN A 128 21.146 -11.035 17.561 1.00 0.00 H new ATOM 0 HG2 GLN A 128 23.155 -9.929 17.315 1.00 0.00 H new ATOM 0 HG3 GLN A 128 22.674 -9.148 15.822 1.00 0.00 H new ATOM 0 HE21 GLN A 128 24.030 -8.139 18.214 1.00 0.00 H new ATOM 0 HE22 GLN A 128 23.105 -6.698 18.648 1.00 0.00 H new ATOM 1970 N GLY A 129 22.642 -11.756 13.613 1.00 0.00 N ATOM 1971 CA GLY A 129 23.932 -12.095 13.022 1.00 0.00 C ATOM 1972 C GLY A 129 24.314 -11.076 11.964 1.00 0.00 C ATOM 1973 O GLY A 129 24.561 -9.903 12.243 1.00 0.00 O ATOM 0 H GLY A 129 21.880 -11.673 12.940 1.00 0.00 H new ATOM 0 HA2 GLY A 129 24.697 -12.127 13.798 1.00 0.00 H new ATOM 0 HA3 GLY A 129 23.886 -13.089 12.578 1.00 0.00 H new ATOM 1977 N GLU A 130 24.268 -11.494 10.711 1.00 0.00 N ATOM 1978 CA GLU A 130 24.609 -10.631 9.589 1.00 0.00 C ATOM 1979 C GLU A 130 23.401 -9.848 9.113 1.00 0.00 C ATOM 1980 O GLU A 130 22.290 -10.370 9.101 1.00 0.00 O ATOM 1981 CB GLU A 130 25.142 -11.474 8.443 1.00 0.00 C ATOM 1982 CG GLU A 130 26.635 -11.198 8.290 1.00 0.00 C ATOM 1983 CD GLU A 130 27.209 -12.040 7.153 1.00 0.00 C ATOM 1984 OE1 GLU A 130 26.476 -12.218 6.157 1.00 0.00 O ATOM 1985 OE2 GLU A 130 28.325 -12.561 7.353 1.00 0.00 O ATOM 0 H GLU A 130 23.994 -12.439 10.441 1.00 0.00 H new ATOM 0 HA GLU A 130 25.370 -9.925 9.922 1.00 0.00 H new ATOM 0 HB2 GLU A 130 24.971 -12.532 8.640 1.00 0.00 H new ATOM 0 HB3 GLU A 130 24.616 -11.233 7.519 1.00 0.00 H new ATOM 0 HG2 GLU A 130 26.798 -10.139 8.088 1.00 0.00 H new ATOM 0 HG3 GLU A 130 27.153 -11.428 9.221 1.00 0.00 H new ATOM 1992 N LEU A 131 23.607 -8.586 8.745 1.00 0.00 N ATOM 1993 CA LEU A 131 22.542 -7.748 8.226 1.00 0.00 C ATOM 1994 C LEU A 131 22.518 -7.784 6.707 1.00 0.00 C ATOM 1995 O LEU A 131 23.560 -7.770 6.069 1.00 0.00 O ATOM 1996 CB LEU A 131 22.736 -6.320 8.742 1.00 0.00 C ATOM 1997 CG LEU A 131 21.476 -5.439 8.762 1.00 0.00 C ATOM 1998 CD1 LEU A 131 20.229 -6.193 9.159 1.00 0.00 C ATOM 1999 CD2 LEU A 131 21.707 -4.274 9.724 1.00 0.00 C ATOM 0 H LEU A 131 24.514 -8.122 8.800 1.00 0.00 H new ATOM 0 HA LEU A 131 21.580 -8.126 8.573 1.00 0.00 H new ATOM 0 HB2 LEU A 131 23.137 -6.371 9.754 1.00 0.00 H new ATOM 0 HB3 LEU A 131 23.489 -5.830 8.125 1.00 0.00 H new ATOM 0 HG LEU A 131 21.309 -5.081 7.746 1.00 0.00 H new ATOM 0 HD11 LEU A 131 19.376 -5.514 9.153 1.00 0.00 H new ATOM 0 HD12 LEU A 131 20.053 -7.003 8.451 1.00 0.00 H new ATOM 0 HD13 LEU A 131 20.357 -6.607 10.159 1.00 0.00 H new ATOM 0 HD21 LEU A 131 20.820 -3.641 9.748 1.00 0.00 H new ATOM 0 HD22 LEU A 131 21.903 -4.661 10.724 1.00 0.00 H new ATOM 0 HD23 LEU A 131 22.562 -3.688 9.387 1.00 0.00 H new ATOM 2011 N LYS A 132 21.319 -7.768 6.144 1.00 0.00 N ATOM 2012 CA LYS A 132 21.083 -7.805 4.707 1.00 0.00 C ATOM 2013 C LYS A 132 19.850 -6.992 4.373 1.00 0.00 C ATOM 2014 O LYS A 132 19.086 -6.641 5.277 1.00 0.00 O ATOM 2015 CB LYS A 132 20.961 -9.261 4.240 1.00 0.00 C ATOM 2016 CG LYS A 132 20.053 -10.136 5.125 1.00 0.00 C ATOM 2017 CD LYS A 132 19.004 -10.879 4.294 1.00 0.00 C ATOM 2018 CE LYS A 132 17.699 -10.056 4.228 1.00 0.00 C ATOM 2019 NZ LYS A 132 16.867 -10.196 5.446 1.00 0.00 N ATOM 0 H LYS A 132 20.458 -7.728 6.689 1.00 0.00 H new ATOM 0 HA LYS A 132 21.925 -7.360 4.176 1.00 0.00 H new ATOM 0 HB2 LYS A 132 20.575 -9.272 3.221 1.00 0.00 H new ATOM 0 HB3 LYS A 132 21.956 -9.705 4.209 1.00 0.00 H new ATOM 0 HG2 LYS A 132 20.662 -10.856 5.672 1.00 0.00 H new ATOM 0 HG3 LYS A 132 19.555 -9.511 5.866 1.00 0.00 H new ATOM 0 HD2 LYS A 132 19.384 -11.054 3.287 1.00 0.00 H new ATOM 0 HD3 LYS A 132 18.805 -11.856 4.734 1.00 0.00 H new ATOM 0 HE2 LYS A 132 17.946 -9.004 4.081 1.00 0.00 H new ATOM 0 HE3 LYS A 132 17.120 -10.372 3.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.916 -10.524 5.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 17.305 -10.887 6.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 16.795 -9.276 5.925 1.00 0.00 H new ATOM 2033 N LEU A 133 19.657 -6.723 3.091 1.00 0.00 N ATOM 2034 CA LEU A 133 18.504 -5.991 2.601 1.00 0.00 C ATOM 2035 C LEU A 133 17.347 -6.967 2.414 1.00 0.00 C ATOM 2036 O LEU A 133 17.529 -8.086 1.950 1.00 0.00 O ATOM 2037 CB LEU A 133 18.866 -5.262 1.301 1.00 0.00 C ATOM 2038 CG LEU A 133 17.910 -4.102 0.956 1.00 0.00 C ATOM 2039 CD1 LEU A 133 18.221 -2.868 1.793 1.00 0.00 C ATOM 2040 CD2 LEU A 133 18.070 -3.734 -0.517 1.00 0.00 C ATOM 0 H LEU A 133 20.304 -7.010 2.356 1.00 0.00 H new ATOM 0 HA LEU A 133 18.195 -5.231 3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 133 19.881 -4.873 1.383 1.00 0.00 H new ATOM 0 HB3 LEU A 133 18.865 -5.979 0.480 1.00 0.00 H new ATOM 0 HG LEU A 133 16.892 -4.430 1.166 1.00 0.00 H new ATOM 0 HD11 LEU A 133 17.532 -2.066 1.529 1.00 0.00 H new ATOM 0 HD12 LEU A 133 18.110 -3.108 2.850 1.00 0.00 H new ATOM 0 HD13 LEU A 133 19.244 -2.546 1.600 1.00 0.00 H new ATOM 0 HD21 LEU A 133 17.395 -2.914 -0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 133 19.098 -3.426 -0.705 1.00 0.00 H new ATOM 0 HD23 LEU A 133 17.831 -4.599 -1.136 1.00 0.00 H new ATOM 2052 N CYS A 134 16.152 -6.570 2.812 1.00 0.00 N ATOM 2053 CA CYS A 134 14.923 -7.308 2.608 1.00 0.00 C ATOM 2054 C CYS A 134 14.543 -7.281 1.133 1.00 0.00 C ATOM 2055 O CYS A 134 15.220 -6.708 0.279 1.00 0.00 O ATOM 2056 CB CYS A 134 13.843 -6.713 3.502 1.00 0.00 C ATOM 2057 SG CYS A 134 14.415 -6.586 5.201 1.00 0.00 S ATOM 0 H CYS A 134 16.008 -5.689 3.306 1.00 0.00 H new ATOM 0 HA CYS A 134 15.048 -8.355 2.882 1.00 0.00 H new ATOM 0 HB2 CYS A 134 13.563 -5.726 3.134 1.00 0.00 H new ATOM 0 HB3 CYS A 134 12.948 -7.334 3.461 1.00 0.00 H new ATOM 2062 N SER A 135 13.420 -7.902 0.823 1.00 0.00 N ATOM 2063 CA SER A 135 12.935 -8.004 -0.540 1.00 0.00 C ATOM 2064 C SER A 135 11.454 -8.316 -0.412 1.00 0.00 C ATOM 2065 O SER A 135 11.063 -9.402 -0.008 1.00 0.00 O ATOM 2066 CB SER A 135 13.783 -9.009 -1.348 1.00 0.00 C ATOM 2067 OG SER A 135 13.466 -10.375 -1.205 1.00 0.00 O ATOM 0 H SER A 135 12.817 -8.351 1.512 1.00 0.00 H new ATOM 0 HA SER A 135 13.041 -7.089 -1.123 1.00 0.00 H new ATOM 0 HB2 SER A 135 13.700 -8.751 -2.404 1.00 0.00 H new ATOM 0 HB3 SER A 135 14.828 -8.873 -1.068 1.00 0.00 H new ATOM 0 HG SER A 135 12.666 -10.468 -0.647 1.00 0.00 H new ATOM 2073 N HIS A 136 10.628 -7.281 -0.571 1.00 0.00 N ATOM 2074 CA HIS A 136 9.181 -7.452 -0.731 1.00 0.00 C ATOM 2075 C HIS A 136 8.832 -8.590 -1.678 1.00 0.00 C ATOM 2076 O HIS A 136 9.517 -8.666 -2.711 1.00 0.00 O ATOM 2077 CB HIS A 136 8.534 -6.167 -1.265 1.00 0.00 C ATOM 2078 CG HIS A 136 9.410 -5.305 -2.136 1.00 0.00 C ATOM 2079 ND1 HIS A 136 10.346 -5.776 -3.018 1.00 0.00 N ATOM 2080 CD2 HIS A 136 9.465 -3.943 -2.136 1.00 0.00 C ATOM 2081 CE1 HIS A 136 10.970 -4.703 -3.553 1.00 0.00 C ATOM 2082 NE2 HIS A 136 10.427 -3.573 -3.045 1.00 0.00 N ATOM 2083 OXT HIS A 136 7.819 -9.259 -1.400 1.00 0.00 O ATOM 0 H HIS A 136 10.938 -6.309 -0.593 1.00 0.00 H new ATOM 0 HA HIS A 136 8.794 -7.689 0.260 1.00 0.00 H new ATOM 0 HB2 HIS A 136 7.645 -6.439 -1.833 1.00 0.00 H new ATOM 0 HB3 HIS A 136 8.199 -5.571 -0.416 1.00 0.00 H new ATOM 0 HD1 HIS A 136 10.537 -6.755 -3.232 1.00 0.00 H new ATOM 0 HD2 HIS A 136 8.864 -3.278 -1.533 1.00 0.00 H new ATOM 0 HE1 HIS A 136 11.775 -4.742 -4.272 1.00 0.00 H new TER 2092 HIS A 136