USER MOD reduce.3.24.130724 H: found=0, std=0, add=1748, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1742 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 Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.0678 X(o=-0.068,f=-0.28) USER MOD Single : A 6 TYR OH : rot -93:sc= 0.0585 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -0.49 X(o=-0.49,f=-0.22) USER MOD Single : A 19 GLN : amide:sc=-0.00387 K(o=-0.0039,f=-1) USER MOD Single : A 21 TYR OH : rot 180:sc= -2.12! USER MOD Single : A 26 LYS NZ :NH3+ -164:sc= -0.48 (180deg=-1.05) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HD1:sc= -3.18! X(o=-3.2!,f=-3.1) USER MOD Single : A 37 LYS NZ :NH3+ 157:sc= -0.0619 (180deg=-0.29) USER MOD Single : A 39 TYR OH : rot 180:sc= -3.66! USER MOD Single : A 40 HIS : no HD1:sc= -0.833 K(o=-0.83,f=-2.1!) USER MOD Single : A 42 ASN : amide:sc= -1.46 K(o=-1.5,f=-5.9!) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.219 USER MOD Single : A 57 GLN : amide:sc= -1.35 K(o=-1.3,f=-4.6!) USER MOD Single : A 58 TYR OH : rot 171:sc= -9.24! USER MOD Single : A 59 SER OG : rot 70:sc= -0.939 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -6.41! C(o=-6.4!,f=-7.9!) USER MOD Single : A 67 GLN : amide:sc= -1.06 X(o=-1.1,f=-0.74) USER MOD Single : A 68 HIS : no HE2:sc= -0.0891 K(o=-0.089,f=-1.6) USER MOD Single : A 69 ASN : amide:sc= -0.281 K(o=-0.28,f=-3.9!) USER MOD Single : A 73 SER OG : rot 180:sc= 0.00678 USER MOD Single : A 81 GLN : amide:sc= -1.86! C(o=-1.9!,f=-6.5!) USER MOD Single : A 90 TYR OH : rot 180:sc= -1.32 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 153:sc= -0.146 (180deg=-1.29) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.162 K(o=-0.16,f=-2.5!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -2.15! C(o=-2.2!,f=-8.2!) USER MOD Single : A 104 MET CE :methyl -133:sc= -15.8! (180deg=-27.1!) USER MOD Single : A 108 SER OG : rot 39:sc= -0.756! USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 130:sc= -3.72! USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 5 ASN : amide:sc= -0.043 X(o=-0.043,f=-0.32) USER MOD Single : B 6 TYR OH : rot -93:sc= 0.0527 USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 11 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 ASN : amide:sc= -0.499 X(o=-0.5,f=-0.22) USER MOD Single : B 19 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : B 21 TYR OH : rot 180:sc= -2.11! USER MOD Single : B 26 LYS NZ :NH3+ -156:sc= -0.111 (180deg=-0.781) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 HIS : no HE2:sc= -3.21! X(o=-3.2!,f=-3.4) USER MOD Single : B 37 LYS NZ :NH3+ -143:sc=-0.00248 (180deg=-0.138) USER MOD Single : B 39 TYR OH : rot 178:sc= -3.42! USER MOD Single : B 40 HIS : no HD1:sc= -0.893 K(o=-0.89,f=-2!) USER MOD Single : B 42 ASN : amide:sc= -1.3 K(o=-1.3,f=-5.9!) USER MOD Single : B 50 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot 180:sc= 0 USER MOD Single : B 56 THR OG1 : rot 180:sc= 0.236 USER MOD Single : B 57 GLN : amide:sc= -1.61 K(o=-1.6,f=-4.8!) USER MOD Single : B 58 TYR OH : rot 165:sc= -9.32! USER MOD Single : B 59 SER OG : rot -179:sc= -0.814 USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -6.24! C(o=-6.2!,f=-8.1!) USER MOD Single : B 67 GLN : amide:sc= -1.05 X(o=-1,f=-0.67) USER MOD Single : B 68 HIS : no HE2:sc= -0.117 K(o=-0.12,f=-1.7) USER MOD Single : B 69 ASN : amide:sc= -0.286 K(o=-0.29,f=-3.9!) USER MOD Single : B 73 SER OG : rot 180:sc= 0.0248 USER MOD Single : B 81 GLN : amide:sc= -1.62! C(o=-1.6!,f=-6.2!) USER MOD Single : B 90 TYR OH : rot 180:sc= -1.39 USER MOD Single : B 91 TYR OH : rot 180:sc= 0 USER MOD Single : B 95 LYS NZ :NH3+ 154:sc= -0.12 (180deg=-1.07) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 100 GLN : amide:sc= -0.202 K(o=-0.2,f=-2.5!) USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 103 ASN : amide:sc= -2.17! C(o=-2.2!,f=-8.1!) USER MOD Single : B 104 MET CE :methyl -125:sc= -15.8! (180deg=-27.3!) USER MOD Single : B 108 SER OG : rot 41:sc= -0.746! USER MOD Single : B 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 SER OG : rot 142:sc= -3.67! USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.118 -2.177 -15.303 1.00 0.00 N ATOM 2 CA ALA A 1 8.355 -2.326 -14.486 1.00 0.00 C ATOM 3 C ALA A 1 8.322 -1.330 -13.325 1.00 0.00 C ATOM 4 O ALA A 1 8.688 -0.180 -13.469 1.00 0.00 O ATOM 5 CB ALA A 1 9.579 -2.048 -15.361 1.00 0.00 C ATOM 0 H1 ALA A 1 7.140 -2.854 -16.092 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.285 -2.364 -14.709 1.00 0.00 H new ATOM 0 H3 ALA A 1 7.065 -1.209 -15.679 1.00 0.00 H new ATOM 0 HA ALA A 1 8.411 -3.341 -14.093 1.00 0.00 H new ATOM 0 HB1 ALA A 1 10.485 -2.157 -14.765 1.00 0.00 H new ATOM 0 HB2 ALA A 1 9.603 -2.756 -16.189 1.00 0.00 H new ATOM 0 HB3 ALA A 1 9.523 -1.033 -15.754 1.00 0.00 H new ATOM 13 N LEU A 2 7.884 -1.762 -12.174 1.00 0.00 N ATOM 14 CA LEU A 2 7.827 -0.840 -11.004 1.00 0.00 C ATOM 15 C LEU A 2 8.878 -1.250 -9.978 1.00 0.00 C ATOM 16 O LEU A 2 8.585 -1.448 -8.815 1.00 0.00 O ATOM 17 CB LEU A 2 6.446 -0.916 -10.363 1.00 0.00 C ATOM 18 CG LEU A 2 5.408 -0.304 -11.305 1.00 0.00 C ATOM 19 CD1 LEU A 2 4.036 -0.319 -10.631 1.00 0.00 C ATOM 20 CD2 LEU A 2 5.802 1.140 -11.624 1.00 0.00 C ATOM 0 H LEU A 2 7.563 -2.713 -11.993 1.00 0.00 H new ATOM 0 HA LEU A 2 8.021 0.179 -11.339 1.00 0.00 H new ATOM 0 HB2 LEU A 2 6.190 -1.954 -10.149 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.446 -0.385 -9.411 1.00 0.00 H new ATOM 0 HG LEU A 2 5.366 -0.884 -12.227 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.296 0.117 -11.302 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.755 -1.347 -10.400 1.00 0.00 H new ATOM 0 HD13 LEU A 2 4.077 0.262 -9.710 1.00 0.00 H new ATOM 0 HD21 LEU A 2 5.064 1.579 -12.295 1.00 0.00 H new ATOM 0 HD22 LEU A 2 5.842 1.719 -10.701 1.00 0.00 H new ATOM 0 HD23 LEU A 2 6.781 1.153 -12.103 1.00 0.00 H new ATOM 32 N ASP A 3 10.099 -1.379 -10.400 1.00 0.00 N ATOM 33 CA ASP A 3 11.177 -1.776 -9.452 1.00 0.00 C ATOM 34 C ASP A 3 12.080 -0.575 -9.176 1.00 0.00 C ATOM 35 O ASP A 3 11.883 0.501 -9.704 1.00 0.00 O ATOM 36 CB ASP A 3 12.011 -2.908 -10.060 1.00 0.00 C ATOM 37 CG ASP A 3 12.030 -2.775 -11.584 1.00 0.00 C ATOM 38 OD1 ASP A 3 11.082 -3.217 -12.210 1.00 0.00 O ATOM 39 OD2 ASP A 3 12.994 -2.233 -12.099 1.00 0.00 O ATOM 0 H ASP A 3 10.401 -1.227 -11.362 1.00 0.00 H new ATOM 0 HA ASP A 3 10.727 -2.119 -8.520 1.00 0.00 H new ATOM 0 HB2 ASP A 3 13.028 -2.873 -9.670 1.00 0.00 H new ATOM 0 HB3 ASP A 3 11.593 -3.874 -9.775 1.00 0.00 H new ATOM 44 N THR A 4 13.068 -0.753 -8.347 1.00 0.00 N ATOM 45 CA THR A 4 13.988 0.373 -8.026 1.00 0.00 C ATOM 46 C THR A 4 15.010 0.542 -9.153 1.00 0.00 C ATOM 47 O THR A 4 15.913 1.351 -9.068 1.00 0.00 O ATOM 48 CB THR A 4 14.707 0.071 -6.709 1.00 0.00 C ATOM 49 OG1 THR A 4 15.858 -0.721 -6.971 1.00 0.00 O ATOM 50 CG2 THR A 4 13.760 -0.689 -5.775 1.00 0.00 C ATOM 0 H THR A 4 13.279 -1.633 -7.876 1.00 0.00 H new ATOM 0 HA THR A 4 13.419 1.297 -7.926 1.00 0.00 H new ATOM 0 HB THR A 4 15.010 1.004 -6.235 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.321 -0.914 -6.129 1.00 0.00 H new ATOM 0 HG21 THR A 4 14.270 -0.905 -4.836 1.00 0.00 H new ATOM 0 HG22 THR A 4 12.878 -0.080 -5.577 1.00 0.00 H new ATOM 0 HG23 THR A 4 13.457 -1.624 -6.246 1.00 0.00 H new ATOM 58 N ASN A 5 14.865 -0.201 -10.216 1.00 0.00 N ATOM 59 CA ASN A 5 15.819 -0.067 -11.351 1.00 0.00 C ATOM 60 C ASN A 5 15.253 0.942 -12.353 1.00 0.00 C ATOM 61 O ASN A 5 15.939 1.838 -12.803 1.00 0.00 O ATOM 62 CB ASN A 5 16.000 -1.424 -12.034 1.00 0.00 C ATOM 63 CG ASN A 5 17.492 -1.723 -12.188 1.00 0.00 C ATOM 64 OD1 ASN A 5 18.266 -0.853 -12.533 1.00 0.00 O ATOM 65 ND2 ASN A 5 17.931 -2.928 -11.945 1.00 0.00 N ATOM 0 H ASN A 5 14.128 -0.894 -10.347 1.00 0.00 H new ATOM 0 HA ASN A 5 16.786 0.277 -10.984 1.00 0.00 H new ATOM 0 HB2 ASN A 5 15.520 -2.206 -11.445 1.00 0.00 H new ATOM 0 HB3 ASN A 5 15.517 -1.419 -13.011 1.00 0.00 H new ATOM 0 HD21 ASN A 5 18.924 -3.139 -12.045 1.00 0.00 H new ATOM 0 HD22 ASN A 5 17.281 -3.659 -11.655 1.00 0.00 H new ATOM 72 N TYR A 6 14.001 0.805 -12.698 1.00 0.00 N ATOM 73 CA TYR A 6 13.380 1.751 -13.660 1.00 0.00 C ATOM 74 C TYR A 6 12.963 3.021 -12.913 1.00 0.00 C ATOM 75 O TYR A 6 12.733 4.056 -13.507 1.00 0.00 O ATOM 76 CB TYR A 6 12.153 1.082 -14.278 1.00 0.00 C ATOM 77 CG TYR A 6 11.281 2.117 -14.947 1.00 0.00 C ATOM 78 CD1 TYR A 6 11.722 2.764 -16.106 1.00 0.00 C ATOM 79 CD2 TYR A 6 10.031 2.426 -14.403 1.00 0.00 C ATOM 80 CE1 TYR A 6 10.910 3.725 -16.722 1.00 0.00 C ATOM 81 CE2 TYR A 6 9.217 3.385 -15.018 1.00 0.00 C ATOM 82 CZ TYR A 6 9.657 4.034 -16.179 1.00 0.00 C ATOM 83 OH TYR A 6 8.856 4.980 -16.785 1.00 0.00 O ATOM 0 H TYR A 6 13.381 0.073 -12.351 1.00 0.00 H new ATOM 0 HA TYR A 6 14.087 2.015 -14.447 1.00 0.00 H new ATOM 0 HB2 TYR A 6 12.465 0.333 -15.005 1.00 0.00 H new ATOM 0 HB3 TYR A 6 11.586 0.561 -13.507 1.00 0.00 H new ATOM 0 HD1 TYR A 6 12.688 2.523 -16.526 1.00 0.00 H new ATOM 0 HD2 TYR A 6 9.693 1.925 -13.508 1.00 0.00 H new ATOM 0 HE1 TYR A 6 11.250 4.227 -17.615 1.00 0.00 H new ATOM 0 HE2 TYR A 6 8.251 3.624 -14.598 1.00 0.00 H new ATOM 0 HH TYR A 6 9.020 5.857 -16.379 1.00 0.00 H new ATOM 93 N CYS A 7 12.863 2.947 -11.614 1.00 0.00 N ATOM 94 CA CYS A 7 12.459 4.145 -10.826 1.00 0.00 C ATOM 95 C CYS A 7 13.704 4.951 -10.447 1.00 0.00 C ATOM 96 O CYS A 7 13.614 6.081 -10.010 1.00 0.00 O ATOM 97 CB CYS A 7 11.727 3.693 -9.560 1.00 0.00 C ATOM 98 SG CYS A 7 10.058 3.153 -10.003 1.00 0.00 S ATOM 0 H CYS A 7 13.044 2.107 -11.064 1.00 0.00 H new ATOM 0 HA CYS A 7 11.796 4.771 -11.423 1.00 0.00 H new ATOM 0 HB2 CYS A 7 12.271 2.879 -9.081 1.00 0.00 H new ATOM 0 HB3 CYS A 7 11.679 4.511 -8.841 1.00 0.00 H new ATOM 103 N PHE A 8 14.866 4.383 -10.618 1.00 0.00 N ATOM 104 CA PHE A 8 16.115 5.121 -10.275 1.00 0.00 C ATOM 105 C PHE A 8 16.488 6.062 -11.423 1.00 0.00 C ATOM 106 O PHE A 8 17.463 6.785 -11.352 1.00 0.00 O ATOM 107 CB PHE A 8 17.255 4.124 -10.045 1.00 0.00 C ATOM 108 CG PHE A 8 17.312 3.734 -8.584 1.00 0.00 C ATOM 109 CD1 PHE A 8 16.189 3.906 -7.762 1.00 0.00 C ATOM 110 CD2 PHE A 8 18.492 3.203 -8.053 1.00 0.00 C ATOM 111 CE1 PHE A 8 16.251 3.546 -6.410 1.00 0.00 C ATOM 112 CE2 PHE A 8 18.553 2.843 -6.701 1.00 0.00 C ATOM 113 CZ PHE A 8 17.433 3.014 -5.880 1.00 0.00 C ATOM 0 H PHE A 8 15.005 3.440 -10.980 1.00 0.00 H new ATOM 0 HA PHE A 8 15.951 5.702 -9.367 1.00 0.00 H new ATOM 0 HB2 PHE A 8 17.104 3.238 -10.661 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.204 4.566 -10.349 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.277 4.316 -8.171 1.00 0.00 H new ATOM 0 HD2 PHE A 8 19.357 3.071 -8.686 1.00 0.00 H new ATOM 0 HE1 PHE A 8 15.387 3.679 -5.776 1.00 0.00 H new ATOM 0 HE2 PHE A 8 19.465 2.433 -6.292 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.480 2.736 -4.838 1.00 0.00 H new ATOM 123 N SER A 9 15.723 6.062 -12.479 1.00 0.00 N ATOM 124 CA SER A 9 16.039 6.959 -13.627 1.00 0.00 C ATOM 125 C SER A 9 15.343 8.306 -13.423 1.00 0.00 C ATOM 126 O SER A 9 15.884 9.209 -12.816 1.00 0.00 O ATOM 127 CB SER A 9 15.545 6.319 -14.925 1.00 0.00 C ATOM 128 OG SER A 9 16.403 5.241 -15.274 1.00 0.00 O ATOM 0 H SER A 9 14.893 5.481 -12.597 1.00 0.00 H new ATOM 0 HA SER A 9 17.117 7.111 -13.686 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.523 5.960 -14.801 1.00 0.00 H new ATOM 0 HB3 SER A 9 15.528 7.059 -15.725 1.00 0.00 H new ATOM 0 HG SER A 9 16.088 4.828 -16.105 1.00 0.00 H new ATOM 134 N SER A 10 14.148 8.449 -13.926 1.00 0.00 N ATOM 135 CA SER A 10 13.419 9.737 -13.759 1.00 0.00 C ATOM 136 C SER A 10 12.598 9.692 -12.468 1.00 0.00 C ATOM 137 O SER A 10 12.652 8.736 -11.721 1.00 0.00 O ATOM 138 CB SER A 10 12.486 9.953 -14.951 1.00 0.00 C ATOM 139 OG SER A 10 12.518 11.323 -15.330 1.00 0.00 O ATOM 0 H SER A 10 13.645 7.729 -14.445 1.00 0.00 H new ATOM 0 HA SER A 10 14.135 10.557 -13.706 1.00 0.00 H new ATOM 0 HB2 SER A 10 12.794 9.325 -15.787 1.00 0.00 H new ATOM 0 HB3 SER A 10 11.469 9.660 -14.690 1.00 0.00 H new ATOM 0 HG SER A 10 11.922 11.465 -16.095 1.00 0.00 H new ATOM 145 N THR A 11 11.839 10.719 -12.200 1.00 0.00 N ATOM 146 CA THR A 11 11.019 10.734 -10.959 1.00 0.00 C ATOM 147 C THR A 11 9.678 10.048 -11.223 1.00 0.00 C ATOM 148 O THR A 11 8.921 9.769 -10.314 1.00 0.00 O ATOM 149 CB THR A 11 10.782 12.186 -10.536 1.00 0.00 C ATOM 150 OG1 THR A 11 11.978 12.717 -9.983 1.00 0.00 O ATOM 151 CG2 THR A 11 9.668 12.244 -9.495 1.00 0.00 C ATOM 0 H THR A 11 11.752 11.548 -12.788 1.00 0.00 H new ATOM 0 HA THR A 11 11.542 10.201 -10.164 1.00 0.00 H new ATOM 0 HB THR A 11 10.490 12.774 -11.406 1.00 0.00 H new ATOM 0 HG1 THR A 11 11.829 13.647 -9.713 1.00 0.00 H new ATOM 0 HG21 THR A 11 9.502 13.279 -9.197 1.00 0.00 H new ATOM 0 HG22 THR A 11 8.750 11.838 -9.921 1.00 0.00 H new ATOM 0 HG23 THR A 11 9.954 11.656 -8.623 1.00 0.00 H new ATOM 159 N GLU A 12 9.380 9.776 -12.460 1.00 0.00 N ATOM 160 CA GLU A 12 8.088 9.109 -12.790 1.00 0.00 C ATOM 161 C GLU A 12 6.939 9.871 -12.128 1.00 0.00 C ATOM 162 O GLU A 12 7.150 10.825 -11.404 1.00 0.00 O ATOM 163 CB GLU A 12 8.109 7.669 -12.275 1.00 0.00 C ATOM 164 CG GLU A 12 8.380 6.714 -13.440 1.00 0.00 C ATOM 165 CD GLU A 12 9.738 7.042 -14.063 1.00 0.00 C ATOM 166 OE1 GLU A 12 10.742 6.713 -13.453 1.00 0.00 O ATOM 167 OE2 GLU A 12 9.751 7.616 -15.140 1.00 0.00 O ATOM 0 H GLU A 12 9.976 9.986 -13.261 1.00 0.00 H new ATOM 0 HA GLU A 12 7.947 9.105 -13.871 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.879 7.556 -11.512 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.156 7.426 -11.805 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.369 5.682 -13.089 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.593 6.804 -14.189 1.00 0.00 H new ATOM 174 N LYS A 13 5.723 9.463 -12.371 1.00 0.00 N ATOM 175 CA LYS A 13 4.565 10.170 -11.755 1.00 0.00 C ATOM 176 C LYS A 13 3.571 9.147 -11.203 1.00 0.00 C ATOM 177 O LYS A 13 2.471 9.485 -10.815 1.00 0.00 O ATOM 178 CB LYS A 13 3.873 11.031 -12.813 1.00 0.00 C ATOM 179 CG LYS A 13 3.716 10.225 -14.105 1.00 0.00 C ATOM 180 CD LYS A 13 4.556 10.868 -15.212 1.00 0.00 C ATOM 181 CE LYS A 13 4.063 10.379 -16.574 1.00 0.00 C ATOM 182 NZ LYS A 13 4.876 11.010 -17.652 1.00 0.00 N ATOM 0 H LYS A 13 5.482 8.672 -12.968 1.00 0.00 H new ATOM 0 HA LYS A 13 4.920 10.804 -10.942 1.00 0.00 H new ATOM 0 HB2 LYS A 13 2.896 11.354 -12.452 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.457 11.932 -13.003 1.00 0.00 H new ATOM 0 HG2 LYS A 13 4.034 9.195 -13.945 1.00 0.00 H new ATOM 0 HG3 LYS A 13 2.668 10.193 -14.401 1.00 0.00 H new ATOM 0 HD2 LYS A 13 4.482 11.954 -15.155 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.607 10.612 -15.081 1.00 0.00 H new ATOM 0 HE2 LYS A 13 4.141 9.293 -16.633 1.00 0.00 H new ATOM 0 HE3 LYS A 13 3.010 10.630 -16.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.541 10.678 -18.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 4.780 12.044 -17.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.875 10.749 -17.531 1.00 0.00 H new ATOM 196 N ASN A 14 3.946 7.899 -11.165 1.00 0.00 N ATOM 197 CA ASN A 14 3.014 6.860 -10.640 1.00 0.00 C ATOM 198 C ASN A 14 3.764 5.933 -9.679 1.00 0.00 C ATOM 199 O ASN A 14 4.883 6.197 -9.292 1.00 0.00 O ATOM 200 CB ASN A 14 2.455 6.040 -11.805 1.00 0.00 C ATOM 201 CG ASN A 14 2.321 6.929 -13.043 1.00 0.00 C ATOM 202 OD1 ASN A 14 3.008 6.728 -14.026 1.00 0.00 O ATOM 203 ND2 ASN A 14 1.462 7.911 -13.037 1.00 0.00 N ATOM 0 H ASN A 14 4.855 7.553 -11.474 1.00 0.00 H new ATOM 0 HA ASN A 14 2.195 7.346 -10.109 1.00 0.00 H new ATOM 0 HB2 ASN A 14 3.114 5.198 -12.019 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.484 5.624 -11.537 1.00 0.00 H new ATOM 0 HD21 ASN A 14 1.367 8.510 -13.857 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.886 8.079 -12.212 1.00 0.00 H new ATOM 210 N CYS A 15 3.150 4.846 -9.297 1.00 0.00 N ATOM 211 CA CYS A 15 3.816 3.891 -8.365 1.00 0.00 C ATOM 212 C CYS A 15 5.263 3.669 -8.812 1.00 0.00 C ATOM 213 O CYS A 15 5.544 2.820 -9.636 1.00 0.00 O ATOM 214 CB CYS A 15 3.056 2.561 -8.394 1.00 0.00 C ATOM 215 SG CYS A 15 4.042 1.254 -7.614 1.00 0.00 S ATOM 0 H CYS A 15 2.211 4.577 -9.592 1.00 0.00 H new ATOM 0 HA CYS A 15 3.813 4.294 -7.352 1.00 0.00 H new ATOM 0 HB2 CYS A 15 2.104 2.667 -7.874 1.00 0.00 H new ATOM 0 HB3 CYS A 15 2.827 2.288 -9.424 1.00 0.00 H new ATOM 220 N CYS A 16 6.187 4.419 -8.276 1.00 0.00 N ATOM 221 CA CYS A 16 7.612 4.241 -8.674 1.00 0.00 C ATOM 222 C CYS A 16 8.493 4.237 -7.422 1.00 0.00 C ATOM 223 O CYS A 16 8.521 5.191 -6.669 1.00 0.00 O ATOM 224 CB CYS A 16 8.036 5.389 -9.593 1.00 0.00 C ATOM 225 SG CYS A 16 9.206 4.784 -10.840 1.00 0.00 S ATOM 0 H CYS A 16 6.017 5.146 -7.581 1.00 0.00 H new ATOM 0 HA CYS A 16 7.725 3.295 -9.203 1.00 0.00 H new ATOM 0 HB2 CYS A 16 7.161 5.818 -10.081 1.00 0.00 H new ATOM 0 HB3 CYS A 16 8.496 6.185 -9.007 1.00 0.00 H new ATOM 230 N VAL A 17 9.205 3.170 -7.191 1.00 0.00 N ATOM 231 CA VAL A 17 10.078 3.101 -5.986 1.00 0.00 C ATOM 232 C VAL A 17 11.362 3.900 -6.218 1.00 0.00 C ATOM 233 O VAL A 17 12.173 3.559 -7.054 1.00 0.00 O ATOM 234 CB VAL A 17 10.444 1.644 -5.712 1.00 0.00 C ATOM 235 CG1 VAL A 17 11.374 1.132 -6.806 1.00 0.00 C ATOM 236 CG2 VAL A 17 11.161 1.547 -4.371 1.00 0.00 C ATOM 0 H VAL A 17 9.220 2.341 -7.785 1.00 0.00 H new ATOM 0 HA VAL A 17 9.541 3.521 -5.135 1.00 0.00 H new ATOM 0 HB VAL A 17 9.534 1.044 -5.694 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.633 0.092 -6.606 1.00 0.00 H new ATOM 0 HG12 VAL A 17 10.873 1.203 -7.772 1.00 0.00 H new ATOM 0 HG13 VAL A 17 12.282 1.735 -6.823 1.00 0.00 H new ATOM 0 HG21 VAL A 17 11.423 0.508 -4.173 1.00 0.00 H new ATOM 0 HG22 VAL A 17 12.068 2.151 -4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 17 10.505 1.913 -3.581 1.00 0.00 H new ATOM 246 N ARG A 18 11.569 4.949 -5.473 1.00 0.00 N ATOM 247 CA ARG A 18 12.819 5.743 -5.657 1.00 0.00 C ATOM 248 C ARG A 18 13.832 5.345 -4.583 1.00 0.00 C ATOM 249 O ARG A 18 13.655 4.372 -3.874 1.00 0.00 O ATOM 250 CB ARG A 18 12.539 7.251 -5.560 1.00 0.00 C ATOM 251 CG ARG A 18 11.109 7.505 -5.078 1.00 0.00 C ATOM 252 CD ARG A 18 10.901 9.008 -4.885 1.00 0.00 C ATOM 253 NE ARG A 18 9.509 9.373 -5.270 1.00 0.00 N ATOM 254 CZ ARG A 18 9.145 10.626 -5.290 1.00 0.00 C ATOM 255 NH1 ARG A 18 9.387 11.392 -4.262 1.00 0.00 N ATOM 256 NH2 ARG A 18 8.542 11.114 -6.339 1.00 0.00 N ATOM 0 H ARG A 18 10.935 5.290 -4.751 1.00 0.00 H new ATOM 0 HA ARG A 18 13.218 5.532 -6.649 1.00 0.00 H new ATOM 0 HB2 ARG A 18 13.247 7.714 -4.873 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.688 7.717 -6.534 1.00 0.00 H new ATOM 0 HG2 ARG A 18 10.394 7.117 -5.804 1.00 0.00 H new ATOM 0 HG3 ARG A 18 10.930 6.978 -4.141 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.085 9.280 -3.846 1.00 0.00 H new ATOM 0 HD3 ARG A 18 11.615 9.565 -5.492 1.00 0.00 H new ATOM 0 HE ARG A 18 8.840 8.644 -5.518 1.00 0.00 H new ATOM 0 HH11 ARG A 18 9.861 11.011 -3.443 1.00 0.00 H new ATOM 0 HH12 ARG A 18 9.103 12.371 -4.278 1.00 0.00 H new ATOM 0 HH21 ARG A 18 8.355 10.516 -7.144 1.00 0.00 H new ATOM 0 HH22 ARG A 18 8.258 12.093 -6.354 1.00 0.00 H new ATOM 270 N GLN A 19 14.897 6.089 -4.464 1.00 0.00 N ATOM 271 CA GLN A 19 15.933 5.758 -3.445 1.00 0.00 C ATOM 272 C GLN A 19 15.531 6.333 -2.088 1.00 0.00 C ATOM 273 O GLN A 19 14.981 7.413 -1.996 1.00 0.00 O ATOM 274 CB GLN A 19 17.276 6.352 -3.875 1.00 0.00 C ATOM 275 CG GLN A 19 17.241 7.873 -3.705 1.00 0.00 C ATOM 276 CD GLN A 19 18.602 8.459 -4.084 1.00 0.00 C ATOM 277 OE1 GLN A 19 19.620 7.816 -3.925 1.00 0.00 O ATOM 278 NE2 GLN A 19 18.663 9.664 -4.586 1.00 0.00 N ATOM 0 H GLN A 19 15.095 6.914 -5.030 1.00 0.00 H new ATOM 0 HA GLN A 19 16.021 4.675 -3.361 1.00 0.00 H new ATOM 0 HB2 GLN A 19 18.082 5.927 -3.276 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.482 6.096 -4.914 1.00 0.00 H new ATOM 0 HG2 GLN A 19 16.460 8.302 -4.333 1.00 0.00 H new ATOM 0 HG3 GLN A 19 16.997 8.129 -2.674 1.00 0.00 H new ATOM 0 HE21 GLN A 19 17.808 10.205 -4.720 1.00 0.00 H new ATOM 0 HE22 GLN A 19 19.565 10.064 -4.844 1.00 0.00 H new ATOM 287 N LEU A 20 15.805 5.618 -1.032 1.00 0.00 N ATOM 288 CA LEU A 20 15.444 6.119 0.322 1.00 0.00 C ATOM 289 C LEU A 20 16.470 5.621 1.336 1.00 0.00 C ATOM 290 O LEU A 20 16.119 5.110 2.381 1.00 0.00 O ATOM 291 CB LEU A 20 14.063 5.597 0.711 1.00 0.00 C ATOM 292 CG LEU A 20 13.608 6.265 2.011 1.00 0.00 C ATOM 293 CD1 LEU A 20 13.607 7.783 1.833 1.00 0.00 C ATOM 294 CD2 LEU A 20 12.194 5.796 2.356 1.00 0.00 C ATOM 0 H LEU A 20 16.264 4.707 -1.049 1.00 0.00 H new ATOM 0 HA LEU A 20 15.433 7.209 0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 20 13.348 5.803 -0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 20 14.095 4.515 0.838 1.00 0.00 H new ATOM 0 HG LEU A 20 14.291 5.993 2.816 1.00 0.00 H new ATOM 0 HD11 LEU A 20 13.283 8.258 2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.613 8.121 1.585 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.924 8.054 1.028 1.00 0.00 H new ATOM 0 HD21 LEU A 20 11.869 6.271 3.282 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.513 6.069 1.550 1.00 0.00 H new ATOM 0 HD23 LEU A 20 12.191 4.713 2.483 1.00 0.00 H new ATOM 306 N TYR A 21 17.735 5.759 1.044 1.00 0.00 N ATOM 307 CA TYR A 21 18.760 5.285 2.012 1.00 0.00 C ATOM 308 C TYR A 21 18.366 5.739 3.413 1.00 0.00 C ATOM 309 O TYR A 21 18.013 6.881 3.630 1.00 0.00 O ATOM 310 CB TYR A 21 20.129 5.869 1.670 1.00 0.00 C ATOM 311 CG TYR A 21 21.115 5.472 2.747 1.00 0.00 C ATOM 312 CD1 TYR A 21 21.079 6.100 4.002 1.00 0.00 C ATOM 313 CD2 TYR A 21 22.063 4.477 2.490 1.00 0.00 C ATOM 314 CE1 TYR A 21 21.994 5.730 4.999 1.00 0.00 C ATOM 315 CE2 TYR A 21 22.978 4.108 3.486 1.00 0.00 C ATOM 316 CZ TYR A 21 22.944 4.734 4.739 1.00 0.00 C ATOM 317 OH TYR A 21 23.847 4.369 5.716 1.00 0.00 O ATOM 0 H TYR A 21 18.098 6.175 0.186 1.00 0.00 H new ATOM 0 HA TYR A 21 18.816 4.197 1.964 1.00 0.00 H new ATOM 0 HB2 TYR A 21 20.463 5.502 0.699 1.00 0.00 H new ATOM 0 HB3 TYR A 21 20.068 6.955 1.597 1.00 0.00 H new ATOM 0 HD1 TYR A 21 20.346 6.868 4.200 1.00 0.00 H new ATOM 0 HD2 TYR A 21 22.090 3.993 1.525 1.00 0.00 H new ATOM 0 HE1 TYR A 21 21.966 6.212 5.965 1.00 0.00 H new ATOM 0 HE2 TYR A 21 23.711 3.340 3.287 1.00 0.00 H new ATOM 0 HH TYR A 21 24.434 3.664 5.372 1.00 0.00 H new ATOM 327 N ILE A 22 18.429 4.859 4.365 1.00 0.00 N ATOM 328 CA ILE A 22 18.065 5.245 5.749 1.00 0.00 C ATOM 329 C ILE A 22 19.275 5.040 6.654 1.00 0.00 C ATOM 330 O ILE A 22 19.719 3.930 6.875 1.00 0.00 O ATOM 331 CB ILE A 22 16.903 4.381 6.239 1.00 0.00 C ATOM 332 CG1 ILE A 22 15.745 4.477 5.241 1.00 0.00 C ATOM 333 CG2 ILE A 22 16.440 4.883 7.608 1.00 0.00 C ATOM 334 CD1 ILE A 22 14.486 3.862 5.856 1.00 0.00 C ATOM 0 H ILE A 22 18.717 3.888 4.245 1.00 0.00 H new ATOM 0 HA ILE A 22 17.761 6.292 5.770 1.00 0.00 H new ATOM 0 HB ILE A 22 17.227 3.344 6.323 1.00 0.00 H new ATOM 0 HG12 ILE A 22 15.562 5.519 4.979 1.00 0.00 H new ATOM 0 HG13 ILE A 22 16.003 3.957 4.318 1.00 0.00 H new ATOM 0 HG21 ILE A 22 15.611 4.268 7.960 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.265 4.819 8.317 1.00 0.00 H new ATOM 0 HG23 ILE A 22 16.113 5.919 7.524 1.00 0.00 H new ATOM 0 HD11 ILE A 22 13.663 3.931 5.145 1.00 0.00 H new ATOM 0 HD12 ILE A 22 14.672 2.815 6.095 1.00 0.00 H new ATOM 0 HD13 ILE A 22 14.225 4.401 6.767 1.00 0.00 H new ATOM 346 N ASP A 23 19.811 6.100 7.183 1.00 0.00 N ATOM 347 CA ASP A 23 20.986 5.969 8.072 1.00 0.00 C ATOM 348 C ASP A 23 20.488 5.635 9.475 1.00 0.00 C ATOM 349 O ASP A 23 20.271 6.504 10.284 1.00 0.00 O ATOM 350 CB ASP A 23 21.790 7.276 8.091 1.00 0.00 C ATOM 351 CG ASP A 23 21.339 8.226 6.972 1.00 0.00 C ATOM 352 OD1 ASP A 23 20.312 8.863 7.139 1.00 0.00 O ATOM 353 OD2 ASP A 23 22.033 8.303 5.973 1.00 0.00 O ATOM 0 H ASP A 23 19.482 7.054 7.035 1.00 0.00 H new ATOM 0 HA ASP A 23 21.641 5.177 7.709 1.00 0.00 H new ATOM 0 HB2 ASP A 23 21.669 7.766 9.057 1.00 0.00 H new ATOM 0 HB3 ASP A 23 22.851 7.054 7.977 1.00 0.00 H new ATOM 358 N PHE A 24 20.297 4.365 9.730 1.00 0.00 N ATOM 359 CA PHE A 24 19.794 3.872 11.054 1.00 0.00 C ATOM 360 C PHE A 24 19.713 4.983 12.107 1.00 0.00 C ATOM 361 O PHE A 24 18.656 5.275 12.624 1.00 0.00 O ATOM 362 CB PHE A 24 20.730 2.774 11.561 1.00 0.00 C ATOM 363 CG PHE A 24 20.338 1.457 10.940 1.00 0.00 C ATOM 364 CD1 PHE A 24 19.142 0.837 11.316 1.00 0.00 C ATOM 365 CD2 PHE A 24 21.167 0.859 9.983 1.00 0.00 C ATOM 366 CE1 PHE A 24 18.774 -0.383 10.737 1.00 0.00 C ATOM 367 CE2 PHE A 24 20.800 -0.361 9.405 1.00 0.00 C ATOM 368 CZ PHE A 24 19.603 -0.983 9.781 1.00 0.00 C ATOM 0 H PHE A 24 20.475 3.623 9.053 1.00 0.00 H new ATOM 0 HA PHE A 24 18.784 3.493 10.901 1.00 0.00 H new ATOM 0 HB2 PHE A 24 21.762 3.015 11.308 1.00 0.00 H new ATOM 0 HB3 PHE A 24 20.675 2.707 12.648 1.00 0.00 H new ATOM 0 HD1 PHE A 24 18.502 1.300 12.053 1.00 0.00 H new ATOM 0 HD2 PHE A 24 22.089 1.339 9.691 1.00 0.00 H new ATOM 0 HE1 PHE A 24 17.851 -0.862 11.028 1.00 0.00 H new ATOM 0 HE2 PHE A 24 21.440 -0.823 8.668 1.00 0.00 H new ATOM 0 HZ PHE A 24 19.319 -1.924 9.334 1.00 0.00 H new ATOM 378 N ARG A 25 20.818 5.584 12.451 1.00 0.00 N ATOM 379 CA ARG A 25 20.794 6.643 13.502 1.00 0.00 C ATOM 380 C ARG A 25 20.386 8.005 12.926 1.00 0.00 C ATOM 381 O ARG A 25 19.647 8.747 13.541 1.00 0.00 O ATOM 382 CB ARG A 25 22.186 6.761 14.125 1.00 0.00 C ATOM 383 CG ARG A 25 22.062 7.304 15.550 1.00 0.00 C ATOM 384 CD ARG A 25 22.658 8.712 15.616 1.00 0.00 C ATOM 385 NE ARG A 25 23.835 8.710 16.530 1.00 0.00 N ATOM 386 CZ ARG A 25 24.392 9.837 16.879 1.00 0.00 C ATOM 387 NH1 ARG A 25 25.309 10.374 16.121 1.00 0.00 N ATOM 388 NH2 ARG A 25 24.032 10.428 17.985 1.00 0.00 N ATOM 0 H ARG A 25 21.736 5.389 12.051 1.00 0.00 H new ATOM 0 HA ARG A 25 20.057 6.358 14.253 1.00 0.00 H new ATOM 0 HB2 ARG A 25 22.675 5.787 14.137 1.00 0.00 H new ATOM 0 HB3 ARG A 25 22.810 7.423 13.525 1.00 0.00 H new ATOM 0 HG2 ARG A 25 21.015 7.327 15.851 1.00 0.00 H new ATOM 0 HG3 ARG A 25 22.580 6.646 16.247 1.00 0.00 H new ATOM 0 HD2 ARG A 25 22.958 9.039 14.620 1.00 0.00 H new ATOM 0 HD3 ARG A 25 21.909 9.419 15.972 1.00 0.00 H new ATOM 0 HE ARG A 25 24.205 7.827 16.883 1.00 0.00 H new ATOM 0 HH11 ARG A 25 25.590 9.913 15.256 1.00 0.00 H new ATOM 0 HH12 ARG A 25 25.744 11.255 16.394 1.00 0.00 H new ATOM 0 HH21 ARG A 25 23.315 10.009 18.577 1.00 0.00 H new ATOM 0 HH22 ARG A 25 24.468 11.309 18.258 1.00 0.00 H new ATOM 402 N LYS A 26 20.880 8.362 11.774 1.00 0.00 N ATOM 403 CA LYS A 26 20.531 9.698 11.203 1.00 0.00 C ATOM 404 C LYS A 26 19.031 9.797 10.917 1.00 0.00 C ATOM 405 O LYS A 26 18.385 10.766 11.267 1.00 0.00 O ATOM 406 CB LYS A 26 21.289 9.896 9.895 1.00 0.00 C ATOM 407 CG LYS A 26 21.590 11.385 9.701 1.00 0.00 C ATOM 408 CD LYS A 26 22.227 11.605 8.329 1.00 0.00 C ATOM 409 CE LYS A 26 22.483 13.098 8.119 1.00 0.00 C ATOM 410 NZ LYS A 26 21.386 13.883 8.755 1.00 0.00 N ATOM 0 H LYS A 26 21.506 7.793 11.204 1.00 0.00 H new ATOM 0 HA LYS A 26 20.804 10.464 11.929 1.00 0.00 H new ATOM 0 HB2 LYS A 26 22.217 9.325 9.910 1.00 0.00 H new ATOM 0 HB3 LYS A 26 20.698 9.521 9.059 1.00 0.00 H new ATOM 0 HG2 LYS A 26 20.671 11.966 9.784 1.00 0.00 H new ATOM 0 HG3 LYS A 26 22.261 11.736 10.485 1.00 0.00 H new ATOM 0 HD2 LYS A 26 23.163 11.051 8.258 1.00 0.00 H new ATOM 0 HD3 LYS A 26 21.571 11.224 7.546 1.00 0.00 H new ATOM 0 HE2 LYS A 26 23.443 13.378 8.552 1.00 0.00 H new ATOM 0 HE3 LYS A 26 22.536 13.323 7.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 21.402 14.858 8.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 20.470 13.445 8.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 21.520 13.894 9.786 1.00 0.00 H new ATOM 424 N ASP A 27 18.486 8.828 10.245 1.00 0.00 N ATOM 425 CA ASP A 27 17.044 8.883 9.885 1.00 0.00 C ATOM 426 C ASP A 27 16.158 8.261 10.974 1.00 0.00 C ATOM 427 O ASP A 27 15.294 8.915 11.521 1.00 0.00 O ATOM 428 CB ASP A 27 16.854 8.118 8.581 1.00 0.00 C ATOM 429 CG ASP A 27 17.006 9.077 7.401 1.00 0.00 C ATOM 430 OD1 ASP A 27 16.349 10.105 7.408 1.00 0.00 O ATOM 431 OD2 ASP A 27 17.779 8.770 6.508 1.00 0.00 O ATOM 0 H ASP A 27 18.979 7.994 9.927 1.00 0.00 H new ATOM 0 HA ASP A 27 16.748 9.927 9.779 1.00 0.00 H new ATOM 0 HB2 ASP A 27 17.588 7.315 8.508 1.00 0.00 H new ATOM 0 HB3 ASP A 27 15.869 7.652 8.560 1.00 0.00 H new ATOM 436 N LEU A 28 16.336 7.003 11.273 1.00 0.00 N ATOM 437 CA LEU A 28 15.462 6.358 12.302 1.00 0.00 C ATOM 438 C LEU A 28 16.050 6.537 13.703 1.00 0.00 C ATOM 439 O LEU A 28 15.390 6.291 14.692 1.00 0.00 O ATOM 440 CB LEU A 28 15.346 4.861 12.006 1.00 0.00 C ATOM 441 CG LEU A 28 14.910 4.652 10.556 1.00 0.00 C ATOM 442 CD1 LEU A 28 14.873 3.154 10.251 1.00 0.00 C ATOM 443 CD2 LEU A 28 13.514 5.246 10.352 1.00 0.00 C ATOM 0 H LEU A 28 17.041 6.396 10.855 1.00 0.00 H new ATOM 0 HA LEU A 28 14.481 6.831 12.264 1.00 0.00 H new ATOM 0 HB2 LEU A 28 16.304 4.371 12.182 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.625 4.402 12.682 1.00 0.00 H new ATOM 0 HG LEU A 28 15.616 5.145 9.888 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.562 3.001 9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.865 2.728 10.399 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.165 2.664 10.919 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.203 5.097 9.318 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.807 4.752 11.018 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.537 6.313 10.574 1.00 0.00 H new ATOM 455 N GLY A 29 17.280 6.956 13.807 1.00 0.00 N ATOM 456 CA GLY A 29 17.883 7.133 15.160 1.00 0.00 C ATOM 457 C GLY A 29 17.921 5.782 15.881 1.00 0.00 C ATOM 458 O GLY A 29 18.171 5.707 17.068 1.00 0.00 O ATOM 0 H GLY A 29 17.891 7.182 13.022 1.00 0.00 H new ATOM 0 HA2 GLY A 29 18.891 7.538 15.071 1.00 0.00 H new ATOM 0 HA3 GLY A 29 17.301 7.850 15.739 1.00 0.00 H new ATOM 462 N TRP A 30 17.671 4.713 15.172 1.00 0.00 N ATOM 463 CA TRP A 30 17.689 3.367 15.807 1.00 0.00 C ATOM 464 C TRP A 30 18.909 3.242 16.716 1.00 0.00 C ATOM 465 O TRP A 30 20.031 3.464 16.304 1.00 0.00 O ATOM 466 CB TRP A 30 17.753 2.297 14.716 1.00 0.00 C ATOM 467 CG TRP A 30 16.373 2.002 14.232 1.00 0.00 C ATOM 468 CD1 TRP A 30 15.287 2.773 14.465 1.00 0.00 C ATOM 469 CD2 TRP A 30 15.910 0.870 13.442 1.00 0.00 C ATOM 470 NE1 TRP A 30 14.186 2.186 13.868 1.00 0.00 N ATOM 471 CE2 TRP A 30 14.518 1.010 13.226 1.00 0.00 C ATOM 472 CE3 TRP A 30 16.556 -0.255 12.899 1.00 0.00 C ATOM 473 CZ2 TRP A 30 13.794 0.068 12.497 1.00 0.00 C ATOM 474 CZ3 TRP A 30 15.829 -1.205 12.165 1.00 0.00 C ATOM 475 CH2 TRP A 30 14.451 -1.045 11.966 1.00 0.00 C ATOM 0 H TRP A 30 17.454 4.717 14.175 1.00 0.00 H new ATOM 0 HA TRP A 30 16.785 3.233 16.401 1.00 0.00 H new ATOM 0 HB2 TRP A 30 18.375 2.641 13.889 1.00 0.00 H new ATOM 0 HB3 TRP A 30 18.215 1.390 15.107 1.00 0.00 H new ATOM 0 HD1 TRP A 30 15.280 3.696 15.026 1.00 0.00 H new ATOM 0 HE1 TRP A 30 13.243 2.575 13.898 1.00 0.00 H new ATOM 0 HE3 TRP A 30 17.617 -0.389 13.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 12.733 0.197 12.344 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 16.335 -2.065 11.751 1.00 0.00 H new ATOM 0 HH2 TRP A 30 13.897 -1.781 11.403 1.00 0.00 H new ATOM 486 N LYS A 31 18.698 2.890 17.952 1.00 0.00 N ATOM 487 CA LYS A 31 19.827 2.752 18.896 1.00 0.00 C ATOM 488 C LYS A 31 20.110 1.269 19.145 1.00 0.00 C ATOM 489 O LYS A 31 21.110 0.911 19.734 1.00 0.00 O ATOM 490 CB LYS A 31 19.433 3.414 20.209 1.00 0.00 C ATOM 491 CG LYS A 31 19.864 4.882 20.197 1.00 0.00 C ATOM 492 CD LYS A 31 18.795 5.736 20.883 1.00 0.00 C ATOM 493 CE LYS A 31 19.141 5.894 22.365 1.00 0.00 C ATOM 494 NZ LYS A 31 19.415 7.328 22.661 1.00 0.00 N ATOM 0 H LYS A 31 17.779 2.691 18.348 1.00 0.00 H new ATOM 0 HA LYS A 31 20.720 3.222 18.484 1.00 0.00 H new ATOM 0 HB2 LYS A 31 18.355 3.343 20.354 1.00 0.00 H new ATOM 0 HB3 LYS A 31 19.902 2.894 21.044 1.00 0.00 H new ATOM 0 HG2 LYS A 31 20.819 4.995 20.710 1.00 0.00 H new ATOM 0 HG3 LYS A 31 20.011 5.220 19.171 1.00 0.00 H new ATOM 0 HD2 LYS A 31 18.735 6.714 20.406 1.00 0.00 H new ATOM 0 HD3 LYS A 31 17.816 5.268 20.775 1.00 0.00 H new ATOM 0 HE2 LYS A 31 18.317 5.535 22.982 1.00 0.00 H new ATOM 0 HE3 LYS A 31 20.012 5.288 22.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 19.650 7.436 23.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 20.214 7.655 22.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 18.572 7.895 22.440 1.00 0.00 H new ATOM 508 N TRP A 32 19.232 0.404 18.715 1.00 0.00 N ATOM 509 CA TRP A 32 19.459 -1.049 18.947 1.00 0.00 C ATOM 510 C TRP A 32 20.315 -1.630 17.826 1.00 0.00 C ATOM 511 O TRP A 32 20.667 -2.790 17.848 1.00 0.00 O ATOM 512 CB TRP A 32 18.116 -1.781 19.005 1.00 0.00 C ATOM 513 CG TRP A 32 17.547 -1.936 17.628 1.00 0.00 C ATOM 514 CD1 TRP A 32 16.913 -0.964 16.936 1.00 0.00 C ATOM 515 CD2 TRP A 32 17.544 -3.114 16.769 1.00 0.00 C ATOM 516 NE1 TRP A 32 16.504 -1.472 15.722 1.00 0.00 N ATOM 517 CE2 TRP A 32 16.872 -2.793 15.568 1.00 0.00 C ATOM 518 CE3 TRP A 32 18.051 -4.415 16.917 1.00 0.00 C ATOM 519 CZ2 TRP A 32 16.704 -3.731 14.551 1.00 0.00 C ATOM 520 CZ3 TRP A 32 17.889 -5.363 15.893 1.00 0.00 C ATOM 521 CH2 TRP A 32 17.213 -5.021 14.713 1.00 0.00 C ATOM 0 H TRP A 32 18.374 0.639 18.217 1.00 0.00 H new ATOM 0 HA TRP A 32 19.980 -1.179 19.895 1.00 0.00 H new ATOM 0 HB2 TRP A 32 18.248 -2.761 19.463 1.00 0.00 H new ATOM 0 HB3 TRP A 32 17.419 -1.226 19.633 1.00 0.00 H new ATOM 0 HD1 TRP A 32 16.753 0.048 17.279 1.00 0.00 H new ATOM 0 HE1 TRP A 32 15.991 -0.936 15.022 1.00 0.00 H new ATOM 0 HE3 TRP A 32 18.569 -4.689 17.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 16.184 -3.462 13.644 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 18.287 -6.360 16.015 1.00 0.00 H new ATOM 0 HH2 TRP A 32 17.086 -5.754 13.930 1.00 0.00 H new ATOM 532 N ILE A 33 20.657 -0.840 16.849 1.00 0.00 N ATOM 533 CA ILE A 33 21.493 -1.363 15.735 1.00 0.00 C ATOM 534 C ILE A 33 22.754 -0.505 15.602 1.00 0.00 C ATOM 535 O ILE A 33 22.692 0.706 15.509 1.00 0.00 O ATOM 536 CB ILE A 33 20.681 -1.335 14.434 1.00 0.00 C ATOM 537 CG1 ILE A 33 19.816 -2.593 14.372 1.00 0.00 C ATOM 538 CG2 ILE A 33 21.615 -1.307 13.219 1.00 0.00 C ATOM 539 CD1 ILE A 33 18.896 -2.531 13.156 1.00 0.00 C ATOM 0 H ILE A 33 20.395 0.143 16.773 1.00 0.00 H new ATOM 0 HA ILE A 33 21.789 -2.392 15.941 1.00 0.00 H new ATOM 0 HB ILE A 33 20.059 -0.440 14.418 1.00 0.00 H new ATOM 0 HG12 ILE A 33 20.450 -3.478 14.315 1.00 0.00 H new ATOM 0 HG13 ILE A 33 19.224 -2.683 15.283 1.00 0.00 H new ATOM 0 HG21 ILE A 33 21.022 -1.287 12.305 1.00 0.00 H new ATOM 0 HG22 ILE A 33 22.243 -0.417 13.263 1.00 0.00 H new ATOM 0 HG23 ILE A 33 22.245 -2.196 13.224 1.00 0.00 H new ATOM 0 HD11 ILE A 33 18.282 -3.431 13.118 1.00 0.00 H new ATOM 0 HD12 ILE A 33 18.252 -1.655 13.232 1.00 0.00 H new ATOM 0 HD13 ILE A 33 19.496 -2.463 12.249 1.00 0.00 H new ATOM 551 N HIS A 34 23.899 -1.128 15.596 1.00 0.00 N ATOM 552 CA HIS A 34 25.173 -0.363 15.475 1.00 0.00 C ATOM 553 C HIS A 34 25.601 -0.316 14.004 1.00 0.00 C ATOM 554 O HIS A 34 25.839 0.741 13.452 1.00 0.00 O ATOM 555 CB HIS A 34 26.254 -1.056 16.314 1.00 0.00 C ATOM 556 CG HIS A 34 27.621 -0.588 15.887 1.00 0.00 C ATOM 557 ND1 HIS A 34 28.032 0.727 16.029 1.00 0.00 N ATOM 558 CD2 HIS A 34 28.679 -1.254 15.320 1.00 0.00 C ATOM 559 CE1 HIS A 34 29.290 0.812 15.557 1.00 0.00 C ATOM 560 NE2 HIS A 34 29.733 -0.368 15.113 1.00 0.00 N ATOM 0 H HIS A 34 24.009 -2.139 15.670 1.00 0.00 H new ATOM 0 HA HIS A 34 25.032 0.656 15.837 1.00 0.00 H new ATOM 0 HB2 HIS A 34 26.100 -0.838 17.371 1.00 0.00 H new ATOM 0 HB3 HIS A 34 26.178 -2.137 16.197 1.00 0.00 H new ATOM 0 HD2 HIS A 34 28.692 -2.305 15.072 1.00 0.00 H new ATOM 0 HE1 HIS A 34 29.870 1.723 15.539 1.00 0.00 H new ATOM 0 HE2 HIS A 34 30.647 -0.575 14.709 1.00 0.00 H new ATOM 568 N GLU A 35 25.707 -1.449 13.366 1.00 0.00 N ATOM 569 CA GLU A 35 26.125 -1.460 11.935 1.00 0.00 C ATOM 570 C GLU A 35 25.101 -2.241 11.106 1.00 0.00 C ATOM 571 O GLU A 35 24.424 -3.110 11.618 1.00 0.00 O ATOM 572 CB GLU A 35 27.496 -2.127 11.809 1.00 0.00 C ATOM 573 CG GLU A 35 28.590 -1.119 12.166 1.00 0.00 C ATOM 574 CD GLU A 35 29.892 -1.862 12.466 1.00 0.00 C ATOM 575 OE1 GLU A 35 29.821 -3.041 12.771 1.00 0.00 O ATOM 576 OE2 GLU A 35 30.939 -1.239 12.387 1.00 0.00 O ATOM 0 H GLU A 35 25.523 -2.366 13.772 1.00 0.00 H new ATOM 0 HA GLU A 35 26.183 -0.435 11.568 1.00 0.00 H new ATOM 0 HB2 GLU A 35 27.554 -2.991 12.471 1.00 0.00 H new ATOM 0 HB3 GLU A 35 27.642 -2.493 10.793 1.00 0.00 H new ATOM 0 HG2 GLU A 35 28.739 -0.421 11.342 1.00 0.00 H new ATOM 0 HG3 GLU A 35 28.288 -0.530 13.032 1.00 0.00 H new ATOM 583 N PRO A 36 25.020 -1.906 9.844 1.00 0.00 N ATOM 584 CA PRO A 36 25.849 -0.849 9.235 1.00 0.00 C ATOM 585 C PRO A 36 25.293 0.532 9.589 1.00 0.00 C ATOM 586 O PRO A 36 24.245 0.655 10.192 1.00 0.00 O ATOM 587 CB PRO A 36 25.725 -1.118 7.733 1.00 0.00 C ATOM 588 CG PRO A 36 24.418 -1.923 7.540 1.00 0.00 C ATOM 589 CD PRO A 36 24.087 -2.558 8.903 1.00 0.00 C ATOM 0 HA PRO A 36 26.883 -0.859 9.581 1.00 0.00 H new ATOM 0 HB2 PRO A 36 25.692 -0.184 7.173 1.00 0.00 H new ATOM 0 HB3 PRO A 36 26.585 -1.679 7.367 1.00 0.00 H new ATOM 0 HG2 PRO A 36 23.608 -1.273 7.208 1.00 0.00 H new ATOM 0 HG3 PRO A 36 24.545 -2.690 6.776 1.00 0.00 H new ATOM 0 HD2 PRO A 36 23.049 -2.379 9.184 1.00 0.00 H new ATOM 0 HD3 PRO A 36 24.231 -3.638 8.884 1.00 0.00 H new ATOM 597 N LYS A 37 25.982 1.571 9.209 1.00 0.00 N ATOM 598 CA LYS A 37 25.496 2.937 9.509 1.00 0.00 C ATOM 599 C LYS A 37 24.073 3.093 8.978 1.00 0.00 C ATOM 600 O LYS A 37 23.241 3.747 9.574 1.00 0.00 O ATOM 601 CB LYS A 37 26.414 3.933 8.812 1.00 0.00 C ATOM 602 CG LYS A 37 27.553 4.330 9.752 1.00 0.00 C ATOM 603 CD LYS A 37 28.312 5.520 9.162 1.00 0.00 C ATOM 604 CE LYS A 37 28.712 5.208 7.719 1.00 0.00 C ATOM 605 NZ LYS A 37 27.811 5.939 6.786 1.00 0.00 N ATOM 0 H LYS A 37 26.865 1.528 8.701 1.00 0.00 H new ATOM 0 HA LYS A 37 25.497 3.115 10.584 1.00 0.00 H new ATOM 0 HB2 LYS A 37 26.819 3.493 7.901 1.00 0.00 H new ATOM 0 HB3 LYS A 37 25.849 4.817 8.516 1.00 0.00 H new ATOM 0 HG2 LYS A 37 27.155 4.589 10.733 1.00 0.00 H new ATOM 0 HG3 LYS A 37 28.230 3.488 9.895 1.00 0.00 H new ATOM 0 HD2 LYS A 37 27.688 6.413 9.192 1.00 0.00 H new ATOM 0 HD3 LYS A 37 29.199 5.730 9.759 1.00 0.00 H new ATOM 0 HE2 LYS A 37 29.748 5.501 7.546 1.00 0.00 H new ATOM 0 HE3 LYS A 37 28.649 4.135 7.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 28.284 6.056 5.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 26.932 5.398 6.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 27.586 6.874 7.182 1.00 0.00 H new ATOM 619 N GLY A 38 23.793 2.490 7.858 1.00 0.00 N ATOM 620 CA GLY A 38 22.427 2.589 7.273 1.00 0.00 C ATOM 621 C GLY A 38 22.278 1.550 6.160 1.00 0.00 C ATOM 622 O GLY A 38 22.842 0.476 6.225 1.00 0.00 O ATOM 0 H GLY A 38 24.454 1.930 7.320 1.00 0.00 H new ATOM 0 HA2 GLY A 38 21.675 2.423 8.045 1.00 0.00 H new ATOM 0 HA3 GLY A 38 22.260 3.590 6.876 1.00 0.00 H new ATOM 626 N TYR A 39 21.526 1.858 5.140 1.00 0.00 N ATOM 627 CA TYR A 39 21.345 0.884 4.028 1.00 0.00 C ATOM 628 C TYR A 39 20.403 1.474 2.975 1.00 0.00 C ATOM 629 O TYR A 39 19.918 2.579 3.113 1.00 0.00 O ATOM 630 CB TYR A 39 20.749 -0.411 4.583 1.00 0.00 C ATOM 631 CG TYR A 39 19.299 -0.190 4.939 1.00 0.00 C ATOM 632 CD1 TYR A 39 18.951 0.717 5.947 1.00 0.00 C ATOM 633 CD2 TYR A 39 18.306 -0.895 4.260 1.00 0.00 C ATOM 634 CE1 TYR A 39 17.604 0.916 6.275 1.00 0.00 C ATOM 635 CE2 TYR A 39 16.960 -0.697 4.585 1.00 0.00 C ATOM 636 CZ TYR A 39 16.609 0.208 5.593 1.00 0.00 C ATOM 637 OH TYR A 39 15.281 0.402 5.915 1.00 0.00 O ATOM 0 H TYR A 39 21.029 2.742 5.029 1.00 0.00 H new ATOM 0 HA TYR A 39 22.310 0.673 3.567 1.00 0.00 H new ATOM 0 HB2 TYR A 39 20.835 -1.208 3.845 1.00 0.00 H new ATOM 0 HB3 TYR A 39 21.305 -0.731 5.464 1.00 0.00 H new ATOM 0 HD1 TYR A 39 19.721 1.263 6.472 1.00 0.00 H new ATOM 0 HD2 TYR A 39 18.576 -1.594 3.483 1.00 0.00 H new ATOM 0 HE1 TYR A 39 17.334 1.615 7.053 1.00 0.00 H new ATOM 0 HE2 TYR A 39 16.191 -1.243 4.058 1.00 0.00 H new ATOM 0 HH TYR A 39 14.720 -0.166 5.346 1.00 0.00 H new ATOM 647 N HIS A 40 20.137 0.745 1.925 1.00 0.00 N ATOM 648 CA HIS A 40 19.223 1.268 0.871 1.00 0.00 C ATOM 649 C HIS A 40 17.802 0.783 1.164 1.00 0.00 C ATOM 650 O HIS A 40 17.326 -0.170 0.578 1.00 0.00 O ATOM 651 CB HIS A 40 19.669 0.750 -0.498 1.00 0.00 C ATOM 652 CG HIS A 40 21.108 1.123 -0.730 1.00 0.00 C ATOM 653 ND1 HIS A 40 22.142 0.574 0.012 1.00 0.00 N ATOM 654 CD2 HIS A 40 21.700 1.987 -1.616 1.00 0.00 C ATOM 655 CE1 HIS A 40 23.292 1.110 -0.437 1.00 0.00 C ATOM 656 NE2 HIS A 40 23.080 1.977 -1.429 1.00 0.00 N ATOM 0 H HIS A 40 20.512 -0.188 1.752 1.00 0.00 H new ATOM 0 HA HIS A 40 19.249 2.358 0.866 1.00 0.00 H new ATOM 0 HB2 HIS A 40 19.550 -0.332 -0.546 1.00 0.00 H new ATOM 0 HB3 HIS A 40 19.041 1.174 -1.282 1.00 0.00 H new ATOM 0 HD2 HIS A 40 21.176 2.584 -2.347 1.00 0.00 H new ATOM 0 HE1 HIS A 40 24.268 0.868 -0.042 1.00 0.00 H new ATOM 0 HE2 HIS A 40 23.779 2.516 -1.940 1.00 0.00 H new ATOM 664 N ALA A 41 17.127 1.423 2.078 1.00 0.00 N ATOM 665 CA ALA A 41 15.743 0.994 2.426 1.00 0.00 C ATOM 666 C ALA A 41 14.814 1.176 1.224 1.00 0.00 C ATOM 667 O ALA A 41 13.913 0.391 1.005 1.00 0.00 O ATOM 668 CB ALA A 41 15.235 1.833 3.601 1.00 0.00 C ATOM 0 H ALA A 41 17.475 2.227 2.600 1.00 0.00 H new ATOM 0 HA ALA A 41 15.754 -0.060 2.704 1.00 0.00 H new ATOM 0 HB1 ALA A 41 14.223 1.522 3.859 1.00 0.00 H new ATOM 0 HB2 ALA A 41 15.889 1.689 4.461 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.231 2.886 3.321 1.00 0.00 H new ATOM 674 N ASN A 42 15.018 2.199 0.442 1.00 0.00 N ATOM 675 CA ASN A 42 14.133 2.410 -0.740 1.00 0.00 C ATOM 676 C ASN A 42 12.695 2.612 -0.266 1.00 0.00 C ATOM 677 O ASN A 42 12.393 2.479 0.903 1.00 0.00 O ATOM 678 CB ASN A 42 14.192 1.178 -1.646 1.00 0.00 C ATOM 679 CG ASN A 42 15.323 1.340 -2.662 1.00 0.00 C ATOM 680 OD1 ASN A 42 15.772 2.440 -2.917 1.00 0.00 O ATOM 681 ND2 ASN A 42 15.807 0.283 -3.255 1.00 0.00 N ATOM 0 H ASN A 42 15.754 2.894 0.568 1.00 0.00 H new ATOM 0 HA ASN A 42 14.467 3.289 -1.291 1.00 0.00 H new ATOM 0 HB2 ASN A 42 14.354 0.282 -1.047 1.00 0.00 H new ATOM 0 HB3 ASN A 42 13.241 1.049 -2.163 1.00 0.00 H new ATOM 0 HD21 ASN A 42 16.563 0.380 -3.933 1.00 0.00 H new ATOM 0 HD22 ASN A 42 15.430 -0.640 -3.040 1.00 0.00 H new ATOM 688 N PHE A 43 11.799 2.917 -1.166 1.00 0.00 N ATOM 689 CA PHE A 43 10.379 3.110 -0.758 1.00 0.00 C ATOM 690 C PHE A 43 9.532 3.426 -1.989 1.00 0.00 C ATOM 691 O PHE A 43 10.033 3.501 -3.093 1.00 0.00 O ATOM 692 CB PHE A 43 10.276 4.238 0.272 1.00 0.00 C ATOM 693 CG PHE A 43 10.415 5.585 -0.390 1.00 0.00 C ATOM 694 CD1 PHE A 43 11.449 5.828 -1.301 1.00 0.00 C ATOM 695 CD2 PHE A 43 9.512 6.602 -0.070 1.00 0.00 C ATOM 696 CE1 PHE A 43 11.578 7.091 -1.890 1.00 0.00 C ATOM 697 CE2 PHE A 43 9.639 7.860 -0.659 1.00 0.00 C ATOM 698 CZ PHE A 43 10.672 8.107 -1.568 1.00 0.00 C ATOM 0 H PHE A 43 11.988 3.040 -2.161 1.00 0.00 H new ATOM 0 HA PHE A 43 10.006 2.194 -0.300 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.317 4.179 0.787 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.052 4.118 1.028 1.00 0.00 H new ATOM 0 HD1 PHE A 43 12.147 5.042 -1.549 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.715 6.414 0.634 1.00 0.00 H new ATOM 0 HE1 PHE A 43 12.376 7.281 -2.592 1.00 0.00 H new ATOM 0 HE2 PHE A 43 8.938 8.644 -0.413 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.771 9.082 -2.022 1.00 0.00 H new ATOM 708 N CYS A 44 8.247 3.582 -1.819 1.00 0.00 N ATOM 709 CA CYS A 44 7.378 3.858 -2.999 1.00 0.00 C ATOM 710 C CYS A 44 6.633 5.181 -2.805 1.00 0.00 C ATOM 711 O CYS A 44 6.304 5.564 -1.700 1.00 0.00 O ATOM 712 CB CYS A 44 6.343 2.735 -3.150 1.00 0.00 C ATOM 713 SG CYS A 44 6.988 1.180 -2.474 1.00 0.00 S ATOM 0 H CYS A 44 7.764 3.531 -0.922 1.00 0.00 H new ATOM 0 HA CYS A 44 8.006 3.915 -3.888 1.00 0.00 H new ATOM 0 HB2 CYS A 44 5.423 3.009 -2.634 1.00 0.00 H new ATOM 0 HB3 CYS A 44 6.091 2.604 -4.202 1.00 0.00 H new ATOM 718 N LEU A 45 6.353 5.877 -3.874 1.00 0.00 N ATOM 719 CA LEU A 45 5.617 7.166 -3.756 1.00 0.00 C ATOM 720 C LEU A 45 4.686 7.341 -4.958 1.00 0.00 C ATOM 721 O LEU A 45 4.696 6.555 -5.886 1.00 0.00 O ATOM 722 CB LEU A 45 6.612 8.324 -3.724 1.00 0.00 C ATOM 723 CG LEU A 45 7.256 8.421 -2.345 1.00 0.00 C ATOM 724 CD1 LEU A 45 8.065 9.712 -2.270 1.00 0.00 C ATOM 725 CD2 LEU A 45 6.170 8.434 -1.266 1.00 0.00 C ATOM 0 H LEU A 45 6.603 5.607 -4.825 1.00 0.00 H new ATOM 0 HA LEU A 45 5.031 7.158 -2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.380 8.175 -4.483 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.103 9.258 -3.963 1.00 0.00 H new ATOM 0 HG LEU A 45 7.908 7.563 -2.182 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.531 9.793 -1.288 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.838 9.702 -3.038 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.405 10.565 -2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.635 8.503 -0.283 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.515 9.292 -1.419 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.585 7.516 -1.327 1.00 0.00 H new ATOM 737 N GLY A 46 3.887 8.374 -4.952 1.00 0.00 N ATOM 738 CA GLY A 46 2.957 8.613 -6.092 1.00 0.00 C ATOM 739 C GLY A 46 1.997 7.427 -6.241 1.00 0.00 C ATOM 740 O GLY A 46 2.382 6.293 -6.036 1.00 0.00 O ATOM 0 H GLY A 46 3.839 9.065 -4.203 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.392 9.530 -5.926 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.524 8.751 -7.013 1.00 0.00 H new ATOM 744 N PRO A 47 0.773 7.728 -6.601 1.00 0.00 N ATOM 745 CA PRO A 47 -0.272 6.706 -6.792 1.00 0.00 C ATOM 746 C PRO A 47 -0.105 6.025 -8.154 1.00 0.00 C ATOM 747 O PRO A 47 0.892 6.195 -8.826 1.00 0.00 O ATOM 748 CB PRO A 47 -1.573 7.514 -6.745 1.00 0.00 C ATOM 749 CG PRO A 47 -1.196 8.972 -7.100 1.00 0.00 C ATOM 750 CD PRO A 47 0.317 9.111 -6.845 1.00 0.00 C ATOM 0 HA PRO A 47 -0.240 5.912 -6.046 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -2.302 7.118 -7.453 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.028 7.460 -5.756 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.435 9.191 -8.141 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -1.758 9.677 -6.488 1.00 0.00 H new ATOM 0 HD2 PRO A 47 0.826 9.553 -7.702 1.00 0.00 H new ATOM 0 HD3 PRO A 47 0.519 9.754 -5.988 1.00 0.00 H new ATOM 758 N CYS A 48 -1.078 5.259 -8.569 1.00 0.00 N ATOM 759 CA CYS A 48 -0.973 4.574 -9.888 1.00 0.00 C ATOM 760 C CYS A 48 -2.355 4.489 -10.540 1.00 0.00 C ATOM 761 O CYS A 48 -3.363 4.487 -9.861 1.00 0.00 O ATOM 762 CB CYS A 48 -0.424 3.158 -9.700 1.00 0.00 C ATOM 763 SG CYS A 48 -1.133 2.411 -8.209 1.00 0.00 S ATOM 0 H CYS A 48 -1.939 5.079 -8.052 1.00 0.00 H new ATOM 0 HA CYS A 48 -0.299 5.145 -10.526 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -0.663 2.548 -10.571 1.00 0.00 H new ATOM 0 HB3 CYS A 48 0.663 3.188 -9.620 1.00 0.00 H new ATOM 768 N PRO A 49 -2.356 4.404 -11.847 1.00 0.00 N ATOM 769 CA PRO A 49 -3.596 4.296 -12.633 1.00 0.00 C ATOM 770 C PRO A 49 -4.163 2.869 -12.500 1.00 0.00 C ATOM 771 O PRO A 49 -4.163 2.307 -11.422 1.00 0.00 O ATOM 772 CB PRO A 49 -3.137 4.632 -14.063 1.00 0.00 C ATOM 773 CG PRO A 49 -1.618 4.362 -14.112 1.00 0.00 C ATOM 774 CD PRO A 49 -1.119 4.408 -12.656 1.00 0.00 C ATOM 0 HA PRO A 49 -4.401 4.957 -12.311 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -3.664 4.018 -14.794 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -3.354 5.672 -14.305 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -1.411 3.391 -14.563 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -1.110 5.111 -14.720 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -0.489 3.549 -12.424 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -0.523 5.301 -12.468 1.00 0.00 H new ATOM 782 N TYR A 50 -4.652 2.274 -13.557 1.00 0.00 N ATOM 783 CA TYR A 50 -5.211 0.893 -13.428 1.00 0.00 C ATOM 784 C TYR A 50 -4.168 -0.140 -13.865 1.00 0.00 C ATOM 785 O TYR A 50 -3.452 -0.688 -13.054 1.00 0.00 O ATOM 786 CB TYR A 50 -6.476 0.732 -14.292 1.00 0.00 C ATOM 787 CG TYR A 50 -6.632 1.904 -15.236 1.00 0.00 C ATOM 788 CD1 TYR A 50 -6.932 3.174 -14.729 1.00 0.00 C ATOM 789 CD2 TYR A 50 -6.473 1.721 -16.615 1.00 0.00 C ATOM 790 CE1 TYR A 50 -7.072 4.261 -15.600 1.00 0.00 C ATOM 791 CE2 TYR A 50 -6.614 2.807 -17.487 1.00 0.00 C ATOM 792 CZ TYR A 50 -6.914 4.077 -16.979 1.00 0.00 C ATOM 793 OH TYR A 50 -7.052 5.148 -17.838 1.00 0.00 O ATOM 0 H TYR A 50 -4.689 2.677 -14.493 1.00 0.00 H new ATOM 0 HA TYR A 50 -5.473 0.731 -12.382 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -6.417 -0.195 -14.862 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -7.354 0.656 -13.650 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -7.055 3.315 -13.665 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.241 0.741 -17.006 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -7.302 5.241 -15.208 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.492 2.665 -18.551 1.00 0.00 H new ATOM 0 HH TYR A 50 -6.910 4.848 -18.760 1.00 0.00 H new ATOM 803 N ILE A 51 -4.093 -0.418 -15.140 1.00 0.00 N ATOM 804 CA ILE A 51 -3.114 -1.430 -15.645 1.00 0.00 C ATOM 805 C ILE A 51 -1.791 -1.350 -14.872 1.00 0.00 C ATOM 806 O ILE A 51 -1.080 -2.327 -14.751 1.00 0.00 O ATOM 807 CB ILE A 51 -2.846 -1.172 -17.129 1.00 0.00 C ATOM 808 CG1 ILE A 51 -1.996 0.092 -17.280 1.00 0.00 C ATOM 809 CG2 ILE A 51 -4.175 -0.983 -17.862 1.00 0.00 C ATOM 810 CD1 ILE A 51 -1.566 0.246 -18.740 1.00 0.00 C ATOM 0 H ILE A 51 -4.672 0.015 -15.860 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.538 -2.424 -15.503 1.00 0.00 H new ATOM 0 HB ILE A 51 -2.314 -2.022 -17.556 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -2.565 0.966 -16.963 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.119 0.032 -16.636 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.984 -0.799 -18.919 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -4.781 -1.882 -17.754 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -4.708 -0.133 -17.436 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -0.961 1.146 -18.848 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.981 -0.623 -19.041 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.450 0.325 -19.373 1.00 0.00 H new ATOM 822 N TRP A 52 -1.450 -0.200 -14.358 1.00 0.00 N ATOM 823 CA TRP A 52 -0.165 -0.069 -13.607 1.00 0.00 C ATOM 824 C TRP A 52 -0.094 -1.103 -12.478 1.00 0.00 C ATOM 825 O TRP A 52 -0.463 -0.825 -11.356 1.00 0.00 O ATOM 826 CB TRP A 52 -0.068 1.332 -13.013 1.00 0.00 C ATOM 827 CG TRP A 52 1.347 1.808 -13.095 1.00 0.00 C ATOM 828 CD1 TRP A 52 2.000 2.450 -12.105 1.00 0.00 C ATOM 829 CD2 TRP A 52 2.291 1.688 -14.199 1.00 0.00 C ATOM 830 NE1 TRP A 52 3.284 2.740 -12.529 1.00 0.00 N ATOM 831 CE2 TRP A 52 3.513 2.289 -13.812 1.00 0.00 C ATOM 832 CE3 TRP A 52 2.207 1.124 -15.485 1.00 0.00 C ATOM 833 CZ2 TRP A 52 4.613 2.328 -14.671 1.00 0.00 C ATOM 834 CZ3 TRP A 52 3.312 1.162 -16.351 1.00 0.00 C ATOM 835 CH2 TRP A 52 4.513 1.763 -15.945 1.00 0.00 C ATOM 0 H TRP A 52 -2.003 0.654 -14.424 1.00 0.00 H new ATOM 0 HA TRP A 52 0.663 -0.242 -14.295 1.00 0.00 H new ATOM 0 HB2 TRP A 52 -0.725 2.014 -13.553 1.00 0.00 H new ATOM 0 HB3 TRP A 52 -0.401 1.323 -11.975 1.00 0.00 H new ATOM 0 HD1 TRP A 52 1.587 2.697 -11.138 1.00 0.00 H new ATOM 0 HE1 TRP A 52 3.977 3.228 -11.962 1.00 0.00 H new ATOM 0 HE3 TRP A 52 1.287 0.659 -15.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 5.535 2.792 -14.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 3.237 0.726 -17.336 1.00 0.00 H new ATOM 0 HH2 TRP A 52 5.359 1.789 -16.616 1.00 0.00 H new ATOM 846 N SER A 53 0.401 -2.281 -12.776 1.00 0.00 N ATOM 847 CA SER A 53 0.534 -3.357 -11.741 1.00 0.00 C ATOM 848 C SER A 53 -0.559 -3.239 -10.674 1.00 0.00 C ATOM 849 O SER A 53 -0.441 -2.478 -9.734 1.00 0.00 O ATOM 850 CB SER A 53 1.903 -3.244 -11.071 1.00 0.00 C ATOM 851 OG SER A 53 2.908 -3.670 -11.982 1.00 0.00 O ATOM 0 H SER A 53 0.723 -2.547 -13.707 1.00 0.00 H new ATOM 0 HA SER A 53 0.430 -4.323 -12.235 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.087 -2.214 -10.764 1.00 0.00 H new ATOM 0 HB3 SER A 53 1.931 -3.855 -10.169 1.00 0.00 H new ATOM 0 HG SER A 53 3.788 -3.597 -11.556 1.00 0.00 H new ATOM 857 N LEU A 54 -1.615 -3.995 -10.801 1.00 0.00 N ATOM 858 CA LEU A 54 -2.700 -3.928 -9.781 1.00 0.00 C ATOM 859 C LEU A 54 -2.707 -5.219 -8.963 1.00 0.00 C ATOM 860 O LEU A 54 -2.706 -6.307 -9.502 1.00 0.00 O ATOM 861 CB LEU A 54 -4.051 -3.755 -10.477 1.00 0.00 C ATOM 862 CG LEU A 54 -4.070 -2.418 -11.216 1.00 0.00 C ATOM 863 CD1 LEU A 54 -5.302 -2.349 -12.122 1.00 0.00 C ATOM 864 CD2 LEU A 54 -4.123 -1.275 -10.200 1.00 0.00 C ATOM 0 H LEU A 54 -1.773 -4.654 -11.564 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.525 -3.079 -9.120 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.220 -4.573 -11.177 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.858 -3.790 -9.745 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.168 -2.327 -11.822 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.314 -1.395 -12.648 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.267 -3.162 -12.847 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.204 -2.441 -11.517 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.137 -0.321 -10.726 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.024 -1.368 -9.594 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.246 -1.321 -9.555 1.00 0.00 H new ATOM 876 N ASP A 55 -2.711 -5.108 -7.663 1.00 0.00 N ATOM 877 CA ASP A 55 -2.713 -6.331 -6.812 1.00 0.00 C ATOM 878 C ASP A 55 -4.153 -6.722 -6.476 1.00 0.00 C ATOM 879 O ASP A 55 -4.552 -7.858 -6.642 1.00 0.00 O ATOM 880 CB ASP A 55 -1.946 -6.051 -5.517 1.00 0.00 C ATOM 881 CG ASP A 55 -1.651 -7.371 -4.803 1.00 0.00 C ATOM 882 OD1 ASP A 55 -2.498 -7.813 -4.043 1.00 0.00 O ATOM 883 OD2 ASP A 55 -0.586 -7.919 -5.028 1.00 0.00 O ATOM 0 H ASP A 55 -2.713 -4.224 -7.154 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.234 -7.148 -7.352 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -1.015 -5.529 -5.739 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.531 -5.398 -4.869 1.00 0.00 H new ATOM 888 N THR A 56 -4.937 -5.794 -6.000 1.00 0.00 N ATOM 889 CA THR A 56 -6.348 -6.119 -5.652 1.00 0.00 C ATOM 890 C THR A 56 -7.290 -5.510 -6.693 1.00 0.00 C ATOM 891 O THR A 56 -6.984 -4.512 -7.313 1.00 0.00 O ATOM 892 CB THR A 56 -6.676 -5.543 -4.271 1.00 0.00 C ATOM 893 OG1 THR A 56 -7.118 -4.200 -4.412 1.00 0.00 O ATOM 894 CG2 THR A 56 -5.429 -5.584 -3.387 1.00 0.00 C ATOM 0 H THR A 56 -4.661 -4.826 -5.837 1.00 0.00 H new ATOM 0 HA THR A 56 -6.477 -7.201 -5.638 1.00 0.00 H new ATOM 0 HB THR A 56 -7.464 -6.137 -3.808 1.00 0.00 H new ATOM 0 HG1 THR A 56 -7.330 -3.831 -3.529 1.00 0.00 H new ATOM 0 HG21 THR A 56 -5.665 -5.174 -2.405 1.00 0.00 H new ATOM 0 HG22 THR A 56 -5.094 -6.616 -3.278 1.00 0.00 H new ATOM 0 HG23 THR A 56 -4.638 -4.992 -3.847 1.00 0.00 H new ATOM 902 N GLN A 57 -8.436 -6.106 -6.887 1.00 0.00 N ATOM 903 CA GLN A 57 -9.398 -5.563 -7.886 1.00 0.00 C ATOM 904 C GLN A 57 -9.756 -4.122 -7.515 1.00 0.00 C ATOM 905 O GLN A 57 -9.981 -3.288 -8.370 1.00 0.00 O ATOM 906 CB GLN A 57 -10.667 -6.418 -7.890 1.00 0.00 C ATOM 907 CG GLN A 57 -10.650 -7.355 -9.100 1.00 0.00 C ATOM 908 CD GLN A 57 -12.066 -7.862 -9.374 1.00 0.00 C ATOM 909 OE1 GLN A 57 -12.375 -9.008 -9.114 1.00 0.00 O ATOM 910 NE2 GLN A 57 -12.948 -7.050 -9.891 1.00 0.00 N ATOM 0 H GLN A 57 -8.746 -6.945 -6.397 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.944 -5.583 -8.877 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -10.730 -6.998 -6.969 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -11.549 -5.778 -7.925 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -10.265 -6.830 -9.974 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.982 -8.195 -8.913 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -12.689 -6.088 -10.109 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -13.896 -7.378 -10.076 1.00 0.00 H new ATOM 919 N TYR A 58 -9.808 -3.822 -6.247 1.00 0.00 N ATOM 920 CA TYR A 58 -10.149 -2.436 -5.823 1.00 0.00 C ATOM 921 C TYR A 58 -9.062 -1.477 -6.326 1.00 0.00 C ATOM 922 O TYR A 58 -9.338 -0.362 -6.718 1.00 0.00 O ATOM 923 CB TYR A 58 -10.249 -2.385 -4.286 1.00 0.00 C ATOM 924 CG TYR A 58 -9.938 -0.993 -3.785 1.00 0.00 C ATOM 925 CD1 TYR A 58 -10.911 0.012 -3.848 1.00 0.00 C ATOM 926 CD2 TYR A 58 -8.671 -0.709 -3.263 1.00 0.00 C ATOM 927 CE1 TYR A 58 -10.614 1.299 -3.387 1.00 0.00 C ATOM 928 CE2 TYR A 58 -8.377 0.579 -2.804 1.00 0.00 C ATOM 929 CZ TYR A 58 -9.349 1.582 -2.866 1.00 0.00 C ATOM 930 OH TYR A 58 -9.058 2.850 -2.415 1.00 0.00 O ATOM 0 H TYR A 58 -9.629 -4.477 -5.486 1.00 0.00 H new ATOM 0 HA TYR A 58 -11.108 -2.136 -6.246 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -11.251 -2.677 -3.970 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -9.555 -3.101 -3.846 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -11.889 -0.206 -4.252 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -7.921 -1.484 -3.215 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -11.364 2.075 -3.434 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -7.399 0.799 -2.402 1.00 0.00 H new ATOM 0 HH TYR A 58 -8.192 2.843 -1.956 1.00 0.00 H new ATOM 940 N SER A 59 -7.828 -1.904 -6.315 1.00 0.00 N ATOM 941 CA SER A 59 -6.729 -1.016 -6.792 1.00 0.00 C ATOM 942 C SER A 59 -7.001 -0.599 -8.239 1.00 0.00 C ATOM 943 O SER A 59 -6.475 0.384 -8.720 1.00 0.00 O ATOM 944 CB SER A 59 -5.399 -1.765 -6.719 1.00 0.00 C ATOM 945 OG SER A 59 -4.392 -0.996 -7.364 1.00 0.00 O ATOM 0 H SER A 59 -7.534 -2.827 -5.997 1.00 0.00 H new ATOM 0 HA SER A 59 -6.681 -0.128 -6.161 1.00 0.00 H new ATOM 0 HB2 SER A 59 -5.126 -1.944 -5.679 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.491 -2.740 -7.197 1.00 0.00 H new ATOM 0 HG SER A 59 -4.194 -0.200 -6.827 1.00 0.00 H new ATOM 951 N LYS A 60 -7.820 -1.338 -8.935 1.00 0.00 N ATOM 952 CA LYS A 60 -8.126 -0.982 -10.348 1.00 0.00 C ATOM 953 C LYS A 60 -9.298 0.001 -10.377 1.00 0.00 C ATOM 954 O LYS A 60 -9.320 0.937 -11.152 1.00 0.00 O ATOM 955 CB LYS A 60 -8.500 -2.249 -11.124 1.00 0.00 C ATOM 956 CG LYS A 60 -9.133 -1.864 -12.463 1.00 0.00 C ATOM 957 CD LYS A 60 -9.125 -3.073 -13.400 1.00 0.00 C ATOM 958 CE LYS A 60 -10.127 -2.850 -14.534 1.00 0.00 C ATOM 959 NZ LYS A 60 -9.400 -2.409 -15.758 1.00 0.00 N ATOM 0 H LYS A 60 -8.290 -2.173 -8.586 1.00 0.00 H new ATOM 0 HA LYS A 60 -7.252 -0.522 -10.808 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -7.613 -2.860 -11.292 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -9.196 -2.852 -10.541 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -10.155 -1.518 -12.308 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -8.582 -1.038 -12.913 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -8.126 -3.223 -13.808 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -9.382 -3.976 -12.847 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -10.676 -3.770 -14.735 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -10.861 -2.098 -14.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -10.080 -2.257 -16.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -8.896 -1.521 -15.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -8.716 -3.141 -16.038 1.00 0.00 H new ATOM 973 N VAL A 61 -10.272 -0.205 -9.534 1.00 0.00 N ATOM 974 CA VAL A 61 -11.443 0.711 -9.504 1.00 0.00 C ATOM 975 C VAL A 61 -11.007 2.073 -8.955 1.00 0.00 C ATOM 976 O VAL A 61 -11.029 3.067 -9.650 1.00 0.00 O ATOM 977 CB VAL A 61 -12.524 0.104 -8.605 1.00 0.00 C ATOM 978 CG1 VAL A 61 -13.553 1.171 -8.231 1.00 0.00 C ATOM 979 CG2 VAL A 61 -13.224 -1.032 -9.353 1.00 0.00 C ATOM 0 H VAL A 61 -10.306 -0.972 -8.863 1.00 0.00 H new ATOM 0 HA VAL A 61 -11.841 0.845 -10.510 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.060 -0.280 -7.697 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -14.318 0.730 -7.592 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.058 1.983 -7.698 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -14.018 1.562 -9.136 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -13.994 -1.467 -8.716 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.682 -0.641 -10.262 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.495 -1.799 -9.615 1.00 0.00 H new ATOM 989 N LEU A 62 -10.614 2.125 -7.712 1.00 0.00 N ATOM 990 CA LEU A 62 -10.180 3.419 -7.112 1.00 0.00 C ATOM 991 C LEU A 62 -9.149 4.091 -8.028 1.00 0.00 C ATOM 992 O LEU A 62 -9.155 5.293 -8.201 1.00 0.00 O ATOM 993 CB LEU A 62 -9.571 3.146 -5.730 1.00 0.00 C ATOM 994 CG LEU A 62 -8.801 4.369 -5.213 1.00 0.00 C ATOM 995 CD1 LEU A 62 -9.735 5.276 -4.406 1.00 0.00 C ATOM 996 CD2 LEU A 62 -7.667 3.885 -4.309 1.00 0.00 C ATOM 0 H LEU A 62 -10.575 1.323 -7.083 1.00 0.00 H new ATOM 0 HA LEU A 62 -11.035 4.087 -7.003 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.361 2.886 -5.026 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -8.901 2.288 -5.788 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.402 4.932 -6.057 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.179 6.141 -4.044 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -10.555 5.612 -5.041 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.137 4.722 -3.558 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.110 4.743 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.083 3.327 -3.470 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.998 3.239 -4.878 1.00 0.00 H new ATOM 1008 N ALA A 63 -8.264 3.332 -8.620 1.00 0.00 N ATOM 1009 CA ALA A 63 -7.248 3.949 -9.521 1.00 0.00 C ATOM 1010 C ALA A 63 -7.953 4.915 -10.479 1.00 0.00 C ATOM 1011 O ALA A 63 -7.513 6.027 -10.690 1.00 0.00 O ATOM 1012 CB ALA A 63 -6.527 2.858 -10.318 1.00 0.00 C ATOM 0 H ALA A 63 -8.201 2.319 -8.519 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.513 4.492 -8.927 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.786 3.316 -10.974 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.029 2.174 -9.631 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.251 2.307 -10.918 1.00 0.00 H new ATOM 1018 N LEU A 64 -9.052 4.501 -11.050 1.00 0.00 N ATOM 1019 CA LEU A 64 -9.798 5.396 -11.982 1.00 0.00 C ATOM 1020 C LEU A 64 -10.512 6.470 -11.168 1.00 0.00 C ATOM 1021 O LEU A 64 -10.518 7.631 -11.514 1.00 0.00 O ATOM 1022 CB LEU A 64 -10.837 4.578 -12.748 1.00 0.00 C ATOM 1023 CG LEU A 64 -10.133 3.683 -13.762 1.00 0.00 C ATOM 1024 CD1 LEU A 64 -11.045 2.512 -14.126 1.00 0.00 C ATOM 1025 CD2 LEU A 64 -9.815 4.492 -15.022 1.00 0.00 C ATOM 0 H LEU A 64 -9.467 3.579 -10.911 1.00 0.00 H new ATOM 0 HA LEU A 64 -9.104 5.857 -12.685 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.421 3.972 -12.055 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.536 5.242 -13.257 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.207 3.303 -13.331 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.543 1.871 -14.851 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.273 1.936 -13.229 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.971 2.892 -14.558 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.312 3.853 -15.747 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -10.741 4.872 -15.454 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.166 5.328 -14.763 1.00 0.00 H new ATOM 1037 N TYR A 65 -11.116 6.079 -10.085 1.00 0.00 N ATOM 1038 CA TYR A 65 -11.839 7.059 -9.227 1.00 0.00 C ATOM 1039 C TYR A 65 -10.999 8.331 -9.079 1.00 0.00 C ATOM 1040 O TYR A 65 -11.517 9.430 -9.043 1.00 0.00 O ATOM 1041 CB TYR A 65 -12.068 6.430 -7.852 1.00 0.00 C ATOM 1042 CG TYR A 65 -12.739 7.425 -6.940 1.00 0.00 C ATOM 1043 CD1 TYR A 65 -11.963 8.316 -6.189 1.00 0.00 C ATOM 1044 CD2 TYR A 65 -14.135 7.449 -6.838 1.00 0.00 C ATOM 1045 CE1 TYR A 65 -12.585 9.234 -5.335 1.00 0.00 C ATOM 1046 CE2 TYR A 65 -14.756 8.368 -5.984 1.00 0.00 C ATOM 1047 CZ TYR A 65 -13.980 9.259 -5.231 1.00 0.00 C ATOM 1048 OH TYR A 65 -14.593 10.165 -4.389 1.00 0.00 O ATOM 0 H TYR A 65 -11.141 5.115 -9.753 1.00 0.00 H new ATOM 0 HA TYR A 65 -12.796 7.317 -9.681 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -12.686 5.537 -7.949 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -11.117 6.114 -7.424 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -10.886 8.295 -6.269 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -14.732 6.760 -7.417 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -11.988 9.923 -4.756 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -15.833 8.390 -5.906 1.00 0.00 H new ATOM 0 HH TYR A 65 -15.565 10.050 -4.436 1.00 0.00 H new ATOM 1058 N ASN A 66 -9.705 8.188 -8.997 1.00 0.00 N ATOM 1059 CA ASN A 66 -8.821 9.379 -8.855 1.00 0.00 C ATOM 1060 C ASN A 66 -8.449 9.900 -10.240 1.00 0.00 C ATOM 1061 O ASN A 66 -8.528 11.078 -10.523 1.00 0.00 O ATOM 1062 CB ASN A 66 -7.545 8.958 -8.144 1.00 0.00 C ATOM 1063 CG ASN A 66 -6.991 10.131 -7.335 1.00 0.00 C ATOM 1064 OD1 ASN A 66 -7.525 10.475 -6.299 1.00 0.00 O ATOM 1065 ND2 ASN A 66 -5.934 10.764 -7.765 1.00 0.00 N ATOM 0 H ASN A 66 -9.219 7.292 -9.022 1.00 0.00 H new ATOM 0 HA ASN A 66 -9.338 10.155 -8.290 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -7.747 8.113 -7.485 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.805 8.625 -8.872 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -5.556 11.547 -7.232 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -5.485 10.476 -8.634 1.00 0.00 H new ATOM 1072 N GLN A 67 -8.040 9.013 -11.103 1.00 0.00 N ATOM 1073 CA GLN A 67 -7.650 9.415 -12.485 1.00 0.00 C ATOM 1074 C GLN A 67 -8.797 10.171 -13.157 1.00 0.00 C ATOM 1075 O GLN A 67 -8.627 10.791 -14.188 1.00 0.00 O ATOM 1076 CB GLN A 67 -7.332 8.157 -13.294 1.00 0.00 C ATOM 1077 CG GLN A 67 -5.845 7.823 -13.159 1.00 0.00 C ATOM 1078 CD GLN A 67 -5.069 8.469 -14.307 1.00 0.00 C ATOM 1079 OE1 GLN A 67 -4.965 9.678 -14.382 1.00 0.00 O ATOM 1080 NE2 GLN A 67 -4.514 7.711 -15.214 1.00 0.00 N ATOM 0 H GLN A 67 -7.958 8.015 -10.908 1.00 0.00 H new ATOM 0 HA GLN A 67 -6.776 10.065 -12.440 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -7.936 7.322 -12.940 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -7.587 8.312 -14.342 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -5.466 8.183 -12.202 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.702 6.743 -13.172 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -4.600 6.696 -15.153 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -3.994 8.133 -15.983 1.00 0.00 H new ATOM 1089 N HIS A 68 -9.962 10.120 -12.583 1.00 0.00 N ATOM 1090 CA HIS A 68 -11.126 10.829 -13.188 1.00 0.00 C ATOM 1091 C HIS A 68 -11.255 12.227 -12.581 1.00 0.00 C ATOM 1092 O HIS A 68 -11.472 13.198 -13.279 1.00 0.00 O ATOM 1093 CB HIS A 68 -12.405 10.036 -12.915 1.00 0.00 C ATOM 1094 CG HIS A 68 -12.641 9.063 -14.035 1.00 0.00 C ATOM 1095 ND1 HIS A 68 -12.102 7.786 -14.036 1.00 0.00 N ATOM 1096 CD2 HIS A 68 -13.358 9.168 -15.200 1.00 0.00 C ATOM 1097 CE1 HIS A 68 -12.500 7.180 -15.169 1.00 0.00 C ATOM 1098 NE2 HIS A 68 -13.268 7.978 -15.915 1.00 0.00 N ATOM 0 H HIS A 68 -10.162 9.617 -11.718 1.00 0.00 H new ATOM 0 HA HIS A 68 -10.973 10.917 -14.264 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -12.320 9.503 -11.968 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -13.253 10.714 -12.824 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -11.511 7.380 -13.310 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -13.909 10.042 -15.514 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -12.231 6.170 -15.442 1.00 0.00 H new ATOM 1106 N ASN A 69 -11.129 12.341 -11.288 1.00 0.00 N ATOM 1107 CA ASN A 69 -11.251 13.680 -10.644 1.00 0.00 C ATOM 1108 C ASN A 69 -9.855 14.294 -10.468 1.00 0.00 C ATOM 1109 O ASN A 69 -8.975 13.666 -9.914 1.00 0.00 O ATOM 1110 CB ASN A 69 -11.912 13.524 -9.273 1.00 0.00 C ATOM 1111 CG ASN A 69 -13.377 13.125 -9.456 1.00 0.00 C ATOM 1112 OD1 ASN A 69 -13.734 12.510 -10.442 1.00 0.00 O ATOM 1113 ND2 ASN A 69 -14.248 13.451 -8.540 1.00 0.00 N ATOM 0 H ASN A 69 -10.947 11.566 -10.650 1.00 0.00 H new ATOM 0 HA ASN A 69 -11.858 14.332 -11.272 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -11.388 12.767 -8.689 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.845 14.459 -8.717 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -15.228 13.190 -8.652 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -13.949 13.967 -7.713 1.00 0.00 H new ATOM 1120 N PRO A 70 -9.691 15.506 -10.943 1.00 0.00 N ATOM 1121 CA PRO A 70 -8.410 16.227 -10.846 1.00 0.00 C ATOM 1122 C PRO A 70 -8.232 16.806 -9.439 1.00 0.00 C ATOM 1123 O PRO A 70 -8.833 17.802 -9.088 1.00 0.00 O ATOM 1124 CB PRO A 70 -8.548 17.346 -11.880 1.00 0.00 C ATOM 1125 CG PRO A 70 -10.065 17.558 -12.094 1.00 0.00 C ATOM 1126 CD PRO A 70 -10.762 16.269 -11.618 1.00 0.00 C ATOM 0 HA PRO A 70 -7.544 15.590 -11.027 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.074 18.262 -11.527 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -8.058 17.074 -12.815 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -10.419 18.421 -11.530 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -10.285 17.752 -13.144 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -11.584 16.489 -10.937 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -11.182 15.711 -12.455 1.00 0.00 H new ATOM 1134 N GLY A 71 -7.413 16.189 -8.632 1.00 0.00 N ATOM 1135 CA GLY A 71 -7.201 16.706 -7.251 1.00 0.00 C ATOM 1136 C GLY A 71 -7.725 15.687 -6.238 1.00 0.00 C ATOM 1137 O GLY A 71 -7.581 15.856 -5.043 1.00 0.00 O ATOM 0 H GLY A 71 -6.882 15.351 -8.869 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -6.141 16.892 -7.080 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.716 17.658 -7.125 1.00 0.00 H new ATOM 1141 N ALA A 72 -8.332 14.628 -6.703 1.00 0.00 N ATOM 1142 CA ALA A 72 -8.860 13.604 -5.769 1.00 0.00 C ATOM 1143 C ALA A 72 -7.711 13.044 -4.943 1.00 0.00 C ATOM 1144 O ALA A 72 -6.752 12.507 -5.460 1.00 0.00 O ATOM 1145 CB ALA A 72 -9.519 12.473 -6.554 1.00 0.00 C ATOM 0 H ALA A 72 -8.483 14.432 -7.692 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.601 14.061 -5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.904 11.725 -5.861 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.340 12.873 -7.149 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.784 12.012 -7.214 1.00 0.00 H new ATOM 1151 N SER A 73 -7.805 13.177 -3.660 1.00 0.00 N ATOM 1152 CA SER A 73 -6.728 12.665 -2.769 1.00 0.00 C ATOM 1153 C SER A 73 -7.129 11.300 -2.206 1.00 0.00 C ATOM 1154 O SER A 73 -6.943 11.023 -1.038 1.00 0.00 O ATOM 1155 CB SER A 73 -6.513 13.647 -1.617 1.00 0.00 C ATOM 1156 OG SER A 73 -7.251 14.834 -1.868 1.00 0.00 O ATOM 0 H SER A 73 -8.587 13.622 -3.180 1.00 0.00 H new ATOM 0 HA SER A 73 -5.805 12.562 -3.340 1.00 0.00 H new ATOM 0 HB2 SER A 73 -6.833 13.198 -0.677 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.453 13.879 -1.515 1.00 0.00 H new ATOM 0 HG SER A 73 -7.116 15.465 -1.130 1.00 0.00 H new ATOM 1162 N ALA A 74 -7.675 10.442 -3.025 1.00 0.00 N ATOM 1163 CA ALA A 74 -8.081 9.098 -2.525 1.00 0.00 C ATOM 1164 C ALA A 74 -7.533 8.017 -3.459 1.00 0.00 C ATOM 1165 O ALA A 74 -7.955 6.877 -3.422 1.00 0.00 O ATOM 1166 CB ALA A 74 -9.608 9.007 -2.471 1.00 0.00 C ATOM 0 H ALA A 74 -7.857 10.613 -4.014 1.00 0.00 H new ATOM 0 HA ALA A 74 -7.677 8.949 -1.524 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.901 8.023 -2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.995 9.774 -1.800 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.017 9.159 -3.470 1.00 0.00 H new ATOM 1172 N ALA A 75 -6.587 8.362 -4.290 1.00 0.00 N ATOM 1173 CA ALA A 75 -6.002 7.352 -5.218 1.00 0.00 C ATOM 1174 C ALA A 75 -5.541 6.138 -4.400 1.00 0.00 C ATOM 1175 O ALA A 75 -5.773 6.086 -3.209 1.00 0.00 O ATOM 1176 CB ALA A 75 -4.810 7.979 -5.944 1.00 0.00 C ATOM 0 H ALA A 75 -6.194 9.300 -4.366 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.742 7.033 -5.952 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.374 7.249 -6.626 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -5.145 8.849 -6.509 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.061 8.287 -5.215 1.00 0.00 H new ATOM 1182 N PRO A 76 -4.905 5.192 -5.052 1.00 0.00 N ATOM 1183 CA PRO A 76 -4.417 3.977 -4.379 1.00 0.00 C ATOM 1184 C PRO A 76 -3.134 4.285 -3.612 1.00 0.00 C ATOM 1185 O PRO A 76 -2.841 5.425 -3.312 1.00 0.00 O ATOM 1186 CB PRO A 76 -4.151 3.006 -5.530 1.00 0.00 C ATOM 1187 CG PRO A 76 -3.950 3.874 -6.791 1.00 0.00 C ATOM 1188 CD PRO A 76 -4.611 5.237 -6.500 1.00 0.00 C ATOM 0 HA PRO A 76 -5.120 3.573 -3.651 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -3.268 2.399 -5.331 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -4.987 2.319 -5.660 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -2.890 3.997 -7.011 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.404 3.402 -7.662 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -3.945 6.064 -6.746 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.519 5.373 -7.087 1.00 0.00 H new ATOM 1196 N CYS A 77 -2.367 3.285 -3.284 1.00 0.00 N ATOM 1197 CA CYS A 77 -1.113 3.546 -2.530 1.00 0.00 C ATOM 1198 C CYS A 77 -0.016 2.568 -2.957 1.00 0.00 C ATOM 1199 O CYS A 77 0.070 1.463 -2.461 1.00 0.00 O ATOM 1200 CB CYS A 77 -1.383 3.386 -1.033 1.00 0.00 C ATOM 1201 SG CYS A 77 -0.979 4.932 -0.184 1.00 0.00 S ATOM 0 H CYS A 77 -2.552 2.306 -3.503 1.00 0.00 H new ATOM 0 HA CYS A 77 -0.778 4.561 -2.743 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -2.429 3.129 -0.866 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -0.785 2.569 -0.629 1.00 0.00 H new ATOM 1206 N CYS A 78 0.833 2.972 -3.864 1.00 0.00 N ATOM 1207 CA CYS A 78 1.937 2.070 -4.303 1.00 0.00 C ATOM 1208 C CYS A 78 2.711 1.613 -3.057 1.00 0.00 C ATOM 1209 O CYS A 78 2.992 2.400 -2.174 1.00 0.00 O ATOM 1210 CB CYS A 78 2.866 2.837 -5.254 1.00 0.00 C ATOM 1211 SG CYS A 78 4.296 1.809 -5.682 1.00 0.00 S ATOM 0 H CYS A 78 0.810 3.885 -4.319 1.00 0.00 H new ATOM 0 HA CYS A 78 1.539 1.200 -4.826 1.00 0.00 H new ATOM 0 HB2 CYS A 78 2.325 3.117 -6.158 1.00 0.00 H new ATOM 0 HB3 CYS A 78 3.200 3.762 -4.783 1.00 0.00 H new ATOM 1216 N VAL A 79 3.037 0.349 -2.960 1.00 0.00 N ATOM 1217 CA VAL A 79 3.762 -0.140 -1.752 1.00 0.00 C ATOM 1218 C VAL A 79 4.841 -1.159 -2.157 1.00 0.00 C ATOM 1219 O VAL A 79 4.895 -1.573 -3.292 1.00 0.00 O ATOM 1220 CB VAL A 79 2.744 -0.783 -0.798 1.00 0.00 C ATOM 1221 CG1 VAL A 79 1.429 -0.014 -0.879 1.00 0.00 C ATOM 1222 CG2 VAL A 79 2.491 -2.242 -1.192 1.00 0.00 C ATOM 0 H VAL A 79 2.833 -0.362 -3.663 1.00 0.00 H new ATOM 0 HA VAL A 79 4.257 0.693 -1.252 1.00 0.00 H new ATOM 0 HB VAL A 79 3.141 -0.751 0.217 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.702 -0.465 -0.204 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.596 1.024 -0.591 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.048 -0.051 -1.900 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.768 -2.684 -0.507 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.099 -2.282 -2.208 1.00 0.00 H new ATOM 0 HG23 VAL A 79 3.426 -2.800 -1.142 1.00 0.00 H new ATOM 1232 N PRO A 80 5.672 -1.530 -1.211 1.00 0.00 N ATOM 1233 CA PRO A 80 6.764 -2.494 -1.445 1.00 0.00 C ATOM 1234 C PRO A 80 6.221 -3.925 -1.495 1.00 0.00 C ATOM 1235 O PRO A 80 5.959 -4.536 -0.478 1.00 0.00 O ATOM 1236 CB PRO A 80 7.685 -2.297 -0.239 1.00 0.00 C ATOM 1237 CG PRO A 80 6.818 -1.665 0.873 1.00 0.00 C ATOM 1238 CD PRO A 80 5.598 -1.032 0.178 1.00 0.00 C ATOM 0 HA PRO A 80 7.276 -2.336 -2.394 1.00 0.00 H new ATOM 0 HB2 PRO A 80 8.104 -3.248 0.089 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.524 -1.649 -0.493 1.00 0.00 H new ATOM 0 HG2 PRO A 80 6.504 -2.419 1.594 1.00 0.00 H new ATOM 0 HG3 PRO A 80 7.383 -0.913 1.424 1.00 0.00 H new ATOM 0 HD2 PRO A 80 4.667 -1.331 0.659 1.00 0.00 H new ATOM 0 HD3 PRO A 80 5.640 0.057 0.213 1.00 0.00 H new ATOM 1246 N GLN A 81 6.056 -4.465 -2.672 1.00 0.00 N ATOM 1247 CA GLN A 81 5.535 -5.854 -2.790 1.00 0.00 C ATOM 1248 C GLN A 81 6.606 -6.836 -2.319 1.00 0.00 C ATOM 1249 O GLN A 81 6.423 -7.554 -1.356 1.00 0.00 O ATOM 1250 CB GLN A 81 5.189 -6.139 -4.252 1.00 0.00 C ATOM 1251 CG GLN A 81 4.301 -7.380 -4.328 1.00 0.00 C ATOM 1252 CD GLN A 81 3.995 -7.702 -5.793 1.00 0.00 C ATOM 1253 OE1 GLN A 81 3.206 -7.027 -6.423 1.00 0.00 O ATOM 1254 NE2 GLN A 81 4.591 -8.712 -6.364 1.00 0.00 N ATOM 0 H GLN A 81 6.260 -4.002 -3.558 1.00 0.00 H new ATOM 0 HA GLN A 81 4.642 -5.967 -2.175 1.00 0.00 H new ATOM 0 HB2 GLN A 81 4.675 -5.283 -4.690 1.00 0.00 H new ATOM 0 HB3 GLN A 81 6.100 -6.294 -4.830 1.00 0.00 H new ATOM 0 HG2 GLN A 81 4.800 -8.226 -3.855 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.374 -7.210 -3.781 1.00 0.00 H new ATOM 0 HE21 GLN A 81 5.254 -9.279 -5.835 1.00 0.00 H new ATOM 0 HE22 GLN A 81 4.394 -8.935 -7.340 1.00 0.00 H new ATOM 1263 N ALA A 82 7.727 -6.869 -2.985 1.00 0.00 N ATOM 1264 CA ALA A 82 8.813 -7.800 -2.571 1.00 0.00 C ATOM 1265 C ALA A 82 9.809 -7.039 -1.697 1.00 0.00 C ATOM 1266 O ALA A 82 9.925 -5.833 -1.780 1.00 0.00 O ATOM 1267 CB ALA A 82 9.527 -8.339 -3.812 1.00 0.00 C ATOM 0 H ALA A 82 7.938 -6.291 -3.799 1.00 0.00 H new ATOM 0 HA ALA A 82 8.392 -8.635 -2.011 1.00 0.00 H new ATOM 0 HB1 ALA A 82 10.322 -9.020 -3.508 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.813 -8.872 -4.440 1.00 0.00 H new ATOM 0 HB3 ALA A 82 9.956 -7.509 -4.374 1.00 0.00 H new ATOM 1273 N LEU A 83 10.527 -7.729 -0.854 1.00 0.00 N ATOM 1274 CA LEU A 83 11.504 -7.029 0.022 1.00 0.00 C ATOM 1275 C LEU A 83 12.807 -7.817 0.077 1.00 0.00 C ATOM 1276 O LEU A 83 13.040 -8.729 -0.690 1.00 0.00 O ATOM 1277 CB LEU A 83 10.937 -6.917 1.439 1.00 0.00 C ATOM 1278 CG LEU A 83 9.676 -6.066 1.412 1.00 0.00 C ATOM 1279 CD1 LEU A 83 8.720 -6.531 2.510 1.00 0.00 C ATOM 1280 CD2 LEU A 83 10.051 -4.605 1.654 1.00 0.00 C ATOM 0 H LEU A 83 10.479 -8.741 -0.735 1.00 0.00 H new ATOM 0 HA LEU A 83 11.691 -6.035 -0.384 1.00 0.00 H new ATOM 0 HB2 LEU A 83 10.712 -7.908 1.832 1.00 0.00 H new ATOM 0 HB3 LEU A 83 11.676 -6.471 2.104 1.00 0.00 H new ATOM 0 HG LEU A 83 9.189 -6.167 0.442 1.00 0.00 H new ATOM 0 HD11 LEU A 83 7.817 -5.920 2.489 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.456 -7.575 2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 83 9.204 -6.429 3.481 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.151 -3.990 1.636 1.00 0.00 H new ATOM 0 HD22 LEU A 83 10.536 -4.510 2.626 1.00 0.00 H new ATOM 0 HD23 LEU A 83 10.734 -4.271 0.873 1.00 0.00 H new ATOM 1292 N GLU A 84 13.650 -7.464 0.998 1.00 0.00 N ATOM 1293 CA GLU A 84 14.947 -8.170 1.152 1.00 0.00 C ATOM 1294 C GLU A 84 15.366 -8.095 2.620 1.00 0.00 C ATOM 1295 O GLU A 84 14.869 -7.270 3.358 1.00 0.00 O ATOM 1296 CB GLU A 84 16.009 -7.497 0.278 1.00 0.00 C ATOM 1297 CG GLU A 84 15.993 -8.123 -1.118 1.00 0.00 C ATOM 1298 CD GLU A 84 17.292 -7.777 -1.849 1.00 0.00 C ATOM 1299 OE1 GLU A 84 18.277 -8.460 -1.621 1.00 0.00 O ATOM 1300 OE2 GLU A 84 17.280 -6.834 -2.623 1.00 0.00 O ATOM 0 H GLU A 84 13.494 -6.705 1.661 1.00 0.00 H new ATOM 0 HA GLU A 84 14.845 -9.210 0.843 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.815 -6.427 0.210 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.994 -7.614 0.729 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.884 -9.205 -1.042 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.137 -7.755 -1.683 1.00 0.00 H new ATOM 1307 N PRO A 85 16.266 -8.958 3.002 1.00 0.00 N ATOM 1308 CA PRO A 85 16.765 -9.012 4.384 1.00 0.00 C ATOM 1309 C PRO A 85 17.733 -7.856 4.651 1.00 0.00 C ATOM 1310 O PRO A 85 17.766 -6.882 3.926 1.00 0.00 O ATOM 1311 CB PRO A 85 17.464 -10.370 4.463 1.00 0.00 C ATOM 1312 CG PRO A 85 17.805 -10.770 3.009 1.00 0.00 C ATOM 1313 CD PRO A 85 16.870 -9.954 2.097 1.00 0.00 C ATOM 0 HA PRO A 85 15.979 -8.911 5.132 1.00 0.00 H new ATOM 0 HB2 PRO A 85 18.367 -10.307 5.071 1.00 0.00 H new ATOM 0 HB3 PRO A 85 16.817 -11.113 4.929 1.00 0.00 H new ATOM 0 HG2 PRO A 85 18.850 -10.556 2.783 1.00 0.00 H new ATOM 0 HG3 PRO A 85 17.658 -11.839 2.857 1.00 0.00 H new ATOM 0 HD2 PRO A 85 17.421 -9.475 1.287 1.00 0.00 H new ATOM 0 HD3 PRO A 85 16.111 -10.586 1.636 1.00 0.00 H new ATOM 1321 N LEU A 86 18.503 -7.943 5.701 1.00 0.00 N ATOM 1322 CA LEU A 86 19.443 -6.835 6.028 1.00 0.00 C ATOM 1323 C LEU A 86 20.476 -7.318 7.061 1.00 0.00 C ATOM 1324 O LEU A 86 20.144 -7.547 8.203 1.00 0.00 O ATOM 1325 CB LEU A 86 18.604 -5.657 6.568 1.00 0.00 C ATOM 1326 CG LEU A 86 19.352 -4.875 7.654 1.00 0.00 C ATOM 1327 CD1 LEU A 86 20.541 -4.125 7.062 1.00 0.00 C ATOM 1328 CD2 LEU A 86 18.399 -3.866 8.297 1.00 0.00 C ATOM 0 H LEU A 86 18.521 -8.733 6.346 1.00 0.00 H new ATOM 0 HA LEU A 86 19.996 -6.511 5.147 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.349 -4.986 5.748 1.00 0.00 H new ATOM 0 HB3 LEU A 86 17.666 -6.035 6.974 1.00 0.00 H new ATOM 0 HG LEU A 86 19.717 -5.582 8.399 1.00 0.00 H new ATOM 0 HD11 LEU A 86 21.056 -3.578 7.852 1.00 0.00 H new ATOM 0 HD12 LEU A 86 21.229 -4.836 6.605 1.00 0.00 H new ATOM 0 HD13 LEU A 86 20.189 -3.424 6.305 1.00 0.00 H new ATOM 0 HD21 LEU A 86 18.927 -3.308 9.070 1.00 0.00 H new ATOM 0 HD22 LEU A 86 18.033 -3.176 7.537 1.00 0.00 H new ATOM 0 HD23 LEU A 86 17.556 -4.394 8.743 1.00 0.00 H new ATOM 1340 N PRO A 87 21.708 -7.453 6.628 1.00 0.00 N ATOM 1341 CA PRO A 87 22.810 -7.898 7.502 1.00 0.00 C ATOM 1342 C PRO A 87 23.237 -6.746 8.409 1.00 0.00 C ATOM 1343 O PRO A 87 23.748 -5.741 7.956 1.00 0.00 O ATOM 1344 CB PRO A 87 23.922 -8.277 6.520 1.00 0.00 C ATOM 1345 CG PRO A 87 23.620 -7.519 5.207 1.00 0.00 C ATOM 1346 CD PRO A 87 22.119 -7.172 5.236 1.00 0.00 C ATOM 0 HA PRO A 87 22.545 -8.727 8.158 1.00 0.00 H new ATOM 0 HB2 PRO A 87 24.900 -7.998 6.914 1.00 0.00 H new ATOM 0 HB3 PRO A 87 23.941 -9.354 6.351 1.00 0.00 H new ATOM 0 HG2 PRO A 87 24.225 -6.616 5.133 1.00 0.00 H new ATOM 0 HG3 PRO A 87 23.859 -8.135 4.340 1.00 0.00 H new ATOM 0 HD2 PRO A 87 21.946 -6.128 4.973 1.00 0.00 H new ATOM 0 HD3 PRO A 87 21.557 -7.777 4.525 1.00 0.00 H new ATOM 1354 N ILE A 88 23.013 -6.873 9.687 1.00 0.00 N ATOM 1355 CA ILE A 88 23.385 -5.772 10.613 1.00 0.00 C ATOM 1356 C ILE A 88 24.269 -6.293 11.739 1.00 0.00 C ATOM 1357 O ILE A 88 24.853 -7.355 11.662 1.00 0.00 O ATOM 1358 CB ILE A 88 22.113 -5.178 11.224 1.00 0.00 C ATOM 1359 CG1 ILE A 88 21.594 -6.104 12.330 1.00 0.00 C ATOM 1360 CG2 ILE A 88 21.050 -5.051 10.142 1.00 0.00 C ATOM 1361 CD1 ILE A 88 20.210 -5.651 12.784 1.00 0.00 C ATOM 0 H ILE A 88 22.590 -7.690 10.128 1.00 0.00 H new ATOM 0 HA ILE A 88 23.931 -5.014 10.051 1.00 0.00 H new ATOM 0 HB ILE A 88 22.336 -4.197 11.643 1.00 0.00 H new ATOM 0 HG12 ILE A 88 21.548 -7.130 11.965 1.00 0.00 H new ATOM 0 HG13 ILE A 88 22.283 -6.097 13.175 1.00 0.00 H new ATOM 0 HG21 ILE A 88 20.142 -4.628 10.572 1.00 0.00 H new ATOM 0 HG22 ILE A 88 21.414 -4.398 9.349 1.00 0.00 H new ATOM 0 HG23 ILE A 88 20.832 -6.036 9.729 1.00 0.00 H new ATOM 0 HD11 ILE A 88 19.849 -6.315 13.570 1.00 0.00 H new ATOM 0 HD12 ILE A 88 20.268 -4.632 13.168 1.00 0.00 H new ATOM 0 HD13 ILE A 88 19.522 -5.682 11.939 1.00 0.00 H new ATOM 1373 N VAL A 89 24.327 -5.540 12.796 1.00 0.00 N ATOM 1374 CA VAL A 89 25.125 -5.930 13.984 1.00 0.00 C ATOM 1375 C VAL A 89 24.670 -5.071 15.159 1.00 0.00 C ATOM 1376 O VAL A 89 24.889 -3.878 15.181 1.00 0.00 O ATOM 1377 CB VAL A 89 26.615 -5.676 13.743 1.00 0.00 C ATOM 1378 CG1 VAL A 89 27.418 -6.334 14.863 1.00 0.00 C ATOM 1379 CG2 VAL A 89 27.044 -6.262 12.395 1.00 0.00 C ATOM 0 H VAL A 89 23.842 -4.648 12.888 1.00 0.00 H new ATOM 0 HA VAL A 89 24.978 -6.991 14.185 1.00 0.00 H new ATOM 0 HB VAL A 89 26.799 -4.602 13.731 1.00 0.00 H new ATOM 0 HG11 VAL A 89 28.481 -6.158 14.700 1.00 0.00 H new ATOM 0 HG12 VAL A 89 27.123 -5.907 15.822 1.00 0.00 H new ATOM 0 HG13 VAL A 89 27.224 -7.407 14.868 1.00 0.00 H new ATOM 0 HG21 VAL A 89 28.106 -6.073 12.238 1.00 0.00 H new ATOM 0 HG22 VAL A 89 26.862 -7.337 12.391 1.00 0.00 H new ATOM 0 HG23 VAL A 89 26.470 -5.794 11.595 1.00 0.00 H new ATOM 1389 N TYR A 90 24.030 -5.654 16.127 1.00 0.00 N ATOM 1390 CA TYR A 90 23.559 -4.844 17.281 1.00 0.00 C ATOM 1391 C TYR A 90 24.163 -5.374 18.577 1.00 0.00 C ATOM 1392 O TYR A 90 25.025 -6.228 18.572 1.00 0.00 O ATOM 1393 CB TYR A 90 22.034 -4.905 17.357 1.00 0.00 C ATOM 1394 CG TYR A 90 21.553 -6.288 16.991 1.00 0.00 C ATOM 1395 CD1 TYR A 90 21.404 -6.637 15.645 1.00 0.00 C ATOM 1396 CD2 TYR A 90 21.248 -7.215 17.993 1.00 0.00 C ATOM 1397 CE1 TYR A 90 20.949 -7.915 15.298 1.00 0.00 C ATOM 1398 CE2 TYR A 90 20.793 -8.493 17.646 1.00 0.00 C ATOM 1399 CZ TYR A 90 20.643 -8.843 16.300 1.00 0.00 C ATOM 1400 OH TYR A 90 20.195 -10.103 15.960 1.00 0.00 O ATOM 0 H TYR A 90 23.813 -6.650 16.171 1.00 0.00 H new ATOM 0 HA TYR A 90 23.875 -3.810 17.144 1.00 0.00 H new ATOM 0 HB2 TYR A 90 21.701 -4.650 18.363 1.00 0.00 H new ATOM 0 HB3 TYR A 90 21.598 -4.169 16.681 1.00 0.00 H new ATOM 0 HD1 TYR A 90 21.640 -5.920 14.872 1.00 0.00 H new ATOM 0 HD2 TYR A 90 21.363 -6.946 19.032 1.00 0.00 H new ATOM 0 HE1 TYR A 90 20.834 -8.184 14.258 1.00 0.00 H new ATOM 0 HE2 TYR A 90 20.557 -9.210 18.419 1.00 0.00 H new ATOM 0 HH TYR A 90 20.030 -10.622 16.775 1.00 0.00 H new ATOM 1410 N TYR A 91 23.727 -4.856 19.691 1.00 0.00 N ATOM 1411 CA TYR A 91 24.284 -5.309 20.990 1.00 0.00 C ATOM 1412 C TYR A 91 23.161 -5.724 21.937 1.00 0.00 C ATOM 1413 O TYR A 91 22.206 -5.003 22.146 1.00 0.00 O ATOM 1414 CB TYR A 91 25.053 -4.158 21.630 1.00 0.00 C ATOM 1415 CG TYR A 91 26.500 -4.228 21.228 1.00 0.00 C ATOM 1416 CD1 TYR A 91 27.405 -4.958 22.003 1.00 0.00 C ATOM 1417 CD2 TYR A 91 26.937 -3.549 20.089 1.00 0.00 C ATOM 1418 CE1 TYR A 91 28.752 -5.010 21.642 1.00 0.00 C ATOM 1419 CE2 TYR A 91 28.288 -3.602 19.721 1.00 0.00 C ATOM 1420 CZ TYR A 91 29.197 -4.331 20.499 1.00 0.00 C ATOM 1421 OH TYR A 91 30.528 -4.381 20.140 1.00 0.00 O ATOM 0 H TYR A 91 23.007 -4.137 19.755 1.00 0.00 H new ATOM 0 HA TYR A 91 24.940 -6.161 20.812 1.00 0.00 H new ATOM 0 HB2 TYR A 91 24.625 -3.205 21.319 1.00 0.00 H new ATOM 0 HB3 TYR A 91 24.965 -4.208 22.715 1.00 0.00 H new ATOM 0 HD1 TYR A 91 27.062 -5.483 22.882 1.00 0.00 H new ATOM 0 HD2 TYR A 91 26.235 -2.984 19.493 1.00 0.00 H new ATOM 0 HE1 TYR A 91 29.451 -5.573 22.243 1.00 0.00 H new ATOM 0 HE2 TYR A 91 28.628 -3.081 18.838 1.00 0.00 H new ATOM 0 HH TYR A 91 30.666 -3.858 19.323 1.00 0.00 H new ATOM 1431 N VAL A 92 23.294 -6.866 22.542 1.00 0.00 N ATOM 1432 CA VAL A 92 22.270 -7.324 23.516 1.00 0.00 C ATOM 1433 C VAL A 92 22.890 -7.236 24.902 1.00 0.00 C ATOM 1434 O VAL A 92 23.556 -8.145 25.356 1.00 0.00 O ATOM 1435 CB VAL A 92 21.867 -8.766 23.229 1.00 0.00 C ATOM 1436 CG1 VAL A 92 20.415 -8.966 23.659 1.00 0.00 C ATOM 1437 CG2 VAL A 92 22.008 -9.053 21.734 1.00 0.00 C ATOM 0 H VAL A 92 24.074 -7.508 22.403 1.00 0.00 H new ATOM 0 HA VAL A 92 21.377 -6.703 23.444 1.00 0.00 H new ATOM 0 HB VAL A 92 22.513 -9.448 23.782 1.00 0.00 H new ATOM 0 HG11 VAL A 92 20.115 -9.994 23.459 1.00 0.00 H new ATOM 0 HG12 VAL A 92 20.320 -8.761 24.725 1.00 0.00 H new ATOM 0 HG13 VAL A 92 19.773 -8.285 23.100 1.00 0.00 H new ATOM 0 HG21 VAL A 92 21.719 -10.085 21.533 1.00 0.00 H new ATOM 0 HG22 VAL A 92 21.362 -8.379 21.172 1.00 0.00 H new ATOM 0 HG23 VAL A 92 23.044 -8.900 21.430 1.00 0.00 H new ATOM 1447 N GLY A 93 22.707 -6.135 25.565 1.00 0.00 N ATOM 1448 CA GLY A 93 23.321 -5.970 26.909 1.00 0.00 C ATOM 1449 C GLY A 93 24.816 -5.691 26.723 1.00 0.00 C ATOM 1450 O GLY A 93 25.256 -4.559 26.762 1.00 0.00 O ATOM 0 H GLY A 93 22.159 -5.340 25.236 1.00 0.00 H new ATOM 0 HA2 GLY A 93 22.845 -5.149 27.446 1.00 0.00 H new ATOM 0 HA3 GLY A 93 23.174 -6.869 27.507 1.00 0.00 H new ATOM 1454 N ARG A 94 25.599 -6.717 26.519 1.00 0.00 N ATOM 1455 CA ARG A 94 27.070 -6.515 26.328 1.00 0.00 C ATOM 1456 C ARG A 94 27.611 -7.465 25.253 1.00 0.00 C ATOM 1457 O ARG A 94 28.774 -7.413 24.902 1.00 0.00 O ATOM 1458 CB ARG A 94 27.784 -6.808 27.643 1.00 0.00 C ATOM 1459 CG ARG A 94 27.319 -5.820 28.715 1.00 0.00 C ATOM 1460 CD ARG A 94 28.206 -4.573 28.677 1.00 0.00 C ATOM 1461 NE ARG A 94 28.365 -4.032 30.055 1.00 0.00 N ATOM 1462 CZ ARG A 94 27.467 -3.225 30.551 1.00 0.00 C ATOM 1463 NH1 ARG A 94 26.198 -3.459 30.357 1.00 0.00 N ATOM 1464 NH2 ARG A 94 27.840 -2.183 31.244 1.00 0.00 N ATOM 0 H ARG A 94 25.286 -7.687 26.476 1.00 0.00 H new ATOM 0 HA ARG A 94 27.246 -5.486 26.014 1.00 0.00 H new ATOM 0 HB2 ARG A 94 27.575 -7.829 27.961 1.00 0.00 H new ATOM 0 HB3 ARG A 94 28.863 -6.731 27.507 1.00 0.00 H new ATOM 0 HG2 ARG A 94 26.278 -5.545 28.544 1.00 0.00 H new ATOM 0 HG3 ARG A 94 27.368 -6.285 29.700 1.00 0.00 H new ATOM 0 HD2 ARG A 94 29.181 -4.821 28.258 1.00 0.00 H new ATOM 0 HD3 ARG A 94 27.762 -3.818 28.028 1.00 0.00 H new ATOM 0 HE ARG A 94 29.178 -4.293 30.613 1.00 0.00 H new ATOM 0 HH11 ARG A 94 25.906 -4.274 29.817 1.00 0.00 H new ATOM 0 HH12 ARG A 94 25.498 -2.827 30.745 1.00 0.00 H new ATOM 0 HH21 ARG A 94 28.832 -2.001 31.397 1.00 0.00 H new ATOM 0 HH22 ARG A 94 27.140 -1.551 31.632 1.00 0.00 H new ATOM 1478 N LYS A 95 26.794 -8.336 24.733 1.00 0.00 N ATOM 1479 CA LYS A 95 27.281 -9.286 23.693 1.00 0.00 C ATOM 1480 C LYS A 95 26.782 -8.840 22.315 1.00 0.00 C ATOM 1481 O LYS A 95 25.592 -8.785 22.085 1.00 0.00 O ATOM 1482 CB LYS A 95 26.739 -10.684 23.995 1.00 0.00 C ATOM 1483 CG LYS A 95 27.903 -11.635 24.276 1.00 0.00 C ATOM 1484 CD LYS A 95 27.468 -13.073 23.980 1.00 0.00 C ATOM 1485 CE LYS A 95 28.678 -13.886 23.518 1.00 0.00 C ATOM 1486 NZ LYS A 95 29.879 -13.480 24.301 1.00 0.00 N ATOM 0 H LYS A 95 25.810 -8.432 24.982 1.00 0.00 H new ATOM 0 HA LYS A 95 28.371 -9.302 23.698 1.00 0.00 H new ATOM 0 HB2 LYS A 95 26.070 -10.648 24.855 1.00 0.00 H new ATOM 0 HB3 LYS A 95 26.154 -11.049 23.151 1.00 0.00 H new ATOM 0 HG2 LYS A 95 28.761 -11.369 23.659 1.00 0.00 H new ATOM 0 HG3 LYS A 95 28.217 -11.545 25.316 1.00 0.00 H new ATOM 0 HD2 LYS A 95 27.033 -13.524 24.872 1.00 0.00 H new ATOM 0 HD3 LYS A 95 26.696 -13.080 23.210 1.00 0.00 H new ATOM 0 HE2 LYS A 95 28.487 -14.951 23.652 1.00 0.00 H new ATOM 0 HE3 LYS A 95 28.853 -13.725 22.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 30.549 -14.274 24.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 30.335 -12.667 23.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 29.592 -13.216 25.265 1.00 0.00 H new ATOM 1500 N PRO A 96 27.700 -8.539 21.430 1.00 0.00 N ATOM 1501 CA PRO A 96 27.363 -8.100 20.066 1.00 0.00 C ATOM 1502 C PRO A 96 26.913 -9.296 19.220 1.00 0.00 C ATOM 1503 O PRO A 96 27.487 -10.364 19.288 1.00 0.00 O ATOM 1504 CB PRO A 96 28.674 -7.513 19.539 1.00 0.00 C ATOM 1505 CG PRO A 96 29.804 -8.140 20.389 1.00 0.00 C ATOM 1506 CD PRO A 96 29.151 -8.617 21.700 1.00 0.00 C ATOM 0 HA PRO A 96 26.544 -7.381 20.035 1.00 0.00 H new ATOM 0 HB2 PRO A 96 28.807 -7.746 18.483 1.00 0.00 H new ATOM 0 HB3 PRO A 96 28.677 -6.427 19.629 1.00 0.00 H new ATOM 0 HG2 PRO A 96 30.269 -8.973 19.862 1.00 0.00 H new ATOM 0 HG3 PRO A 96 30.589 -7.411 20.589 1.00 0.00 H new ATOM 0 HD2 PRO A 96 29.456 -9.633 21.950 1.00 0.00 H new ATOM 0 HD3 PRO A 96 29.435 -7.983 22.540 1.00 0.00 H new ATOM 1514 N LYS A 97 25.887 -9.129 18.428 1.00 0.00 N ATOM 1515 CA LYS A 97 25.404 -10.262 17.591 1.00 0.00 C ATOM 1516 C LYS A 97 24.994 -9.752 16.206 1.00 0.00 C ATOM 1517 O LYS A 97 24.189 -8.850 16.079 1.00 0.00 O ATOM 1518 CB LYS A 97 24.192 -10.910 18.265 1.00 0.00 C ATOM 1519 CG LYS A 97 24.533 -11.254 19.716 1.00 0.00 C ATOM 1520 CD LYS A 97 24.173 -12.714 19.994 1.00 0.00 C ATOM 1521 CE LYS A 97 24.661 -13.104 21.390 1.00 0.00 C ATOM 1522 NZ LYS A 97 25.017 -14.551 21.406 1.00 0.00 N ATOM 0 H LYS A 97 25.365 -8.259 18.326 1.00 0.00 H new ATOM 0 HA LYS A 97 26.205 -10.993 17.484 1.00 0.00 H new ATOM 0 HB2 LYS A 97 23.340 -10.232 18.232 1.00 0.00 H new ATOM 0 HB3 LYS A 97 23.902 -11.812 17.726 1.00 0.00 H new ATOM 0 HG2 LYS A 97 25.595 -11.089 19.900 1.00 0.00 H new ATOM 0 HG3 LYS A 97 23.987 -10.598 20.394 1.00 0.00 H new ATOM 0 HD2 LYS A 97 23.094 -12.853 19.922 1.00 0.00 H new ATOM 0 HD3 LYS A 97 24.629 -13.361 19.244 1.00 0.00 H new ATOM 0 HE2 LYS A 97 25.527 -12.502 21.665 1.00 0.00 H new ATOM 0 HE3 LYS A 97 23.885 -12.901 22.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 25.349 -14.816 22.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 24.180 -15.117 21.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 25.771 -14.731 20.713 1.00 0.00 H new ATOM 1536 N VAL A 98 25.534 -10.331 15.167 1.00 0.00 N ATOM 1537 CA VAL A 98 25.167 -9.891 13.790 1.00 0.00 C ATOM 1538 C VAL A 98 23.986 -10.728 13.302 1.00 0.00 C ATOM 1539 O VAL A 98 23.941 -11.925 13.509 1.00 0.00 O ATOM 1540 CB VAL A 98 26.354 -10.104 12.849 1.00 0.00 C ATOM 1541 CG1 VAL A 98 25.971 -9.662 11.435 1.00 0.00 C ATOM 1542 CG2 VAL A 98 27.547 -9.282 13.337 1.00 0.00 C ATOM 0 H VAL A 98 26.214 -11.090 15.213 1.00 0.00 H new ATOM 0 HA VAL A 98 24.899 -8.834 13.802 1.00 0.00 H new ATOM 0 HB VAL A 98 26.623 -11.160 12.838 1.00 0.00 H new ATOM 0 HG11 VAL A 98 26.817 -9.814 10.765 1.00 0.00 H new ATOM 0 HG12 VAL A 98 25.122 -10.251 11.087 1.00 0.00 H new ATOM 0 HG13 VAL A 98 25.701 -8.606 11.445 1.00 0.00 H new ATOM 0 HG21 VAL A 98 28.393 -9.434 12.666 1.00 0.00 H new ATOM 0 HG22 VAL A 98 27.280 -8.225 13.350 1.00 0.00 H new ATOM 0 HG23 VAL A 98 27.820 -9.600 14.343 1.00 0.00 H new ATOM 1552 N GLU A 99 23.026 -10.122 12.658 1.00 0.00 N ATOM 1553 CA GLU A 99 21.864 -10.911 12.172 1.00 0.00 C ATOM 1554 C GLU A 99 21.524 -10.506 10.743 1.00 0.00 C ATOM 1555 O GLU A 99 22.339 -9.971 10.019 1.00 0.00 O ATOM 1556 CB GLU A 99 20.655 -10.647 13.065 1.00 0.00 C ATOM 1557 CG GLU A 99 20.119 -11.973 13.609 1.00 0.00 C ATOM 1558 CD GLU A 99 18.589 -11.948 13.602 1.00 0.00 C ATOM 1559 OE1 GLU A 99 18.035 -10.983 13.105 1.00 0.00 O ATOM 1560 OE2 GLU A 99 18.000 -12.896 14.094 1.00 0.00 O ATOM 0 H GLU A 99 22.997 -9.124 12.450 1.00 0.00 H new ATOM 0 HA GLU A 99 22.119 -11.970 12.200 1.00 0.00 H new ATOM 0 HB2 GLU A 99 20.935 -9.991 13.889 1.00 0.00 H new ATOM 0 HB3 GLU A 99 19.878 -10.134 12.499 1.00 0.00 H new ATOM 0 HG2 GLU A 99 20.482 -12.801 13.000 1.00 0.00 H new ATOM 0 HG3 GLU A 99 20.486 -12.137 14.622 1.00 0.00 H new ATOM 1567 N GLN A 100 20.316 -10.763 10.341 1.00 0.00 N ATOM 1568 CA GLN A 100 19.889 -10.405 8.964 1.00 0.00 C ATOM 1569 C GLN A 100 18.407 -10.049 8.989 1.00 0.00 C ATOM 1570 O GLN A 100 17.557 -10.869 8.702 1.00 0.00 O ATOM 1571 CB GLN A 100 20.096 -11.601 8.046 1.00 0.00 C ATOM 1572 CG GLN A 100 21.545 -12.081 8.145 1.00 0.00 C ATOM 1573 CD GLN A 100 21.916 -12.851 6.876 1.00 0.00 C ATOM 1574 OE1 GLN A 100 21.305 -12.669 5.841 1.00 0.00 O ATOM 1575 NE2 GLN A 100 22.896 -13.711 6.911 1.00 0.00 N ATOM 0 H GLN A 100 19.599 -11.210 10.912 1.00 0.00 H new ATOM 0 HA GLN A 100 20.474 -9.560 8.602 1.00 0.00 H new ATOM 0 HB2 GLN A 100 19.416 -12.407 8.323 1.00 0.00 H new ATOM 0 HB3 GLN A 100 19.863 -11.327 7.017 1.00 0.00 H new ATOM 0 HG2 GLN A 100 22.213 -11.230 8.275 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.669 -12.720 9.020 1.00 0.00 H new ATOM 0 HE21 GLN A 100 23.409 -13.864 7.779 1.00 0.00 H new ATOM 0 HE22 GLN A 100 23.149 -14.230 6.070 1.00 0.00 H new ATOM 1584 N LEU A 101 18.087 -8.840 9.344 1.00 0.00 N ATOM 1585 CA LEU A 101 16.660 -8.439 9.401 1.00 0.00 C ATOM 1586 C LEU A 101 15.941 -8.954 8.161 1.00 0.00 C ATOM 1587 O LEU A 101 16.507 -9.044 7.091 1.00 0.00 O ATOM 1588 CB LEU A 101 16.544 -6.916 9.476 1.00 0.00 C ATOM 1589 CG LEU A 101 17.353 -6.390 10.666 1.00 0.00 C ATOM 1590 CD1 LEU A 101 16.859 -4.991 11.036 1.00 0.00 C ATOM 1591 CD2 LEU A 101 17.175 -7.323 11.866 1.00 0.00 C ATOM 0 H LEU A 101 18.754 -8.111 9.598 1.00 0.00 H new ATOM 0 HA LEU A 101 16.201 -8.868 10.292 1.00 0.00 H new ATOM 0 HB2 LEU A 101 16.908 -6.469 8.551 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.498 -6.627 9.580 1.00 0.00 H new ATOM 0 HG LEU A 101 18.408 -6.349 10.394 1.00 0.00 H new ATOM 0 HD11 LEU A 101 17.433 -4.614 11.883 1.00 0.00 H new ATOM 0 HD12 LEU A 101 16.987 -4.323 10.184 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.804 -5.037 11.305 1.00 0.00 H new ATOM 0 HD21 LEU A 101 17.752 -6.945 12.710 1.00 0.00 H new ATOM 0 HD22 LEU A 101 16.121 -7.368 12.139 1.00 0.00 H new ATOM 0 HD23 LEU A 101 17.525 -8.322 11.605 1.00 0.00 H new ATOM 1603 N SER A 102 14.705 -9.317 8.311 1.00 0.00 N ATOM 1604 CA SER A 102 13.938 -9.862 7.152 1.00 0.00 C ATOM 1605 C SER A 102 12.996 -8.804 6.568 1.00 0.00 C ATOM 1606 O SER A 102 12.289 -8.124 7.286 1.00 0.00 O ATOM 1607 CB SER A 102 13.118 -11.066 7.613 1.00 0.00 C ATOM 1608 OG SER A 102 13.209 -12.097 6.639 1.00 0.00 O ATOM 0 H SER A 102 14.185 -9.262 9.187 1.00 0.00 H new ATOM 0 HA SER A 102 14.646 -10.159 6.378 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.486 -11.425 8.574 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.077 -10.778 7.758 1.00 0.00 H new ATOM 0 HG SER A 102 12.685 -12.872 6.933 1.00 0.00 H new ATOM 1614 N ASN A 103 12.959 -8.682 5.265 1.00 0.00 N ATOM 1615 CA ASN A 103 12.035 -7.690 4.634 1.00 0.00 C ATOM 1616 C ASN A 103 12.354 -6.279 5.120 1.00 0.00 C ATOM 1617 O ASN A 103 11.480 -5.445 5.248 1.00 0.00 O ATOM 1618 CB ASN A 103 10.598 -8.030 5.017 1.00 0.00 C ATOM 1619 CG ASN A 103 10.169 -9.324 4.324 1.00 0.00 C ATOM 1620 OD1 ASN A 103 9.940 -9.341 3.131 1.00 0.00 O ATOM 1621 ND2 ASN A 103 10.047 -10.416 5.027 1.00 0.00 N ATOM 0 H ASN A 103 13.526 -9.224 4.613 1.00 0.00 H new ATOM 0 HA ASN A 103 12.160 -7.732 3.552 1.00 0.00 H new ATOM 0 HB2 ASN A 103 10.517 -8.142 6.098 1.00 0.00 H new ATOM 0 HB3 ASN A 103 9.933 -7.215 4.730 1.00 0.00 H new ATOM 0 HD21 ASN A 103 9.759 -11.284 4.575 1.00 0.00 H new ATOM 0 HD22 ASN A 103 10.239 -10.402 6.029 1.00 0.00 H new ATOM 1628 N MET A 104 13.592 -6.001 5.388 1.00 0.00 N ATOM 1629 CA MET A 104 13.954 -4.637 5.858 1.00 0.00 C ATOM 1630 C MET A 104 14.388 -3.788 4.662 1.00 0.00 C ATOM 1631 O MET A 104 14.976 -2.740 4.818 1.00 0.00 O ATOM 1632 CB MET A 104 15.101 -4.726 6.866 1.00 0.00 C ATOM 1633 CG MET A 104 15.454 -3.321 7.354 1.00 0.00 C ATOM 1634 SD MET A 104 15.279 -3.242 9.153 1.00 0.00 S ATOM 1635 CE MET A 104 16.597 -2.036 9.446 1.00 0.00 C ATOM 0 H MET A 104 14.370 -6.655 5.303 1.00 0.00 H new ATOM 0 HA MET A 104 13.090 -4.178 6.338 1.00 0.00 H new ATOM 0 HB2 MET A 104 14.812 -5.354 7.709 1.00 0.00 H new ATOM 0 HB3 MET A 104 15.971 -5.192 6.404 1.00 0.00 H new ATOM 0 HG2 MET A 104 16.475 -3.071 7.066 1.00 0.00 H new ATOM 0 HG3 MET A 104 14.801 -2.586 6.882 1.00 0.00 H new ATOM 0 HE1 MET A 104 17.228 -2.379 10.266 1.00 0.00 H new ATOM 0 HE2 MET A 104 17.200 -1.929 8.544 1.00 0.00 H new ATOM 0 HE3 MET A 104 16.158 -1.073 9.705 1.00 0.00 H new ATOM 1645 N ILE A 105 14.098 -4.230 3.466 1.00 0.00 N ATOM 1646 CA ILE A 105 14.495 -3.437 2.266 1.00 0.00 C ATOM 1647 C ILE A 105 13.432 -3.592 1.177 1.00 0.00 C ATOM 1648 O ILE A 105 12.579 -4.453 1.248 1.00 0.00 O ATOM 1649 CB ILE A 105 15.841 -3.933 1.740 1.00 0.00 C ATOM 1650 CG1 ILE A 105 16.912 -3.731 2.815 1.00 0.00 C ATOM 1651 CG2 ILE A 105 16.219 -3.139 0.488 1.00 0.00 C ATOM 1652 CD1 ILE A 105 18.283 -4.100 2.247 1.00 0.00 C ATOM 0 H ILE A 105 13.606 -5.101 3.269 1.00 0.00 H new ATOM 0 HA ILE A 105 14.583 -2.386 2.543 1.00 0.00 H new ATOM 0 HB ILE A 105 15.770 -4.992 1.492 1.00 0.00 H new ATOM 0 HG12 ILE A 105 16.913 -2.694 3.151 1.00 0.00 H new ATOM 0 HG13 ILE A 105 16.689 -4.348 3.685 1.00 0.00 H new ATOM 0 HG21 ILE A 105 17.179 -3.491 0.110 1.00 0.00 H new ATOM 0 HG22 ILE A 105 15.455 -3.279 -0.276 1.00 0.00 H new ATOM 0 HG23 ILE A 105 16.293 -2.080 0.737 1.00 0.00 H new ATOM 0 HD11 ILE A 105 19.045 -3.956 3.013 1.00 0.00 H new ATOM 0 HD12 ILE A 105 18.278 -5.144 1.932 1.00 0.00 H new ATOM 0 HD13 ILE A 105 18.505 -3.464 1.390 1.00 0.00 H new ATOM 1664 N VAL A 106 13.471 -2.761 0.172 1.00 0.00 N ATOM 1665 CA VAL A 106 12.460 -2.852 -0.913 1.00 0.00 C ATOM 1666 C VAL A 106 13.143 -3.250 -2.226 1.00 0.00 C ATOM 1667 O VAL A 106 14.224 -2.792 -2.541 1.00 0.00 O ATOM 1668 CB VAL A 106 11.789 -1.487 -1.074 1.00 0.00 C ATOM 1669 CG1 VAL A 106 11.056 -1.428 -2.412 1.00 0.00 C ATOM 1670 CG2 VAL A 106 10.789 -1.274 0.063 1.00 0.00 C ATOM 0 H VAL A 106 14.163 -2.021 0.057 1.00 0.00 H new ATOM 0 HA VAL A 106 11.714 -3.606 -0.661 1.00 0.00 H new ATOM 0 HB VAL A 106 12.549 -0.706 -1.044 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.579 -0.454 -2.523 1.00 0.00 H new ATOM 0 HG12 VAL A 106 11.768 -1.578 -3.224 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.297 -2.209 -2.446 1.00 0.00 H new ATOM 0 HG21 VAL A 106 10.310 -0.301 -0.051 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.031 -2.057 0.033 1.00 0.00 H new ATOM 0 HG23 VAL A 106 11.311 -1.311 1.019 1.00 0.00 H new ATOM 1680 N ARG A 107 12.514 -4.093 -2.999 1.00 0.00 N ATOM 1681 CA ARG A 107 13.116 -4.514 -4.296 1.00 0.00 C ATOM 1682 C ARG A 107 12.115 -4.261 -5.430 1.00 0.00 C ATOM 1683 O ARG A 107 12.429 -4.411 -6.594 1.00 0.00 O ATOM 1684 CB ARG A 107 13.459 -6.004 -4.242 1.00 0.00 C ATOM 1685 CG ARG A 107 12.174 -6.820 -4.095 1.00 0.00 C ATOM 1686 CD ARG A 107 12.364 -8.194 -4.741 1.00 0.00 C ATOM 1687 NE ARG A 107 11.471 -8.310 -5.928 1.00 0.00 N ATOM 1688 CZ ARG A 107 11.657 -9.269 -6.794 1.00 0.00 C ATOM 1689 NH1 ARG A 107 12.704 -9.251 -7.573 1.00 0.00 N ATOM 1690 NH2 ARG A 107 10.795 -10.245 -6.881 1.00 0.00 N ATOM 0 H ARG A 107 11.607 -4.509 -2.788 1.00 0.00 H new ATOM 0 HA ARG A 107 14.024 -3.939 -4.477 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.988 -6.299 -5.148 1.00 0.00 H new ATOM 0 HB3 ARG A 107 14.127 -6.204 -3.404 1.00 0.00 H new ATOM 0 HG2 ARG A 107 11.922 -6.934 -3.041 1.00 0.00 H new ATOM 0 HG3 ARG A 107 11.342 -6.297 -4.567 1.00 0.00 H new ATOM 0 HD2 ARG A 107 13.404 -8.327 -5.040 1.00 0.00 H new ATOM 0 HD3 ARG A 107 12.136 -8.981 -4.022 1.00 0.00 H new ATOM 0 HE ARG A 107 10.714 -7.640 -6.064 1.00 0.00 H new ATOM 0 HH11 ARG A 107 13.377 -8.488 -7.505 1.00 0.00 H new ATOM 0 HH12 ARG A 107 12.849 -10.000 -8.250 1.00 0.00 H new ATOM 0 HH21 ARG A 107 9.976 -10.258 -6.273 1.00 0.00 H new ATOM 0 HH22 ARG A 107 10.940 -10.995 -7.557 1.00 0.00 H new ATOM 1704 N SER A 108 10.912 -3.874 -5.095 1.00 0.00 N ATOM 1705 CA SER A 108 9.886 -3.608 -6.143 1.00 0.00 C ATOM 1706 C SER A 108 8.555 -3.283 -5.464 1.00 0.00 C ATOM 1707 O SER A 108 8.102 -4.000 -4.593 1.00 0.00 O ATOM 1708 CB SER A 108 9.719 -4.845 -7.025 1.00 0.00 C ATOM 1709 OG SER A 108 10.655 -4.790 -8.093 1.00 0.00 O ATOM 0 H SER A 108 10.596 -3.730 -4.136 1.00 0.00 H new ATOM 0 HA SER A 108 10.202 -2.768 -6.761 1.00 0.00 H new ATOM 0 HB2 SER A 108 9.874 -5.749 -6.436 1.00 0.00 H new ATOM 0 HB3 SER A 108 8.703 -4.891 -7.418 1.00 0.00 H new ATOM 0 HG SER A 108 11.509 -4.441 -7.762 1.00 0.00 H new ATOM 1715 N CYS A 109 7.928 -2.203 -5.842 1.00 0.00 N ATOM 1716 CA CYS A 109 6.632 -1.837 -5.198 1.00 0.00 C ATOM 1717 C CYS A 109 5.455 -2.357 -6.032 1.00 0.00 C ATOM 1718 O CYS A 109 5.605 -3.234 -6.860 1.00 0.00 O ATOM 1719 CB CYS A 109 6.537 -0.315 -5.068 1.00 0.00 C ATOM 1720 SG CYS A 109 7.897 0.281 -4.036 1.00 0.00 S ATOM 0 H CYS A 109 8.253 -1.561 -6.564 1.00 0.00 H new ATOM 0 HA CYS A 109 6.589 -2.293 -4.209 1.00 0.00 H new ATOM 0 HB2 CYS A 109 6.582 0.149 -6.053 1.00 0.00 H new ATOM 0 HB3 CYS A 109 5.580 -0.035 -4.627 1.00 0.00 H new ATOM 1725 N LYS A 110 4.280 -1.825 -5.808 1.00 0.00 N ATOM 1726 CA LYS A 110 3.085 -2.279 -6.571 1.00 0.00 C ATOM 1727 C LYS A 110 1.930 -1.311 -6.286 1.00 0.00 C ATOM 1728 O LYS A 110 2.114 -0.115 -6.282 1.00 0.00 O ATOM 1729 CB LYS A 110 2.708 -3.695 -6.125 1.00 0.00 C ATOM 1730 CG LYS A 110 2.402 -3.694 -4.626 1.00 0.00 C ATOM 1731 CD LYS A 110 2.157 -5.127 -4.153 1.00 0.00 C ATOM 1732 CE LYS A 110 0.761 -5.229 -3.538 1.00 0.00 C ATOM 1733 NZ LYS A 110 0.845 -5.946 -2.233 1.00 0.00 N ATOM 0 H LYS A 110 4.099 -1.091 -5.124 1.00 0.00 H new ATOM 0 HA LYS A 110 3.297 -2.292 -7.640 1.00 0.00 H new ATOM 0 HB2 LYS A 110 1.840 -4.045 -6.684 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.524 -4.385 -6.340 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.234 -3.255 -4.075 1.00 0.00 H new ATOM 0 HG3 LYS A 110 1.526 -3.078 -4.424 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.248 -5.818 -4.991 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.911 -5.413 -3.420 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.342 -4.233 -3.392 1.00 0.00 H new ATOM 0 HE3 LYS A 110 0.092 -5.760 -4.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.104 -6.016 -1.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 1.227 -6.901 -2.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.470 -5.422 -1.588 1.00 0.00 H new ATOM 1747 N CYS A 111 0.745 -1.803 -6.043 1.00 0.00 N ATOM 1748 CA CYS A 111 -0.386 -0.874 -5.758 1.00 0.00 C ATOM 1749 C CYS A 111 -1.441 -1.589 -4.911 1.00 0.00 C ATOM 1750 O CYS A 111 -2.381 -2.160 -5.427 1.00 0.00 O ATOM 1751 CB CYS A 111 -1.010 -0.408 -7.076 1.00 0.00 C ATOM 1752 SG CYS A 111 0.070 0.827 -7.844 1.00 0.00 S ATOM 0 H CYS A 111 0.513 -2.796 -6.029 1.00 0.00 H new ATOM 0 HA CYS A 111 -0.013 -0.009 -5.209 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -1.147 -1.256 -7.747 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -1.997 0.017 -6.894 1.00 0.00 H new ATOM 1757 N SER A 112 -1.296 -1.559 -3.613 1.00 0.00 N ATOM 1758 CA SER A 112 -2.294 -2.235 -2.738 1.00 0.00 C ATOM 1759 C SER A 112 -3.442 -1.268 -2.440 1.00 0.00 C ATOM 1760 O SER A 112 -3.160 -0.129 -2.106 1.00 0.00 O ATOM 1761 CB SER A 112 -1.626 -2.654 -1.430 1.00 0.00 C ATOM 1762 OG SER A 112 -2.480 -3.552 -0.732 1.00 0.00 O ATOM 1763 OXT SER A 112 -4.585 -1.683 -2.549 1.00 0.00 O ATOM 0 H SER A 112 -0.531 -1.096 -3.123 1.00 0.00 H new ATOM 0 HA SER A 112 -2.683 -3.119 -3.243 1.00 0.00 H new ATOM 0 HB2 SER A 112 -0.667 -3.131 -1.634 1.00 0.00 H new ATOM 0 HB3 SER A 112 -1.421 -1.777 -0.816 1.00 0.00 H new ATOM 0 HG SER A 112 -1.972 -4.347 -0.467 1.00 0.00 H new ATOM 1770 N ALA B 1 -7.179 -1.021 15.493 1.00 0.00 N ATOM 1771 CA ALA B 1 -8.417 -1.209 14.684 1.00 0.00 C ATOM 1772 C ALA B 1 -8.370 -0.291 13.462 1.00 0.00 C ATOM 1773 O ALA B 1 -8.719 0.871 13.533 1.00 0.00 O ATOM 1774 CB ALA B 1 -9.641 -0.866 15.536 1.00 0.00 C ATOM 0 H1 ALA B 1 -7.210 -1.645 16.325 1.00 0.00 H new ATOM 0 H2 ALA B 1 -6.347 -1.256 14.914 1.00 0.00 H new ATOM 0 H3 ALA B 1 -7.115 -0.031 15.805 1.00 0.00 H new ATOM 0 HA ALA B 1 -8.484 -2.246 14.356 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -10.546 -1.003 14.944 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -9.673 -1.521 16.407 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -9.576 0.171 15.865 1.00 0.00 H new ATOM 1782 N LEU B 2 -7.942 -0.803 12.340 1.00 0.00 N ATOM 1783 CA LEU B 2 -7.872 0.040 11.114 1.00 0.00 C ATOM 1784 C LEU B 2 -8.932 -0.421 10.116 1.00 0.00 C ATOM 1785 O LEU B 2 -8.643 -0.700 8.970 1.00 0.00 O ATOM 1786 CB LEU B 2 -6.495 -0.097 10.478 1.00 0.00 C ATOM 1787 CG LEU B 2 -5.446 0.545 11.385 1.00 0.00 C ATOM 1788 CD1 LEU B 2 -4.071 0.452 10.720 1.00 0.00 C ATOM 1789 CD2 LEU B 2 -5.801 2.016 11.612 1.00 0.00 C ATOM 0 H LEU B 2 -7.638 -1.769 12.220 1.00 0.00 H new ATOM 0 HA LEU B 2 -8.049 1.081 11.384 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -6.259 -1.149 10.320 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -6.486 0.382 9.499 1.00 0.00 H new ATOM 0 HG LEU B 2 -5.424 0.023 12.341 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -3.322 0.910 11.367 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -3.817 -0.595 10.555 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -4.093 0.975 9.764 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -5.053 2.475 12.259 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -5.822 2.537 10.655 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -6.781 2.085 12.084 1.00 0.00 H new ATOM 1801 N ASP B 3 -10.154 -0.500 10.546 1.00 0.00 N ATOM 1802 CA ASP B 3 -11.239 -0.939 9.628 1.00 0.00 C ATOM 1803 C ASP B 3 -12.121 0.256 9.272 1.00 0.00 C ATOM 1804 O ASP B 3 -11.904 1.361 9.727 1.00 0.00 O ATOM 1805 CB ASP B 3 -12.090 -2.014 10.309 1.00 0.00 C ATOM 1806 CG ASP B 3 -12.108 -1.778 11.822 1.00 0.00 C ATOM 1807 OD1 ASP B 3 -11.165 -2.188 12.476 1.00 0.00 O ATOM 1808 OD2 ASP B 3 -13.066 -1.190 12.298 1.00 0.00 O ATOM 0 H ASP B 3 -10.452 -0.279 11.496 1.00 0.00 H new ATOM 0 HA ASP B 3 -10.797 -1.350 8.720 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -13.106 -1.990 9.916 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -11.687 -3.003 10.090 1.00 0.00 H new ATOM 1813 N THR B 4 -13.114 0.038 8.458 1.00 0.00 N ATOM 1814 CA THR B 4 -14.016 1.154 8.061 1.00 0.00 C ATOM 1815 C THR B 4 -15.033 1.416 9.173 1.00 0.00 C ATOM 1816 O THR B 4 -15.923 2.231 9.034 1.00 0.00 O ATOM 1817 CB THR B 4 -14.738 0.776 6.766 1.00 0.00 C ATOM 1818 OG1 THR B 4 -15.900 0.020 7.078 1.00 0.00 O ATOM 1819 CG2 THR B 4 -13.800 -0.059 5.887 1.00 0.00 C ATOM 0 H THR B 4 -13.341 -0.868 8.049 1.00 0.00 H new ATOM 0 HA THR B 4 -13.433 2.061 7.899 1.00 0.00 H new ATOM 0 HB THR B 4 -15.028 1.680 6.230 1.00 0.00 H new ATOM 0 HG1 THR B 4 -16.365 -0.222 6.250 1.00 0.00 H new ATOM 0 HG21 THR B 4 -14.312 -0.330 4.964 1.00 0.00 H new ATOM 0 HG22 THR B 4 -12.909 0.523 5.651 1.00 0.00 H new ATOM 0 HG23 THR B 4 -13.511 -0.964 6.421 1.00 0.00 H new ATOM 1827 N ASN B 5 -14.900 0.744 10.284 1.00 0.00 N ATOM 1828 CA ASN B 5 -15.849 0.970 11.408 1.00 0.00 C ATOM 1829 C ASN B 5 -15.264 2.032 12.341 1.00 0.00 C ATOM 1830 O ASN B 5 -15.934 2.966 12.736 1.00 0.00 O ATOM 1831 CB ASN B 5 -16.053 -0.336 12.179 1.00 0.00 C ATOM 1832 CG ASN B 5 -17.550 -0.593 12.361 1.00 0.00 C ATOM 1833 OD1 ASN B 5 -18.306 0.318 12.630 1.00 0.00 O ATOM 1834 ND2 ASN B 5 -18.013 -1.805 12.221 1.00 0.00 N ATOM 0 H ASN B 5 -14.175 0.049 10.461 1.00 0.00 H new ATOM 0 HA ASN B 5 -16.810 1.307 11.020 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -15.594 -1.165 11.640 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -15.563 -0.277 13.151 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -19.010 -1.987 12.338 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -17.378 -2.571 11.995 1.00 0.00 H new ATOM 1841 N TYR B 6 -14.012 1.899 12.690 1.00 0.00 N ATOM 1842 CA TYR B 6 -13.372 2.895 13.586 1.00 0.00 C ATOM 1843 C TYR B 6 -12.934 4.106 12.758 1.00 0.00 C ATOM 1844 O TYR B 6 -12.684 5.173 13.281 1.00 0.00 O ATOM 1845 CB TYR B 6 -12.153 2.246 14.243 1.00 0.00 C ATOM 1846 CG TYR B 6 -11.264 3.307 14.845 1.00 0.00 C ATOM 1847 CD1 TYR B 6 -11.686 4.025 15.971 1.00 0.00 C ATOM 1848 CD2 TYR B 6 -10.016 3.572 14.272 1.00 0.00 C ATOM 1849 CE1 TYR B 6 -10.856 5.008 16.523 1.00 0.00 C ATOM 1850 CE2 TYR B 6 -9.186 4.555 14.824 1.00 0.00 C ATOM 1851 CZ TYR B 6 -9.606 5.273 15.950 1.00 0.00 C ATOM 1852 OH TYR B 6 -8.788 6.243 16.494 1.00 0.00 O ATOM 0 H TYR B 6 -13.405 1.137 12.389 1.00 0.00 H new ATOM 0 HA TYR B 6 -14.073 3.222 14.354 1.00 0.00 H new ATOM 0 HB2 TYR B 6 -12.475 1.548 15.016 1.00 0.00 H new ATOM 0 HB3 TYR B 6 -11.596 1.669 13.505 1.00 0.00 H new ATOM 0 HD1 TYR B 6 -12.650 3.821 16.413 1.00 0.00 H new ATOM 0 HD2 TYR B 6 -9.692 3.018 13.403 1.00 0.00 H new ATOM 0 HE1 TYR B 6 -11.180 5.562 17.391 1.00 0.00 H new ATOM 0 HE2 TYR B 6 -8.222 4.759 14.381 1.00 0.00 H new ATOM 0 HH TYR B 6 -8.947 7.097 16.040 1.00 0.00 H new ATOM 1862 N CYS B 7 -12.838 3.944 11.465 1.00 0.00 N ATOM 1863 CA CYS B 7 -12.414 5.079 10.599 1.00 0.00 C ATOM 1864 C CYS B 7 -13.644 5.880 10.167 1.00 0.00 C ATOM 1865 O CYS B 7 -13.534 6.975 9.652 1.00 0.00 O ATOM 1866 CB CYS B 7 -11.688 4.532 9.368 1.00 0.00 C ATOM 1867 SG CYS B 7 -10.028 3.996 9.848 1.00 0.00 S ATOM 0 H CYS B 7 -13.035 3.073 10.972 1.00 0.00 H new ATOM 0 HA CYS B 7 -11.740 5.733 11.153 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -12.245 3.696 8.944 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -11.627 5.299 8.596 1.00 0.00 H new ATOM 1872 N PHE B 8 -14.816 5.345 10.378 1.00 0.00 N ATOM 1873 CA PHE B 8 -16.053 6.079 9.984 1.00 0.00 C ATOM 1874 C PHE B 8 -16.408 7.102 11.067 1.00 0.00 C ATOM 1875 O PHE B 8 -17.372 7.833 10.950 1.00 0.00 O ATOM 1876 CB PHE B 8 -17.207 5.088 9.821 1.00 0.00 C ATOM 1877 CG PHE B 8 -17.270 4.600 8.391 1.00 0.00 C ATOM 1878 CD1 PHE B 8 -16.148 4.702 7.559 1.00 0.00 C ATOM 1879 CD2 PHE B 8 -18.457 4.045 7.899 1.00 0.00 C ATOM 1880 CE1 PHE B 8 -16.215 4.250 6.235 1.00 0.00 C ATOM 1881 CE2 PHE B 8 -18.523 3.591 6.575 1.00 0.00 C ATOM 1882 CZ PHE B 8 -17.402 3.695 5.743 1.00 0.00 C ATOM 0 H PHE B 8 -14.971 4.432 10.806 1.00 0.00 H new ATOM 0 HA PHE B 8 -15.882 6.595 9.039 1.00 0.00 H new ATOM 0 HB2 PHE B 8 -17.071 4.244 10.497 1.00 0.00 H new ATOM 0 HB3 PHE B 8 -18.148 5.565 10.093 1.00 0.00 H new ATOM 0 HD1 PHE B 8 -15.231 5.129 7.938 1.00 0.00 H new ATOM 0 HD2 PHE B 8 -19.323 3.967 8.540 1.00 0.00 H new ATOM 0 HE1 PHE B 8 -15.350 4.330 5.593 1.00 0.00 H new ATOM 0 HE2 PHE B 8 -19.439 3.161 6.196 1.00 0.00 H new ATOM 0 HZ PHE B 8 -17.453 3.347 4.722 1.00 0.00 H new ATOM 1892 N SER B 9 -15.641 7.159 12.121 1.00 0.00 N ATOM 1893 CA SER B 9 -15.938 8.136 13.207 1.00 0.00 C ATOM 1894 C SER B 9 -15.220 9.454 12.915 1.00 0.00 C ATOM 1895 O SER B 9 -15.747 10.325 12.251 1.00 0.00 O ATOM 1896 CB SER B 9 -15.452 7.576 14.544 1.00 0.00 C ATOM 1897 OG SER B 9 -16.356 6.573 14.990 1.00 0.00 O ATOM 0 H SER B 9 -14.822 6.572 12.277 1.00 0.00 H new ATOM 0 HA SER B 9 -17.013 8.310 13.256 1.00 0.00 H new ATOM 0 HB2 SER B 9 -14.452 7.157 14.434 1.00 0.00 H new ATOM 0 HB3 SER B 9 -15.384 8.375 15.283 1.00 0.00 H new ATOM 0 HG SER B 9 -16.046 6.211 15.846 1.00 0.00 H new ATOM 1903 N SER B 10 -14.020 9.608 13.404 1.00 0.00 N ATOM 1904 CA SER B 10 -13.269 10.870 13.153 1.00 0.00 C ATOM 1905 C SER B 10 -12.449 10.725 11.869 1.00 0.00 C ATOM 1906 O SER B 10 -12.519 9.722 11.187 1.00 0.00 O ATOM 1907 CB SER B 10 -12.332 11.147 14.328 1.00 0.00 C ATOM 1908 OG SER B 10 -12.354 12.538 14.628 1.00 0.00 O ATOM 0 H SER B 10 -13.527 8.914 13.967 1.00 0.00 H new ATOM 0 HA SER B 10 -13.971 11.697 13.046 1.00 0.00 H new ATOM 0 HB2 SER B 10 -12.642 10.570 15.199 1.00 0.00 H new ATOM 0 HB3 SER B 10 -11.318 10.832 14.082 1.00 0.00 H new ATOM 0 HG SER B 10 -11.755 12.719 15.382 1.00 0.00 H new ATOM 1914 N THR B 11 -11.675 11.719 11.531 1.00 0.00 N ATOM 1915 CA THR B 11 -10.854 11.638 10.293 1.00 0.00 C ATOM 1916 C THR B 11 -9.525 10.947 10.602 1.00 0.00 C ATOM 1917 O THR B 11 -8.775 10.597 9.714 1.00 0.00 O ATOM 1918 CB THR B 11 -10.592 13.055 9.776 1.00 0.00 C ATOM 1919 OG1 THR B 11 -11.780 13.572 9.193 1.00 0.00 O ATOM 1920 CG2 THR B 11 -9.480 13.024 8.730 1.00 0.00 C ATOM 0 H THR B 11 -11.576 12.585 12.061 1.00 0.00 H new ATOM 0 HA THR B 11 -11.386 11.063 9.535 1.00 0.00 H new ATOM 0 HB THR B 11 -10.286 13.692 10.606 1.00 0.00 H new ATOM 0 HG1 THR B 11 -11.614 14.480 8.863 1.00 0.00 H new ATOM 0 HG21 THR B 11 -9.296 14.034 8.364 1.00 0.00 H new ATOM 0 HG22 THR B 11 -8.569 12.629 9.179 1.00 0.00 H new ATOM 0 HG23 THR B 11 -9.780 12.386 7.899 1.00 0.00 H new ATOM 1928 N GLU B 12 -9.231 10.751 11.855 1.00 0.00 N ATOM 1929 CA GLU B 12 -7.952 10.084 12.228 1.00 0.00 C ATOM 1930 C GLU B 12 -6.789 10.781 11.518 1.00 0.00 C ATOM 1931 O GLU B 12 -6.982 11.688 10.733 1.00 0.00 O ATOM 1932 CB GLU B 12 -8.000 8.614 11.807 1.00 0.00 C ATOM 1933 CG GLU B 12 -8.281 7.742 13.031 1.00 0.00 C ATOM 1934 CD GLU B 12 -9.633 8.130 13.636 1.00 0.00 C ATOM 1935 OE1 GLU B 12 -10.644 7.779 13.051 1.00 0.00 O ATOM 1936 OE2 GLU B 12 -9.633 8.773 14.672 1.00 0.00 O ATOM 0 H GLU B 12 -9.822 11.024 12.640 1.00 0.00 H new ATOM 0 HA GLU B 12 -7.810 10.147 13.307 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -8.775 8.465 11.055 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -7.054 8.324 11.350 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -8.286 6.690 12.747 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -7.490 7.869 13.770 1.00 0.00 H new ATOM 1943 N LYS B 13 -5.581 10.367 11.790 1.00 0.00 N ATOM 1944 CA LYS B 13 -4.410 11.011 11.131 1.00 0.00 C ATOM 1945 C LYS B 13 -3.435 9.937 10.647 1.00 0.00 C ATOM 1946 O LYS B 13 -2.329 10.229 10.237 1.00 0.00 O ATOM 1947 CB LYS B 13 -3.702 11.924 12.132 1.00 0.00 C ATOM 1948 CG LYS B 13 -3.564 11.202 13.474 1.00 0.00 C ATOM 1949 CD LYS B 13 -4.410 11.918 14.529 1.00 0.00 C ATOM 1950 CE LYS B 13 -3.924 11.525 15.925 1.00 0.00 C ATOM 1951 NZ LYS B 13 -4.685 12.293 16.951 1.00 0.00 N ATOM 0 H LYS B 13 -5.355 9.613 12.438 1.00 0.00 H new ATOM 0 HA LYS B 13 -4.754 11.597 10.279 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -2.718 12.202 11.754 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -4.267 12.847 12.260 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -3.887 10.165 13.376 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -2.519 11.183 13.783 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -4.337 12.998 14.398 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -5.460 11.652 14.410 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -4.060 10.455 16.081 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -2.857 11.728 16.021 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -4.355 12.026 17.900 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -4.533 13.312 16.805 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -5.699 12.078 16.864 1.00 0.00 H new ATOM 1965 N ASN B 14 -3.832 8.695 10.692 1.00 0.00 N ATOM 1966 CA ASN B 14 -2.921 7.607 10.236 1.00 0.00 C ATOM 1967 C ASN B 14 -3.688 6.633 9.339 1.00 0.00 C ATOM 1968 O ASN B 14 -4.802 6.892 8.932 1.00 0.00 O ATOM 1969 CB ASN B 14 -2.376 6.854 11.452 1.00 0.00 C ATOM 1970 CG ASN B 14 -2.223 7.820 12.629 1.00 0.00 C ATOM 1971 OD1 ASN B 14 -2.907 7.695 13.625 1.00 0.00 O ATOM 1972 ND2 ASN B 14 -1.348 8.785 12.556 1.00 0.00 N ATOM 0 H ASN B 14 -4.746 8.387 11.024 1.00 0.00 H new ATOM 0 HA ASN B 14 -2.095 8.042 9.674 1.00 0.00 H new ATOM 0 HB2 ASN B 14 -3.051 6.041 11.721 1.00 0.00 H new ATOM 0 HB3 ASN B 14 -1.413 6.403 11.211 1.00 0.00 H new ATOM 0 HD21 ASN B 14 -1.238 9.434 13.335 1.00 0.00 H new ATOM 0 HD22 ASN B 14 -0.773 8.890 11.720 1.00 0.00 H new ATOM 1979 N CYS B 15 -3.095 5.512 9.032 1.00 0.00 N ATOM 1980 CA CYS B 15 -3.777 4.508 8.165 1.00 0.00 C ATOM 1981 C CYS B 15 -5.229 4.343 8.626 1.00 0.00 C ATOM 1982 O CYS B 15 -5.524 3.558 9.505 1.00 0.00 O ATOM 1983 CB CYS B 15 -3.041 3.170 8.285 1.00 0.00 C ATOM 1984 SG CYS B 15 -4.050 1.829 7.595 1.00 0.00 S ATOM 0 H CYS B 15 -2.162 5.246 9.346 1.00 0.00 H new ATOM 0 HA CYS B 15 -3.766 4.841 7.127 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -2.088 3.224 7.759 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -2.817 2.964 9.332 1.00 0.00 H new ATOM 1989 N CYS B 16 -6.138 5.072 8.039 1.00 0.00 N ATOM 1990 CA CYS B 16 -7.566 4.947 8.447 1.00 0.00 C ATOM 1991 C CYS B 16 -8.448 4.876 7.199 1.00 0.00 C ATOM 1992 O CYS B 16 -8.460 5.776 6.383 1.00 0.00 O ATOM 1993 CB CYS B 16 -7.967 6.163 9.287 1.00 0.00 C ATOM 1994 SG CYS B 16 -9.148 5.666 10.571 1.00 0.00 S ATOM 0 H CYS B 16 -5.955 5.747 7.297 1.00 0.00 H new ATOM 0 HA CYS B 16 -7.697 4.040 9.037 1.00 0.00 H new ATOM 0 HB2 CYS B 16 -7.083 6.606 9.746 1.00 0.00 H new ATOM 0 HB3 CYS B 16 -8.411 6.926 8.648 1.00 0.00 H new ATOM 1999 N VAL B 17 -9.180 3.809 7.041 1.00 0.00 N ATOM 2000 CA VAL B 17 -10.055 3.673 5.844 1.00 0.00 C ATOM 2001 C VAL B 17 -11.325 4.509 6.019 1.00 0.00 C ATOM 2002 O VAL B 17 -12.141 4.244 6.877 1.00 0.00 O ATOM 2003 CB VAL B 17 -10.447 2.207 5.673 1.00 0.00 C ATOM 2004 CG1 VAL B 17 -11.393 1.792 6.795 1.00 0.00 C ATOM 2005 CG2 VAL B 17 -11.159 2.026 4.337 1.00 0.00 C ATOM 0 H VAL B 17 -9.210 3.023 7.691 1.00 0.00 H new ATOM 0 HA VAL B 17 -9.512 4.024 4.966 1.00 0.00 H new ATOM 0 HB VAL B 17 -9.548 1.591 5.704 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -11.670 0.745 6.669 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -10.896 1.923 7.757 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -12.290 2.411 6.763 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.440 0.980 4.213 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -12.054 2.647 4.315 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -10.493 2.321 3.527 1.00 0.00 H new ATOM 2015 N ARG B 18 -11.514 5.509 5.203 1.00 0.00 N ATOM 2016 CA ARG B 18 -12.750 6.336 5.333 1.00 0.00 C ATOM 2017 C ARG B 18 -13.773 5.884 4.291 1.00 0.00 C ATOM 2018 O ARG B 18 -13.613 4.863 3.648 1.00 0.00 O ATOM 2019 CB ARG B 18 -12.443 7.828 5.130 1.00 0.00 C ATOM 2020 CG ARG B 18 -11.010 8.021 4.632 1.00 0.00 C ATOM 2021 CD ARG B 18 -10.773 9.503 4.333 1.00 0.00 C ATOM 2022 NE ARG B 18 -9.377 9.870 4.699 1.00 0.00 N ATOM 2023 CZ ARG B 18 -8.993 11.115 4.637 1.00 0.00 C ATOM 2024 NH1 ARG B 18 -9.210 11.813 3.556 1.00 0.00 N ATOM 2025 NH2 ARG B 18 -8.391 11.663 5.657 1.00 0.00 N ATOM 0 H ARG B 18 -10.875 5.789 4.459 1.00 0.00 H new ATOM 0 HA ARG B 18 -13.150 6.201 6.338 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -13.144 8.254 4.412 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -12.583 8.364 6.069 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -10.302 7.672 5.383 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -10.842 7.426 3.735 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -10.947 9.703 3.276 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -11.479 10.115 4.894 1.00 0.00 H new ATOM 0 HE ARG B 18 -8.721 9.148 4.998 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -9.680 11.385 2.758 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -8.909 12.787 3.509 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -8.221 11.118 6.502 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -8.090 12.637 5.609 1.00 0.00 H new ATOM 2039 N GLN B 19 -14.824 6.636 4.123 1.00 0.00 N ATOM 2040 CA GLN B 19 -15.868 6.256 3.131 1.00 0.00 C ATOM 2041 C GLN B 19 -15.458 6.732 1.737 1.00 0.00 C ATOM 2042 O GLN B 19 -14.892 7.795 1.573 1.00 0.00 O ATOM 2043 CB GLN B 19 -17.199 6.904 3.520 1.00 0.00 C ATOM 2044 CG GLN B 19 -17.133 8.409 3.251 1.00 0.00 C ATOM 2045 CD GLN B 19 -18.484 9.046 3.579 1.00 0.00 C ATOM 2046 OE1 GLN B 19 -19.511 8.403 3.484 1.00 0.00 O ATOM 2047 NE2 GLN B 19 -18.529 10.292 3.964 1.00 0.00 N ATOM 0 H GLN B 19 -15.006 7.501 4.632 1.00 0.00 H new ATOM 0 HA GLN B 19 -15.977 5.172 3.122 1.00 0.00 H new ATOM 0 HB2 GLN B 19 -18.013 6.457 2.949 1.00 0.00 H new ATOM 0 HB3 GLN B 19 -17.410 6.721 4.574 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -16.348 8.863 3.856 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -16.877 8.592 2.207 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -17.668 10.832 4.044 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -19.425 10.725 4.185 1.00 0.00 H new ATOM 2056 N LEU B 20 -15.744 5.953 0.732 1.00 0.00 N ATOM 2057 CA LEU B 20 -15.377 6.355 -0.653 1.00 0.00 C ATOM 2058 C LEU B 20 -16.412 5.808 -1.632 1.00 0.00 C ATOM 2059 O LEU B 20 -16.071 5.218 -2.638 1.00 0.00 O ATOM 2060 CB LEU B 20 -14.004 5.789 -1.006 1.00 0.00 C ATOM 2061 CG LEU B 20 -13.542 6.356 -2.351 1.00 0.00 C ATOM 2062 CD1 LEU B 20 -13.507 7.883 -2.279 1.00 0.00 C ATOM 2063 CD2 LEU B 20 -12.141 5.832 -2.671 1.00 0.00 C ATOM 0 H LEU B 20 -16.217 5.053 0.811 1.00 0.00 H new ATOM 0 HA LEU B 20 -15.349 7.443 -0.716 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -13.285 6.042 -0.227 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -14.050 4.701 -1.056 1.00 0.00 H new ATOM 0 HG LEU B 20 -14.236 6.045 -3.132 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -13.178 8.285 -3.237 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -14.504 8.259 -2.051 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -12.814 8.195 -1.498 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -11.812 6.235 -3.629 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -11.449 6.143 -1.889 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -12.163 4.744 -2.724 1.00 0.00 H new ATOM 2075 N TYR B 21 -17.672 5.989 -1.352 1.00 0.00 N ATOM 2076 CA TYR B 21 -18.707 5.467 -2.286 1.00 0.00 C ATOM 2077 C TYR B 21 -18.305 5.818 -3.712 1.00 0.00 C ATOM 2078 O TYR B 21 -17.928 6.936 -4.006 1.00 0.00 O ATOM 2079 CB TYR B 21 -20.065 6.098 -1.985 1.00 0.00 C ATOM 2080 CG TYR B 21 -21.058 5.647 -3.033 1.00 0.00 C ATOM 2081 CD1 TYR B 21 -21.012 6.190 -4.326 1.00 0.00 C ATOM 2082 CD2 TYR B 21 -22.023 4.688 -2.711 1.00 0.00 C ATOM 2083 CE1 TYR B 21 -21.935 5.772 -5.297 1.00 0.00 C ATOM 2084 CE2 TYR B 21 -22.947 4.271 -3.679 1.00 0.00 C ATOM 2085 CZ TYR B 21 -22.902 4.813 -4.971 1.00 0.00 C ATOM 2086 OH TYR B 21 -23.814 4.401 -5.922 1.00 0.00 O ATOM 0 H TYR B 21 -18.027 6.470 -0.526 1.00 0.00 H new ATOM 0 HA TYR B 21 -18.783 4.387 -2.164 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -20.405 5.804 -0.992 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -19.984 7.185 -1.986 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -20.266 6.930 -4.574 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -22.057 4.268 -1.716 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -21.900 6.189 -6.293 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -23.694 3.532 -3.429 1.00 0.00 H new ATOM 0 HH TYR B 21 -24.414 3.731 -5.532 1.00 0.00 H new ATOM 2096 N ILE B 22 -18.385 4.878 -4.604 1.00 0.00 N ATOM 2097 CA ILE B 22 -18.013 5.162 -6.011 1.00 0.00 C ATOM 2098 C ILE B 22 -19.227 4.921 -6.902 1.00 0.00 C ATOM 2099 O ILE B 22 -19.693 3.809 -7.047 1.00 0.00 O ATOM 2100 CB ILE B 22 -16.868 4.242 -6.438 1.00 0.00 C ATOM 2101 CG1 ILE B 22 -15.709 4.382 -5.448 1.00 0.00 C ATOM 2102 CG2 ILE B 22 -16.395 4.637 -7.837 1.00 0.00 C ATOM 2103 CD1 ILE B 22 -14.458 3.718 -6.026 1.00 0.00 C ATOM 0 H ILE B 22 -18.693 3.923 -4.419 1.00 0.00 H new ATOM 0 HA ILE B 22 -17.688 6.198 -6.104 1.00 0.00 H new ATOM 0 HB ILE B 22 -17.214 3.208 -6.450 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -15.514 5.435 -5.247 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -15.972 3.920 -4.497 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -15.579 3.983 -8.143 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -17.221 4.541 -8.541 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -16.047 5.670 -7.825 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -13.634 3.818 -5.320 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -14.656 2.661 -6.204 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -14.191 4.201 -6.966 1.00 0.00 H new ATOM 2115 N ASP B 23 -19.743 5.955 -7.502 1.00 0.00 N ATOM 2116 CA ASP B 23 -20.922 5.784 -8.381 1.00 0.00 C ATOM 2117 C ASP B 23 -20.431 5.347 -9.757 1.00 0.00 C ATOM 2118 O ASP B 23 -20.200 6.155 -10.625 1.00 0.00 O ATOM 2119 CB ASP B 23 -21.701 7.102 -8.490 1.00 0.00 C ATOM 2120 CG ASP B 23 -21.231 8.117 -7.440 1.00 0.00 C ATOM 2121 OD1 ASP B 23 -20.194 8.724 -7.650 1.00 0.00 O ATOM 2122 OD2 ASP B 23 -21.922 8.275 -6.446 1.00 0.00 O ATOM 0 H ASP B 23 -19.396 6.911 -7.419 1.00 0.00 H new ATOM 0 HA ASP B 23 -21.591 5.031 -7.965 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -21.572 7.522 -9.488 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -22.766 6.909 -8.361 1.00 0.00 H new ATOM 2127 N PHE B 24 -20.261 4.059 -9.926 1.00 0.00 N ATOM 2128 CA PHE B 24 -19.768 3.469 -11.213 1.00 0.00 C ATOM 2129 C PHE B 24 -19.670 4.503 -12.339 1.00 0.00 C ATOM 2130 O PHE B 24 -18.610 4.742 -12.876 1.00 0.00 O ATOM 2131 CB PHE B 24 -20.727 2.357 -11.645 1.00 0.00 C ATOM 2132 CG PHE B 24 -20.359 1.078 -10.935 1.00 0.00 C ATOM 2133 CD1 PHE B 24 -19.174 0.412 -11.266 1.00 0.00 C ATOM 2134 CD2 PHE B 24 -21.200 0.561 -9.943 1.00 0.00 C ATOM 2135 CE1 PHE B 24 -18.829 -0.771 -10.605 1.00 0.00 C ATOM 2136 CE2 PHE B 24 -20.855 -0.624 -9.282 1.00 0.00 C ATOM 2137 CZ PHE B 24 -19.669 -1.290 -9.613 1.00 0.00 C ATOM 0 H PHE B 24 -20.450 3.368 -9.200 1.00 0.00 H new ATOM 0 HA PHE B 24 -18.764 3.084 -11.034 1.00 0.00 H new ATOM 0 HB2 PHE B 24 -21.754 2.635 -11.409 1.00 0.00 H new ATOM 0 HB3 PHE B 24 -20.675 2.215 -12.724 1.00 0.00 H new ATOM 0 HD1 PHE B 24 -18.526 0.811 -12.032 1.00 0.00 H new ATOM 0 HD2 PHE B 24 -22.114 1.076 -9.688 1.00 0.00 H new ATOM 0 HE1 PHE B 24 -17.914 -1.285 -10.860 1.00 0.00 H new ATOM 0 HE2 PHE B 24 -21.504 -1.024 -8.517 1.00 0.00 H new ATOM 0 HZ PHE B 24 -19.402 -2.204 -9.103 1.00 0.00 H new ATOM 2147 N ARG B 25 -20.767 5.098 -12.722 1.00 0.00 N ATOM 2148 CA ARG B 25 -20.730 6.084 -13.843 1.00 0.00 C ATOM 2149 C ARG B 25 -20.296 7.475 -13.361 1.00 0.00 C ATOM 2150 O ARG B 25 -19.546 8.159 -14.029 1.00 0.00 O ATOM 2151 CB ARG B 25 -22.124 6.182 -14.464 1.00 0.00 C ATOM 2152 CG ARG B 25 -22.006 6.621 -15.925 1.00 0.00 C ATOM 2153 CD ARG B 25 -22.572 8.033 -16.079 1.00 0.00 C ATOM 2154 NE ARG B 25 -23.750 7.998 -16.991 1.00 0.00 N ATOM 2155 CZ ARG B 25 -24.266 9.113 -17.431 1.00 0.00 C ATOM 2156 NH1 ARG B 25 -25.167 9.740 -16.724 1.00 0.00 N ATOM 2157 NH2 ARG B 25 -23.881 9.602 -18.578 1.00 0.00 N ATOM 0 H ARG B 25 -21.687 4.945 -12.309 1.00 0.00 H new ATOM 0 HA ARG B 25 -20.002 5.738 -14.577 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -22.629 5.218 -14.403 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -22.732 6.895 -13.907 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -20.963 6.599 -16.239 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -22.547 5.928 -16.569 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -22.863 8.428 -15.106 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -21.809 8.701 -16.478 1.00 0.00 H new ATOM 0 HE ARG B 25 -24.153 7.104 -17.271 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -25.468 9.358 -15.827 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -25.570 10.611 -17.068 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -23.177 9.113 -19.130 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -24.284 10.473 -18.922 1.00 0.00 H new ATOM 2171 N LYS B 26 -20.778 7.921 -12.236 1.00 0.00 N ATOM 2172 CA LYS B 26 -20.404 9.286 -11.761 1.00 0.00 C ATOM 2173 C LYS B 26 -18.903 9.377 -11.480 1.00 0.00 C ATOM 2174 O LYS B 26 -18.238 10.307 -11.892 1.00 0.00 O ATOM 2175 CB LYS B 26 -21.158 9.595 -10.473 1.00 0.00 C ATOM 2176 CG LYS B 26 -21.428 11.099 -10.392 1.00 0.00 C ATOM 2177 CD LYS B 26 -21.988 11.448 -9.012 1.00 0.00 C ATOM 2178 CE LYS B 26 -22.384 12.926 -8.982 1.00 0.00 C ATOM 2179 NZ LYS B 26 -21.298 13.744 -9.593 1.00 0.00 N ATOM 0 H LYS B 26 -21.412 7.405 -11.626 1.00 0.00 H new ATOM 0 HA LYS B 26 -20.663 10.002 -12.541 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -22.098 9.043 -10.447 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -20.575 9.272 -9.611 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -20.507 11.654 -10.573 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -22.135 11.394 -11.167 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -22.854 10.824 -8.790 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -21.243 11.244 -8.243 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -23.316 13.075 -9.527 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -22.560 13.245 -7.955 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -21.350 14.717 -9.229 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -20.375 13.332 -9.350 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -21.411 13.755 -10.627 1.00 0.00 H new ATOM 2193 N ASP B 27 -18.377 8.445 -10.742 1.00 0.00 N ATOM 2194 CA ASP B 27 -16.935 8.498 -10.383 1.00 0.00 C ATOM 2195 C ASP B 27 -16.059 7.789 -11.426 1.00 0.00 C ATOM 2196 O ASP B 27 -15.183 8.390 -12.014 1.00 0.00 O ATOM 2197 CB ASP B 27 -16.760 7.818 -9.031 1.00 0.00 C ATOM 2198 CG ASP B 27 -16.893 8.857 -7.917 1.00 0.00 C ATOM 2199 OD1 ASP B 27 -16.217 9.869 -7.993 1.00 0.00 O ATOM 2200 OD2 ASP B 27 -17.670 8.622 -7.005 1.00 0.00 O ATOM 0 H ASP B 27 -18.886 7.644 -10.369 1.00 0.00 H new ATOM 0 HA ASP B 27 -16.621 9.541 -10.346 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -17.509 7.036 -8.905 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -15.784 7.335 -8.978 1.00 0.00 H new ATOM 2205 N LEU B 28 -16.258 6.518 -11.640 1.00 0.00 N ATOM 2206 CA LEU B 28 -15.396 5.790 -12.623 1.00 0.00 C ATOM 2207 C LEU B 28 -15.981 5.886 -14.034 1.00 0.00 C ATOM 2208 O LEU B 28 -15.324 5.565 -15.005 1.00 0.00 O ATOM 2209 CB LEU B 28 -15.307 4.316 -12.228 1.00 0.00 C ATOM 2210 CG LEU B 28 -14.878 4.196 -10.766 1.00 0.00 C ATOM 2211 CD1 LEU B 28 -14.862 2.721 -10.363 1.00 0.00 C ATOM 2212 CD2 LEU B 28 -13.475 4.782 -10.595 1.00 0.00 C ATOM 0 H LEU B 28 -16.973 5.953 -11.183 1.00 0.00 H new ATOM 0 HA LEU B 28 -14.406 6.246 -12.616 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -16.273 3.832 -12.374 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -14.592 3.801 -12.870 1.00 0.00 H new ATOM 0 HG LEU B 28 -15.580 4.742 -10.135 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -14.556 2.632 -9.321 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -15.860 2.299 -10.486 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.159 2.179 -10.995 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -13.169 4.696 -9.552 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -12.773 4.235 -11.225 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.481 5.832 -10.886 1.00 0.00 H new ATOM 2224 N GLY B 29 -17.204 6.314 -14.167 1.00 0.00 N ATOM 2225 CA GLY B 29 -17.805 6.411 -15.530 1.00 0.00 C ATOM 2226 C GLY B 29 -17.868 5.016 -16.159 1.00 0.00 C ATOM 2227 O GLY B 29 -18.122 4.865 -17.338 1.00 0.00 O ATOM 0 H GLY B 29 -17.812 6.599 -13.399 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -18.805 6.840 -15.469 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -17.210 7.077 -16.155 1.00 0.00 H new ATOM 2231 N TRP B 30 -17.637 3.993 -15.380 1.00 0.00 N ATOM 2232 CA TRP B 30 -17.679 2.607 -15.922 1.00 0.00 C ATOM 2233 C TRP B 30 -18.904 2.443 -16.819 1.00 0.00 C ATOM 2234 O TRP B 30 -20.019 2.719 -16.425 1.00 0.00 O ATOM 2235 CB TRP B 30 -17.761 1.616 -14.761 1.00 0.00 C ATOM 2236 CG TRP B 30 -16.385 1.328 -14.260 1.00 0.00 C ATOM 2237 CD1 TRP B 30 -15.284 2.060 -14.548 1.00 0.00 C ATOM 2238 CD2 TRP B 30 -15.942 0.246 -13.393 1.00 0.00 C ATOM 2239 NE1 TRP B 30 -14.194 1.493 -13.915 1.00 0.00 N ATOM 2240 CE2 TRP B 30 -14.548 0.372 -13.191 1.00 0.00 C ATOM 2241 CE3 TRP B 30 -16.609 -0.822 -12.771 1.00 0.00 C ATOM 2242 CZ2 TRP B 30 -13.840 -0.531 -12.399 1.00 0.00 C ATOM 2243 CZ3 TRP B 30 -15.900 -1.735 -11.972 1.00 0.00 C ATOM 2244 CH2 TRP B 30 -14.517 -1.590 -11.788 1.00 0.00 C ATOM 0 H TRP B 30 -17.420 4.060 -14.386 1.00 0.00 H new ATOM 0 HA TRP B 30 -16.778 2.416 -16.506 1.00 0.00 H new ATOM 0 HB2 TRP B 30 -18.374 2.028 -13.959 1.00 0.00 H new ATOM 0 HB3 TRP B 30 -18.242 0.694 -15.088 1.00 0.00 H new ATOM 0 HD1 TRP B 30 -15.261 2.942 -15.170 1.00 0.00 H new ATOM 0 HE1 TRP B 30 -13.244 1.858 -13.975 1.00 0.00 H new ATOM 0 HE3 TRP B 30 -17.674 -0.942 -12.908 1.00 0.00 H new ATOM 0 HZ2 TRP B 30 -12.776 -0.413 -12.259 1.00 0.00 H new ATOM 0 HZ3 TRP B 30 -16.422 -2.552 -11.497 1.00 0.00 H new ATOM 0 HH2 TRP B 30 -13.976 -2.296 -11.175 1.00 0.00 H new ATOM 2255 N LYS B 31 -18.701 2.002 -18.029 1.00 0.00 N ATOM 2256 CA LYS B 31 -19.834 1.822 -18.961 1.00 0.00 C ATOM 2257 C LYS B 31 -20.142 0.332 -19.113 1.00 0.00 C ATOM 2258 O LYS B 31 -21.146 -0.047 -19.682 1.00 0.00 O ATOM 2259 CB LYS B 31 -19.432 2.391 -20.314 1.00 0.00 C ATOM 2260 CG LYS B 31 -19.834 3.864 -20.397 1.00 0.00 C ATOM 2261 CD LYS B 31 -18.755 4.649 -21.144 1.00 0.00 C ATOM 2262 CE LYS B 31 -19.110 4.720 -22.630 1.00 0.00 C ATOM 2263 NZ LYS B 31 -19.348 6.140 -23.016 1.00 0.00 N ATOM 0 H LYS B 31 -17.787 1.758 -18.410 1.00 0.00 H new ATOM 0 HA LYS B 31 -20.718 2.333 -18.579 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.356 2.290 -20.456 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -19.914 1.828 -21.113 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -20.790 3.962 -20.911 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -19.967 4.272 -19.395 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -18.671 5.654 -20.731 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.785 4.169 -21.014 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -18.302 4.300 -23.229 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -19.999 4.123 -22.831 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -19.589 6.189 -24.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -20.133 6.526 -22.453 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -18.488 6.697 -22.838 1.00 0.00 H new ATOM 2277 N TRP B 32 -19.283 -0.517 -18.619 1.00 0.00 N ATOM 2278 CA TRP B 32 -19.533 -1.979 -18.754 1.00 0.00 C ATOM 2279 C TRP B 32 -20.400 -2.469 -17.597 1.00 0.00 C ATOM 2280 O TRP B 32 -20.776 -3.620 -17.545 1.00 0.00 O ATOM 2281 CB TRP B 32 -18.203 -2.737 -18.763 1.00 0.00 C ATOM 2282 CG TRP B 32 -17.637 -2.809 -17.379 1.00 0.00 C ATOM 2283 CD1 TRP B 32 -16.982 -1.805 -16.756 1.00 0.00 C ATOM 2284 CD2 TRP B 32 -17.661 -3.923 -16.440 1.00 0.00 C ATOM 2285 NE1 TRP B 32 -16.587 -2.236 -15.506 1.00 0.00 N ATOM 2286 CE2 TRP B 32 -16.984 -3.534 -15.261 1.00 0.00 C ATOM 2287 CE3 TRP B 32 -18.197 -5.221 -16.496 1.00 0.00 C ATOM 2288 CZ2 TRP B 32 -16.840 -4.401 -14.178 1.00 0.00 C ATOM 2289 CZ3 TRP B 32 -18.058 -6.099 -15.408 1.00 0.00 C ATOM 2290 CH2 TRP B 32 -17.377 -5.688 -14.250 1.00 0.00 C ATOM 0 H TRP B 32 -18.424 -0.263 -18.131 1.00 0.00 H new ATOM 0 HA TRP B 32 -20.055 -2.163 -19.693 1.00 0.00 H new ATOM 0 HB2 TRP B 32 -18.353 -3.743 -19.155 1.00 0.00 H new ATOM 0 HB3 TRP B 32 -17.497 -2.238 -19.427 1.00 0.00 H new ATOM 0 HD1 TRP B 32 -16.797 -0.824 -17.169 1.00 0.00 H new ATOM 0 HE1 TRP B 32 -16.064 -1.664 -14.843 1.00 0.00 H new ATOM 0 HE3 TRP B 32 -18.720 -5.546 -17.383 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 -16.317 -4.079 -13.290 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 -18.476 -7.093 -15.462 1.00 0.00 H new ATOM 0 HH2 TRP B 32 -17.269 -6.366 -13.417 1.00 0.00 H new ATOM 2301 N ILE B 33 -20.723 -1.609 -16.673 1.00 0.00 N ATOM 2302 CA ILE B 33 -21.568 -2.041 -15.526 1.00 0.00 C ATOM 2303 C ILE B 33 -22.814 -1.152 -15.452 1.00 0.00 C ATOM 2304 O ILE B 33 -22.727 0.060 -15.440 1.00 0.00 O ATOM 2305 CB ILE B 33 -20.756 -1.941 -14.227 1.00 0.00 C ATOM 2306 CG1 ILE B 33 -19.908 -3.203 -14.080 1.00 0.00 C ATOM 2307 CG2 ILE B 33 -21.691 -1.820 -13.019 1.00 0.00 C ATOM 2308 CD1 ILE B 33 -18.974 -3.064 -12.881 1.00 0.00 C ATOM 0 H ILE B 33 -20.440 -0.629 -16.662 1.00 0.00 H new ATOM 0 HA ILE B 33 -21.882 -3.076 -15.663 1.00 0.00 H new ATOM 0 HB ILE B 33 -20.120 -1.057 -14.269 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -20.553 -4.072 -13.951 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -19.327 -3.369 -14.987 1.00 0.00 H new ATOM 0 HG21 ILE B 33 -21.099 -1.750 -12.106 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -22.305 -0.926 -13.123 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -22.335 -2.698 -12.968 1.00 0.00 H new ATOM 0 HD11 ILE B 33 -18.372 -3.967 -12.782 1.00 0.00 H new ATOM 0 HD12 ILE B 33 -18.318 -2.206 -13.028 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -19.563 -2.920 -11.976 1.00 0.00 H new ATOM 2320 N HIS B 34 -23.970 -1.752 -15.407 1.00 0.00 N ATOM 2321 CA HIS B 34 -25.229 -0.957 -15.338 1.00 0.00 C ATOM 2322 C HIS B 34 -25.655 -0.803 -13.874 1.00 0.00 C ATOM 2323 O HIS B 34 -25.867 0.292 -13.394 1.00 0.00 O ATOM 2324 CB HIS B 34 -26.324 -1.684 -16.131 1.00 0.00 C ATOM 2325 CG HIS B 34 -27.683 -1.172 -15.731 1.00 0.00 C ATOM 2326 ND1 HIS B 34 -28.066 0.144 -15.931 1.00 0.00 N ATOM 2327 CD2 HIS B 34 -28.757 -1.790 -15.140 1.00 0.00 C ATOM 2328 CE1 HIS B 34 -29.323 0.275 -15.469 1.00 0.00 C ATOM 2329 NE2 HIS B 34 -29.792 -0.875 -14.977 1.00 0.00 N ATOM 0 H HIS B 34 -24.098 -2.764 -15.415 1.00 0.00 H new ATOM 0 HA HIS B 34 -25.069 0.032 -15.766 1.00 0.00 H new ATOM 0 HB2 HIS B 34 -26.170 -1.533 -17.200 1.00 0.00 H new ATOM 0 HB3 HIS B 34 -26.264 -2.757 -15.949 1.00 0.00 H new ATOM 0 HD1 HIS B 34 -27.499 0.880 -16.352 1.00 0.00 H new ATOM 0 HD2 HIS B 34 -28.793 -2.829 -14.846 1.00 0.00 H new ATOM 0 HE1 HIS B 34 -29.884 1.197 -15.493 1.00 0.00 H new ATOM 2337 N GLU B 35 -25.785 -1.890 -13.163 1.00 0.00 N ATOM 2338 CA GLU B 35 -26.200 -1.797 -11.734 1.00 0.00 C ATOM 2339 C GLU B 35 -25.189 -2.540 -10.856 1.00 0.00 C ATOM 2340 O GLU B 35 -24.530 -3.454 -11.309 1.00 0.00 O ATOM 2341 CB GLU B 35 -27.583 -2.428 -11.563 1.00 0.00 C ATOM 2342 CG GLU B 35 -28.657 -1.432 -12.004 1.00 0.00 C ATOM 2343 CD GLU B 35 -29.975 -2.172 -12.239 1.00 0.00 C ATOM 2344 OE1 GLU B 35 -29.927 -3.371 -12.460 1.00 0.00 O ATOM 2345 OE2 GLU B 35 -31.010 -1.528 -12.196 1.00 0.00 O ATOM 0 H GLU B 35 -25.622 -2.836 -13.508 1.00 0.00 H new ATOM 0 HA GLU B 35 -26.238 -0.749 -11.436 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -27.654 -3.341 -12.155 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -27.739 -2.710 -10.522 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -28.790 -0.664 -11.242 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -28.345 -0.925 -12.917 1.00 0.00 H new ATOM 2352 N PRO B 36 -25.101 -2.123 -9.618 1.00 0.00 N ATOM 2353 CA PRO B 36 -25.908 -1.012 -9.083 1.00 0.00 C ATOM 2354 C PRO B 36 -25.328 0.332 -9.528 1.00 0.00 C ATOM 2355 O PRO B 36 -24.280 0.397 -10.138 1.00 0.00 O ATOM 2356 CB PRO B 36 -25.787 -1.181 -7.566 1.00 0.00 C ATOM 2357 CG PRO B 36 -24.495 -1.996 -7.320 1.00 0.00 C ATOM 2358 CD PRO B 36 -24.181 -2.730 -8.637 1.00 0.00 C ATOM 0 HA PRO B 36 -26.941 -1.027 -9.429 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -25.735 -0.212 -7.070 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -26.656 -1.700 -7.162 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -23.672 -1.341 -7.036 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -24.634 -2.706 -6.504 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -23.140 -2.594 -8.930 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -24.349 -3.803 -8.545 1.00 0.00 H new ATOM 2366 N LYS B 37 -25.999 1.407 -9.218 1.00 0.00 N ATOM 2367 CA LYS B 37 -25.491 2.742 -9.609 1.00 0.00 C ATOM 2368 C LYS B 37 -24.064 2.907 -9.090 1.00 0.00 C ATOM 2369 O LYS B 37 -23.220 3.502 -9.730 1.00 0.00 O ATOM 2370 CB LYS B 37 -26.391 3.796 -8.978 1.00 0.00 C ATOM 2371 CG LYS B 37 -27.526 4.147 -9.941 1.00 0.00 C ATOM 2372 CD LYS B 37 -28.253 5.397 -9.440 1.00 0.00 C ATOM 2373 CE LYS B 37 -28.684 5.189 -7.987 1.00 0.00 C ATOM 2374 NZ LYS B 37 -27.793 5.975 -7.087 1.00 0.00 N ATOM 0 H LYS B 37 -26.882 1.413 -8.708 1.00 0.00 H new ATOM 0 HA LYS B 37 -25.491 2.850 -10.694 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -26.800 3.424 -8.039 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -25.812 4.689 -8.742 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -27.128 4.321 -10.941 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -28.224 3.313 -10.016 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -27.599 6.266 -9.516 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -29.124 5.598 -10.064 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -29.720 5.502 -7.855 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -28.636 4.131 -7.730 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -27.620 5.437 -6.214 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -26.888 6.157 -7.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -28.248 6.880 -6.852 1.00 0.00 H new ATOM 2388 N GLY B 38 -23.795 2.379 -7.931 1.00 0.00 N ATOM 2389 CA GLY B 38 -22.426 2.492 -7.352 1.00 0.00 C ATOM 2390 C GLY B 38 -22.295 1.526 -6.174 1.00 0.00 C ATOM 2391 O GLY B 38 -22.877 0.461 -6.167 1.00 0.00 O ATOM 0 H GLY B 38 -24.467 1.871 -7.355 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -21.678 2.262 -8.111 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -22.242 3.514 -7.021 1.00 0.00 H new ATOM 2395 N TYR B 39 -21.536 1.889 -5.176 1.00 0.00 N ATOM 2396 CA TYR B 39 -21.371 0.987 -4.001 1.00 0.00 C ATOM 2397 C TYR B 39 -20.419 1.630 -2.991 1.00 0.00 C ATOM 2398 O TYR B 39 -19.916 2.715 -3.202 1.00 0.00 O ATOM 2399 CB TYR B 39 -20.799 -0.352 -4.467 1.00 0.00 C ATOM 2400 CG TYR B 39 -19.346 -0.182 -4.838 1.00 0.00 C ATOM 2401 CD1 TYR B 39 -18.982 0.645 -5.909 1.00 0.00 C ATOM 2402 CD2 TYR B 39 -18.364 -0.855 -4.110 1.00 0.00 C ATOM 2403 CE1 TYR B 39 -17.633 0.795 -6.250 1.00 0.00 C ATOM 2404 CE2 TYR B 39 -17.015 -0.705 -4.450 1.00 0.00 C ATOM 2405 CZ TYR B 39 -16.650 0.120 -5.520 1.00 0.00 C ATOM 2406 OH TYR B 39 -15.319 0.267 -5.854 1.00 0.00 O ATOM 0 H TYR B 39 -21.024 2.770 -5.124 1.00 0.00 H new ATOM 0 HA TYR B 39 -22.339 0.823 -3.528 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -20.898 -1.096 -3.676 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -21.363 -0.721 -5.324 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -19.742 1.167 -6.471 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -18.645 -1.492 -3.284 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -17.352 1.431 -7.076 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -16.255 -1.226 -3.887 1.00 0.00 H new ATOM 0 HH TYR B 39 -14.766 -0.244 -5.227 1.00 0.00 H new ATOM 2416 N HIS B 40 -20.164 0.968 -1.894 1.00 0.00 N ATOM 2417 CA HIS B 40 -19.239 1.543 -0.878 1.00 0.00 C ATOM 2418 C HIS B 40 -17.827 1.015 -1.136 1.00 0.00 C ATOM 2419 O HIS B 40 -17.366 0.098 -0.488 1.00 0.00 O ATOM 2420 CB HIS B 40 -19.693 1.124 0.523 1.00 0.00 C ATOM 2421 CG HIS B 40 -21.124 1.537 0.729 1.00 0.00 C ATOM 2422 ND1 HIS B 40 -22.168 0.961 0.022 1.00 0.00 N ATOM 2423 CD2 HIS B 40 -21.701 2.467 1.558 1.00 0.00 C ATOM 2424 CE1 HIS B 40 -23.309 1.546 0.434 1.00 0.00 C ATOM 2425 NE2 HIS B 40 -23.080 2.471 1.370 1.00 0.00 N ATOM 0 H HIS B 40 -20.556 0.056 -1.659 1.00 0.00 H new ATOM 0 HA HIS B 40 -19.245 2.631 -0.947 1.00 0.00 H new ATOM 0 HB2 HIS B 40 -19.594 0.045 0.642 1.00 0.00 H new ATOM 0 HB3 HIS B 40 -19.057 1.588 1.277 1.00 0.00 H new ATOM 0 HD2 HIS B 40 -21.166 3.099 2.251 1.00 0.00 H new ATOM 0 HE1 HIS B 40 -24.289 1.298 0.054 1.00 0.00 H new ATOM 0 HE2 HIS B 40 -23.768 3.055 1.845 1.00 0.00 H new ATOM 2433 N ALA B 41 -17.142 1.580 -2.093 1.00 0.00 N ATOM 2434 CA ALA B 41 -15.766 1.104 -2.410 1.00 0.00 C ATOM 2435 C ALA B 41 -14.834 1.350 -1.221 1.00 0.00 C ATOM 2436 O ALA B 41 -13.947 0.564 -0.951 1.00 0.00 O ATOM 2437 CB ALA B 41 -15.244 1.851 -3.638 1.00 0.00 C ATOM 0 H ALA B 41 -17.477 2.352 -2.670 1.00 0.00 H new ATOM 0 HA ALA B 41 -15.796 0.034 -2.616 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -14.237 1.506 -3.873 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -15.901 1.660 -4.487 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -15.221 2.921 -3.431 1.00 0.00 H new ATOM 2443 N ASN B 42 -15.019 2.426 -0.509 1.00 0.00 N ATOM 2444 CA ASN B 42 -14.131 2.699 0.656 1.00 0.00 C ATOM 2445 C ASN B 42 -12.688 2.843 0.170 1.00 0.00 C ATOM 2446 O ASN B 42 -12.389 2.622 -0.986 1.00 0.00 O ATOM 2447 CB ASN B 42 -14.210 1.531 1.642 1.00 0.00 C ATOM 2448 CG ASN B 42 -15.337 1.781 2.646 1.00 0.00 C ATOM 2449 OD1 ASN B 42 -15.772 2.902 2.821 1.00 0.00 O ATOM 2450 ND2 ASN B 42 -15.832 0.778 3.315 1.00 0.00 N ATOM 0 H ASN B 42 -15.742 3.125 -0.681 1.00 0.00 H new ATOM 0 HA ASN B 42 -14.450 3.618 1.147 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -14.388 0.600 1.104 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -13.261 1.420 2.166 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -16.585 0.934 3.986 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -15.467 -0.163 3.168 1.00 0.00 H new ATOM 2457 N PHE B 43 -11.788 3.196 1.046 1.00 0.00 N ATOM 2458 CA PHE B 43 -10.365 3.334 0.628 1.00 0.00 C ATOM 2459 C PHE B 43 -9.510 3.717 1.834 1.00 0.00 C ATOM 2460 O PHE B 43 -10.009 3.876 2.931 1.00 0.00 O ATOM 2461 CB PHE B 43 -10.240 4.389 -0.476 1.00 0.00 C ATOM 2462 CG PHE B 43 -10.355 5.779 0.092 1.00 0.00 C ATOM 2463 CD1 PHE B 43 -11.385 6.104 0.982 1.00 0.00 C ATOM 2464 CD2 PHE B 43 -9.434 6.756 -0.297 1.00 0.00 C ATOM 2465 CE1 PHE B 43 -11.491 7.408 1.481 1.00 0.00 C ATOM 2466 CE2 PHE B 43 -9.538 8.053 0.203 1.00 0.00 C ATOM 2467 CZ PHE B 43 -10.567 8.382 1.090 1.00 0.00 C ATOM 0 H PHE B 43 -11.975 3.394 2.029 1.00 0.00 H new ATOM 0 HA PHE B 43 -10.012 2.381 0.234 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.282 4.278 -0.984 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -11.017 4.232 -1.224 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -12.097 5.350 1.284 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -8.641 6.506 -0.986 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -12.286 7.661 2.167 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -8.822 8.805 -0.095 1.00 0.00 H new ATOM 0 HZ PHE B 43 -10.648 9.388 1.473 1.00 0.00 H new ATOM 2477 N CYS B 44 -8.223 3.838 1.655 1.00 0.00 N ATOM 2478 CA CYS B 44 -7.346 4.177 2.812 1.00 0.00 C ATOM 2479 C CYS B 44 -6.578 5.471 2.528 1.00 0.00 C ATOM 2480 O CYS B 44 -6.241 5.769 1.400 1.00 0.00 O ATOM 2481 CB CYS B 44 -6.334 3.048 3.039 1.00 0.00 C ATOM 2482 SG CYS B 44 -7.011 1.461 2.476 1.00 0.00 S ATOM 0 H CYS B 44 -7.743 3.718 0.763 1.00 0.00 H new ATOM 0 HA CYS B 44 -7.970 4.306 3.697 1.00 0.00 H new ATOM 0 HB2 CYS B 44 -5.411 3.267 2.502 1.00 0.00 H new ATOM 0 HB3 CYS B 44 -6.081 2.987 4.097 1.00 0.00 H new ATOM 2487 N LEU B 45 -6.287 6.233 3.549 1.00 0.00 N ATOM 2488 CA LEU B 45 -5.527 7.497 3.344 1.00 0.00 C ATOM 2489 C LEU B 45 -4.594 7.735 4.534 1.00 0.00 C ATOM 2490 O LEU B 45 -4.619 7.014 5.511 1.00 0.00 O ATOM 2491 CB LEU B 45 -6.501 8.669 3.231 1.00 0.00 C ATOM 2492 CG LEU B 45 -7.142 8.682 1.848 1.00 0.00 C ATOM 2493 CD1 LEU B 45 -7.931 9.979 1.684 1.00 0.00 C ATOM 2494 CD2 LEU B 45 -6.057 8.605 0.772 1.00 0.00 C ATOM 0 H LEU B 45 -6.544 6.033 4.516 1.00 0.00 H new ATOM 0 HA LEU B 45 -4.941 7.417 2.428 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.272 8.587 3.997 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -5.975 9.608 3.406 1.00 0.00 H new ATOM 0 HG LEU B 45 -7.807 7.825 1.743 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -8.395 10.001 0.698 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -8.704 10.034 2.450 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -7.258 10.830 1.787 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -6.521 8.615 -0.214 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.389 9.461 0.867 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -5.487 7.684 0.896 1.00 0.00 H new ATOM 2506 N GLY B 46 -3.774 8.750 4.458 1.00 0.00 N ATOM 2507 CA GLY B 46 -2.840 9.049 5.581 1.00 0.00 C ATOM 2508 C GLY B 46 -1.902 7.857 5.810 1.00 0.00 C ATOM 2509 O GLY B 46 -2.308 6.720 5.682 1.00 0.00 O ATOM 0 H GLY B 46 -3.711 9.386 3.663 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -2.258 9.942 5.354 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -3.405 9.259 6.489 1.00 0.00 H new ATOM 2513 N PRO B 47 -0.672 8.159 6.148 1.00 0.00 N ATOM 2514 CA PRO B 47 0.355 7.136 6.407 1.00 0.00 C ATOM 2515 C PRO B 47 0.179 6.551 7.812 1.00 0.00 C ATOM 2516 O PRO B 47 -0.815 6.781 8.471 1.00 0.00 O ATOM 2517 CB PRO B 47 1.670 7.914 6.305 1.00 0.00 C ATOM 2518 CG PRO B 47 1.319 9.399 6.561 1.00 0.00 C ATOM 2519 CD PRO B 47 -0.191 9.548 6.298 1.00 0.00 C ATOM 0 HA PRO B 47 0.307 6.295 5.716 1.00 0.00 H new ATOM 0 HB2 PRO B 47 2.392 7.554 7.037 1.00 0.00 H new ATOM 0 HB3 PRO B 47 2.122 7.786 5.322 1.00 0.00 H new ATOM 0 HG2 PRO B 47 1.564 9.684 7.584 1.00 0.00 H new ATOM 0 HG3 PRO B 47 1.893 10.051 5.903 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -0.691 10.055 7.123 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -0.383 10.135 5.400 1.00 0.00 H new ATOM 2527 N CYS B 48 1.139 5.798 8.277 1.00 0.00 N ATOM 2528 CA CYS B 48 1.026 5.205 9.640 1.00 0.00 C ATOM 2529 C CYS B 48 2.407 5.141 10.295 1.00 0.00 C ATOM 2530 O CYS B 48 3.414 5.078 9.617 1.00 0.00 O ATOM 2531 CB CYS B 48 0.453 3.788 9.546 1.00 0.00 C ATOM 2532 SG CYS B 48 1.142 2.933 8.106 1.00 0.00 S ATOM 0 H CYS B 48 1.995 5.568 7.773 1.00 0.00 H new ATOM 0 HA CYS B 48 0.364 5.829 10.240 1.00 0.00 H new ATOM 0 HB2 CYS B 48 0.686 3.232 10.454 1.00 0.00 H new ATOM 0 HB3 CYS B 48 -0.633 3.831 9.468 1.00 0.00 H new ATOM 2537 N PRO B 49 2.408 5.145 11.605 1.00 0.00 N ATOM 2538 CA PRO B 49 3.647 5.070 12.396 1.00 0.00 C ATOM 2539 C PRO B 49 4.191 3.629 12.358 1.00 0.00 C ATOM 2540 O PRO B 49 4.187 2.999 11.320 1.00 0.00 O ATOM 2541 CB PRO B 49 3.195 5.508 13.800 1.00 0.00 C ATOM 2542 CG PRO B 49 1.671 5.264 13.867 1.00 0.00 C ATOM 2543 CD PRO B 49 1.172 5.222 12.411 1.00 0.00 C ATOM 0 HA PRO B 49 4.462 5.695 12.031 1.00 0.00 H new ATOM 0 HB2 PRO B 49 3.713 4.937 14.570 1.00 0.00 H new ATOM 0 HB3 PRO B 49 3.427 6.559 13.972 1.00 0.00 H new ATOM 0 HG2 PRO B 49 1.450 4.328 14.380 1.00 0.00 H new ATOM 0 HG3 PRO B 49 1.175 6.058 14.425 1.00 0.00 H new ATOM 0 HD2 PRO B 49 0.528 4.360 12.236 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.590 6.110 12.164 1.00 0.00 H new ATOM 2551 N TYR B 50 4.663 3.095 13.454 1.00 0.00 N ATOM 2552 CA TYR B 50 5.200 1.700 13.417 1.00 0.00 C ATOM 2553 C TYR B 50 4.140 0.715 13.921 1.00 0.00 C ATOM 2554 O TYR B 50 3.414 0.124 13.149 1.00 0.00 O ATOM 2555 CB TYR B 50 6.462 1.575 14.289 1.00 0.00 C ATOM 2556 CG TYR B 50 6.637 2.801 15.156 1.00 0.00 C ATOM 2557 CD1 TYR B 50 6.956 4.031 14.571 1.00 0.00 C ATOM 2558 CD2 TYR B 50 6.479 2.707 16.545 1.00 0.00 C ATOM 2559 CE1 TYR B 50 7.118 5.168 15.372 1.00 0.00 C ATOM 2560 CE2 TYR B 50 6.641 3.843 17.346 1.00 0.00 C ATOM 2561 CZ TYR B 50 6.959 5.074 16.759 1.00 0.00 C ATOM 2562 OH TYR B 50 7.118 6.194 17.550 1.00 0.00 O ATOM 0 H TYR B 50 4.701 3.556 14.363 1.00 0.00 H new ATOM 0 HA TYR B 50 5.459 1.466 12.385 1.00 0.00 H new ATOM 0 HB2 TYR B 50 6.390 0.687 14.917 1.00 0.00 H new ATOM 0 HB3 TYR B 50 7.338 1.445 13.653 1.00 0.00 H new ATOM 0 HD1 TYR B 50 7.077 4.104 13.500 1.00 0.00 H new ATOM 0 HD2 TYR B 50 6.232 1.758 16.997 1.00 0.00 H new ATOM 0 HE1 TYR B 50 7.366 6.117 14.920 1.00 0.00 H new ATOM 0 HE2 TYR B 50 6.521 3.770 18.417 1.00 0.00 H new ATOM 0 HH TYR B 50 6.972 5.955 18.489 1.00 0.00 H new ATOM 2572 N ILE B 51 4.061 0.525 15.211 1.00 0.00 N ATOM 2573 CA ILE B 51 3.067 -0.435 15.782 1.00 0.00 C ATOM 2574 C ILE B 51 1.744 -0.383 15.008 1.00 0.00 C ATOM 2575 O ILE B 51 1.014 -1.352 14.955 1.00 0.00 O ATOM 2576 CB ILE B 51 2.806 -0.078 17.247 1.00 0.00 C ATOM 2577 CG1 ILE B 51 2.002 1.223 17.318 1.00 0.00 C ATOM 2578 CG2 ILE B 51 4.141 0.108 17.971 1.00 0.00 C ATOM 2579 CD1 ILE B 51 1.564 1.473 18.762 1.00 0.00 C ATOM 0 H ILE B 51 4.646 0.997 15.900 1.00 0.00 H new ATOM 0 HA ILE B 51 3.475 -1.443 15.704 1.00 0.00 H new ATOM 0 HB ILE B 51 2.243 -0.881 17.723 1.00 0.00 H new ATOM 0 HG12 ILE B 51 2.606 2.057 16.960 1.00 0.00 H new ATOM 0 HG13 ILE B 51 1.130 1.160 16.668 1.00 0.00 H new ATOM 0 HG21 ILE B 51 3.957 0.362 19.015 1.00 0.00 H new ATOM 0 HG22 ILE B 51 4.715 -0.817 17.919 1.00 0.00 H new ATOM 0 HG23 ILE B 51 4.704 0.911 17.496 1.00 0.00 H new ATOM 0 HD11 ILE B 51 0.992 2.399 18.813 1.00 0.00 H new ATOM 0 HD12 ILE B 51 0.944 0.644 19.103 1.00 0.00 H new ATOM 0 HD13 ILE B 51 2.444 1.554 19.400 1.00 0.00 H new ATOM 2591 N TRP B 52 1.421 0.734 14.417 1.00 0.00 N ATOM 2592 CA TRP B 52 0.137 0.838 13.659 1.00 0.00 C ATOM 2593 C TRP B 52 0.045 -0.266 12.602 1.00 0.00 C ATOM 2594 O TRP B 52 0.415 -0.070 11.462 1.00 0.00 O ATOM 2595 CB TRP B 52 0.061 2.198 12.974 1.00 0.00 C ATOM 2596 CG TRP B 52 -1.345 2.701 13.024 1.00 0.00 C ATOM 2597 CD1 TRP B 52 -1.990 3.288 11.994 1.00 0.00 C ATOM 2598 CD2 TRP B 52 -2.289 2.671 14.135 1.00 0.00 C ATOM 2599 NE1 TRP B 52 -3.268 3.627 12.400 1.00 0.00 N ATOM 2600 CE2 TRP B 52 -3.502 3.264 13.711 1.00 0.00 C ATOM 2601 CE3 TRP B 52 -2.212 2.192 15.456 1.00 0.00 C ATOM 2602 CZ2 TRP B 52 -4.600 3.379 14.566 1.00 0.00 C ATOM 2603 CZ3 TRP B 52 -3.314 2.305 16.319 1.00 0.00 C ATOM 2604 CH2 TRP B 52 -4.506 2.896 15.875 1.00 0.00 C ATOM 0 H TRP B 52 1.989 1.581 14.425 1.00 0.00 H new ATOM 0 HA TRP B 52 -0.691 0.726 14.358 1.00 0.00 H new ATOM 0 HB2 TRP B 52 0.729 2.904 13.467 1.00 0.00 H new ATOM 0 HB3 TRP B 52 0.393 2.115 11.939 1.00 0.00 H new ATOM 0 HD1 TRP B 52 -1.576 3.464 11.012 1.00 0.00 H new ATOM 0 HE1 TRP B 52 -3.954 4.089 11.803 1.00 0.00 H new ATOM 0 HE3 TRP B 52 -1.299 1.734 15.808 1.00 0.00 H new ATOM 0 HZ2 TRP B 52 -5.514 3.837 14.219 1.00 0.00 H new ATOM 0 HZ3 TRP B 52 -3.243 1.934 17.331 1.00 0.00 H new ATOM 0 HH2 TRP B 52 -5.350 2.978 16.543 1.00 0.00 H new ATOM 2615 N SER B 53 -0.468 -1.413 12.978 1.00 0.00 N ATOM 2616 CA SER B 53 -0.623 -2.554 12.017 1.00 0.00 C ATOM 2617 C SER B 53 0.473 -2.527 10.945 1.00 0.00 C ATOM 2618 O SER B 53 0.369 -1.829 9.956 1.00 0.00 O ATOM 2619 CB SER B 53 -1.990 -2.458 11.341 1.00 0.00 C ATOM 2620 OG SER B 53 -3.002 -2.798 12.278 1.00 0.00 O ATOM 0 H SER B 53 -0.791 -1.611 13.925 1.00 0.00 H new ATOM 0 HA SER B 53 -0.538 -3.488 12.573 1.00 0.00 H new ATOM 0 HB2 SER B 53 -2.152 -1.448 10.964 1.00 0.00 H new ATOM 0 HB3 SER B 53 -2.032 -3.129 10.483 1.00 0.00 H new ATOM 0 HG SER B 53 -3.880 -2.736 11.848 1.00 0.00 H new ATOM 2626 N LEU B 54 1.513 -3.294 11.123 1.00 0.00 N ATOM 2627 CA LEU B 54 2.600 -3.316 10.103 1.00 0.00 C ATOM 2628 C LEU B 54 2.581 -4.659 9.372 1.00 0.00 C ATOM 2629 O LEU B 54 2.557 -5.709 9.983 1.00 0.00 O ATOM 2630 CB LEU B 54 3.953 -3.125 10.789 1.00 0.00 C ATOM 2631 CG LEU B 54 3.995 -1.745 11.443 1.00 0.00 C ATOM 2632 CD1 LEU B 54 5.238 -1.632 12.326 1.00 0.00 C ATOM 2633 CD2 LEU B 54 4.042 -0.668 10.357 1.00 0.00 C ATOM 0 H LEU B 54 1.657 -3.904 11.927 1.00 0.00 H new ATOM 0 HA LEU B 54 2.443 -2.509 9.387 1.00 0.00 H new ATOM 0 HB2 LEU B 54 4.106 -3.901 11.539 1.00 0.00 H new ATOM 0 HB3 LEU B 54 4.759 -3.221 10.062 1.00 0.00 H new ATOM 0 HG LEU B 54 3.103 -1.608 12.055 1.00 0.00 H new ATOM 0 HD11 LEU B 54 5.265 -0.647 12.791 1.00 0.00 H new ATOM 0 HD12 LEU B 54 5.205 -2.398 13.101 1.00 0.00 H new ATOM 0 HD13 LEU B 54 6.131 -1.770 11.717 1.00 0.00 H new ATOM 0 HD21 LEU B 54 4.072 0.317 10.823 1.00 0.00 H new ATOM 0 HD22 LEU B 54 4.933 -0.807 9.745 1.00 0.00 H new ATOM 0 HD23 LEU B 54 3.155 -0.746 9.729 1.00 0.00 H new ATOM 2645 N ASP B 55 2.587 -4.635 8.068 1.00 0.00 N ATOM 2646 CA ASP B 55 2.564 -5.912 7.301 1.00 0.00 C ATOM 2647 C ASP B 55 3.996 -6.351 6.990 1.00 0.00 C ATOM 2648 O ASP B 55 4.374 -7.481 7.226 1.00 0.00 O ATOM 2649 CB ASP B 55 1.797 -5.709 5.993 1.00 0.00 C ATOM 2650 CG ASP B 55 1.485 -7.070 5.368 1.00 0.00 C ATOM 2651 OD1 ASP B 55 2.326 -7.574 4.642 1.00 0.00 O ATOM 2652 OD2 ASP B 55 0.409 -7.585 5.626 1.00 0.00 O ATOM 0 H ASP B 55 2.607 -3.787 7.501 1.00 0.00 H new ATOM 0 HA ASP B 55 2.071 -6.681 7.896 1.00 0.00 H new ATOM 0 HB2 ASP B 55 0.873 -5.163 6.182 1.00 0.00 H new ATOM 0 HB3 ASP B 55 2.387 -5.107 5.303 1.00 0.00 H new ATOM 2657 N THR B 56 4.796 -5.469 6.457 1.00 0.00 N ATOM 2658 CA THR B 56 6.202 -5.841 6.128 1.00 0.00 C ATOM 2659 C THR B 56 7.154 -5.182 7.129 1.00 0.00 C ATOM 2660 O THR B 56 6.866 -4.141 7.683 1.00 0.00 O ATOM 2661 CB THR B 56 6.538 -5.362 4.714 1.00 0.00 C ATOM 2662 OG1 THR B 56 7.004 -4.022 4.769 1.00 0.00 O ATOM 2663 CG2 THR B 56 5.288 -5.435 3.835 1.00 0.00 C ATOM 0 H THR B 56 4.538 -4.508 6.235 1.00 0.00 H new ATOM 0 HA THR B 56 6.313 -6.924 6.182 1.00 0.00 H new ATOM 0 HB THR B 56 7.313 -6.000 4.289 1.00 0.00 H new ATOM 0 HG1 THR B 56 7.221 -3.714 3.864 1.00 0.00 H new ATOM 0 HG21 THR B 56 5.530 -5.093 2.829 1.00 0.00 H new ATOM 0 HG22 THR B 56 4.932 -6.465 3.793 1.00 0.00 H new ATOM 0 HG23 THR B 56 4.509 -4.799 4.256 1.00 0.00 H new ATOM 2671 N GLN B 57 8.289 -5.783 7.362 1.00 0.00 N ATOM 2672 CA GLN B 57 9.261 -5.191 8.324 1.00 0.00 C ATOM 2673 C GLN B 57 9.646 -3.786 7.859 1.00 0.00 C ATOM 2674 O GLN B 57 9.884 -2.902 8.656 1.00 0.00 O ATOM 2675 CB GLN B 57 10.513 -6.068 8.390 1.00 0.00 C ATOM 2676 CG GLN B 57 10.514 -6.860 9.698 1.00 0.00 C ATOM 2677 CD GLN B 57 11.912 -7.421 9.955 1.00 0.00 C ATOM 2678 OE1 GLN B 57 12.151 -8.598 9.768 1.00 0.00 O ATOM 2679 NE2 GLN B 57 12.854 -6.624 10.378 1.00 0.00 N ATOM 0 H GLN B 57 8.585 -6.657 6.928 1.00 0.00 H new ATOM 0 HA GLN B 57 8.805 -5.135 9.313 1.00 0.00 H new ATOM 0 HB2 GLN B 57 10.537 -6.750 7.540 1.00 0.00 H new ATOM 0 HB3 GLN B 57 11.408 -5.448 8.327 1.00 0.00 H new ATOM 0 HG2 GLN B 57 10.211 -6.217 10.525 1.00 0.00 H new ATOM 0 HG3 GLN B 57 9.789 -7.672 9.644 1.00 0.00 H new ATOM 0 HE21 GLN B 57 12.654 -5.636 10.535 1.00 0.00 H new ATOM 0 HE22 GLN B 57 13.791 -6.989 10.552 1.00 0.00 H new ATOM 2688 N TYR B 58 9.707 -3.572 6.573 1.00 0.00 N ATOM 2689 CA TYR B 58 10.073 -2.222 6.060 1.00 0.00 C ATOM 2690 C TYR B 58 9.001 -1.214 6.495 1.00 0.00 C ATOM 2691 O TYR B 58 9.297 -0.080 6.816 1.00 0.00 O ATOM 2692 CB TYR B 58 10.178 -2.275 4.524 1.00 0.00 C ATOM 2693 CG TYR B 58 9.888 -0.916 3.928 1.00 0.00 C ATOM 2694 CD1 TYR B 58 10.877 0.074 3.916 1.00 0.00 C ATOM 2695 CD2 TYR B 58 8.622 -0.648 3.395 1.00 0.00 C ATOM 2696 CE1 TYR B 58 10.599 1.331 3.368 1.00 0.00 C ATOM 2697 CE2 TYR B 58 8.346 0.610 2.848 1.00 0.00 C ATOM 2698 CZ TYR B 58 9.335 1.598 2.836 1.00 0.00 C ATOM 2699 OH TYR B 58 9.062 2.837 2.298 1.00 0.00 O ATOM 0 H TYR B 58 9.519 -4.273 5.856 1.00 0.00 H new ATOM 0 HA TYR B 58 11.036 -1.910 6.466 1.00 0.00 H new ATOM 0 HB2 TYR B 58 11.176 -2.601 4.233 1.00 0.00 H new ATOM 0 HB3 TYR B 58 9.475 -3.009 4.130 1.00 0.00 H new ATOM 0 HD1 TYR B 58 11.853 -0.132 4.329 1.00 0.00 H new ATOM 0 HD2 TYR B 58 7.858 -1.412 3.406 1.00 0.00 H new ATOM 0 HE1 TYR B 58 11.362 2.095 3.356 1.00 0.00 H new ATOM 0 HE2 TYR B 58 7.370 0.818 2.435 1.00 0.00 H new ATOM 0 HH TYR B 58 8.242 2.788 1.764 1.00 0.00 H new ATOM 2709 N SER B 59 7.760 -1.619 6.507 1.00 0.00 N ATOM 2710 CA SER B 59 6.677 -0.682 6.921 1.00 0.00 C ATOM 2711 C SER B 59 6.957 -0.171 8.336 1.00 0.00 C ATOM 2712 O SER B 59 6.451 0.853 8.748 1.00 0.00 O ATOM 2713 CB SER B 59 5.334 -1.412 6.899 1.00 0.00 C ATOM 2714 OG SER B 59 4.340 -0.582 7.487 1.00 0.00 O ATOM 0 H SER B 59 7.450 -2.556 6.249 1.00 0.00 H new ATOM 0 HA SER B 59 6.643 0.161 6.231 1.00 0.00 H new ATOM 0 HB2 SER B 59 5.058 -1.660 5.874 1.00 0.00 H new ATOM 0 HB3 SER B 59 5.409 -2.352 7.445 1.00 0.00 H new ATOM 0 HG SER B 59 3.480 -1.052 7.488 1.00 0.00 H new ATOM 2720 N LYS B 60 7.763 -0.877 9.082 1.00 0.00 N ATOM 2721 CA LYS B 60 8.075 -0.431 10.468 1.00 0.00 C ATOM 2722 C LYS B 60 9.262 0.534 10.429 1.00 0.00 C ATOM 2723 O LYS B 60 9.295 1.523 11.132 1.00 0.00 O ATOM 2724 CB LYS B 60 8.432 -1.647 11.326 1.00 0.00 C ATOM 2725 CG LYS B 60 9.057 -1.180 12.643 1.00 0.00 C ATOM 2726 CD LYS B 60 9.024 -2.326 13.657 1.00 0.00 C ATOM 2727 CE LYS B 60 10.037 -2.051 14.771 1.00 0.00 C ATOM 2728 NZ LYS B 60 9.319 -1.594 15.994 1.00 0.00 N ATOM 0 H LYS B 60 8.218 -1.742 8.791 1.00 0.00 H new ATOM 0 HA LYS B 60 7.208 0.072 10.897 1.00 0.00 H new ATOM 0 HB2 LYS B 60 7.539 -2.239 11.525 1.00 0.00 H new ATOM 0 HB3 LYS B 60 9.128 -2.292 10.790 1.00 0.00 H new ATOM 0 HG2 LYS B 60 10.085 -0.857 12.476 1.00 0.00 H new ATOM 0 HG3 LYS B 60 8.512 -0.320 13.032 1.00 0.00 H new ATOM 0 HD2 LYS B 60 8.023 -2.425 14.077 1.00 0.00 H new ATOM 0 HD3 LYS B 60 9.257 -3.269 13.163 1.00 0.00 H new ATOM 0 HE2 LYS B 60 10.609 -2.953 14.988 1.00 0.00 H new ATOM 0 HE3 LYS B 60 10.750 -1.291 14.450 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 10.007 -1.407 16.751 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 8.792 -0.723 15.782 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 8.656 -2.333 16.304 1.00 0.00 H new ATOM 2742 N VAL B 61 10.236 0.250 9.611 1.00 0.00 N ATOM 2743 CA VAL B 61 11.420 1.144 9.521 1.00 0.00 C ATOM 2744 C VAL B 61 11.007 2.471 8.878 1.00 0.00 C ATOM 2745 O VAL B 61 11.046 3.510 9.503 1.00 0.00 O ATOM 2746 CB VAL B 61 12.493 0.459 8.668 1.00 0.00 C ATOM 2747 CG1 VAL B 61 13.539 1.481 8.224 1.00 0.00 C ATOM 2748 CG2 VAL B 61 13.171 -0.634 9.496 1.00 0.00 C ATOM 0 H VAL B 61 10.262 -0.566 8.999 1.00 0.00 H new ATOM 0 HA VAL B 61 11.818 1.342 10.516 1.00 0.00 H new ATOM 0 HB VAL B 61 12.026 0.021 7.786 1.00 0.00 H new ATOM 0 HG11 VAL B 61 14.298 0.985 7.618 1.00 0.00 H new ATOM 0 HG12 VAL B 61 13.058 2.262 7.635 1.00 0.00 H new ATOM 0 HG13 VAL B 61 14.009 1.926 9.101 1.00 0.00 H new ATOM 0 HG21 VAL B 61 13.936 -1.125 8.894 1.00 0.00 H new ATOM 0 HG22 VAL B 61 13.633 -0.189 10.377 1.00 0.00 H new ATOM 0 HG23 VAL B 61 12.428 -1.368 9.808 1.00 0.00 H new ATOM 2758 N LEU B 62 10.616 2.444 7.633 1.00 0.00 N ATOM 2759 CA LEU B 62 10.203 3.703 6.947 1.00 0.00 C ATOM 2760 C LEU B 62 9.186 4.453 7.815 1.00 0.00 C ATOM 2761 O LEU B 62 9.214 5.664 7.905 1.00 0.00 O ATOM 2762 CB LEU B 62 9.587 3.345 5.587 1.00 0.00 C ATOM 2763 CG LEU B 62 8.838 4.541 4.989 1.00 0.00 C ATOM 2764 CD1 LEU B 62 9.787 5.374 4.118 1.00 0.00 C ATOM 2765 CD2 LEU B 62 7.693 4.019 4.122 1.00 0.00 C ATOM 0 H LEU B 62 10.564 1.602 7.059 1.00 0.00 H new ATOM 0 HA LEU B 62 11.068 4.348 6.793 1.00 0.00 H new ATOM 0 HB2 LEU B 62 10.372 3.024 4.902 1.00 0.00 H new ATOM 0 HB3 LEU B 62 8.903 2.505 5.704 1.00 0.00 H new ATOM 0 HG LEU B 62 8.451 5.166 5.794 1.00 0.00 H new ATOM 0 HD11 LEU B 62 9.245 6.221 3.698 1.00 0.00 H new ATOM 0 HD12 LEU B 62 10.614 5.738 4.727 1.00 0.00 H new ATOM 0 HD13 LEU B 62 10.176 4.755 3.310 1.00 0.00 H new ATOM 0 HD21 LEU B 62 7.151 4.860 3.690 1.00 0.00 H new ATOM 0 HD22 LEU B 62 8.096 3.398 3.322 1.00 0.00 H new ATOM 0 HD23 LEU B 62 7.014 3.426 4.735 1.00 0.00 H new ATOM 2777 N ALA B 63 8.290 3.751 8.458 1.00 0.00 N ATOM 2778 CA ALA B 63 7.286 4.447 9.315 1.00 0.00 C ATOM 2779 C ALA B 63 8.008 5.462 10.207 1.00 0.00 C ATOM 2780 O ALA B 63 7.590 6.595 10.338 1.00 0.00 O ATOM 2781 CB ALA B 63 6.548 3.424 10.186 1.00 0.00 C ATOM 0 H ALA B 63 8.210 2.735 8.428 1.00 0.00 H new ATOM 0 HA ALA B 63 6.561 4.962 8.685 1.00 0.00 H new ATOM 0 HB1 ALA B 63 5.816 3.938 10.810 1.00 0.00 H new ATOM 0 HB2 ALA B 63 6.038 2.703 9.547 1.00 0.00 H new ATOM 0 HB3 ALA B 63 7.264 2.903 10.821 1.00 0.00 H new ATOM 2787 N LEU B 64 9.099 5.067 10.808 1.00 0.00 N ATOM 2788 CA LEU B 64 9.859 6.012 11.676 1.00 0.00 C ATOM 2789 C LEU B 64 10.592 7.014 10.790 1.00 0.00 C ATOM 2790 O LEU B 64 10.614 8.196 11.054 1.00 0.00 O ATOM 2791 CB LEU B 64 10.885 5.233 12.499 1.00 0.00 C ATOM 2792 CG LEU B 64 10.164 4.421 13.571 1.00 0.00 C ATOM 2793 CD1 LEU B 64 11.055 3.260 14.013 1.00 0.00 C ATOM 2794 CD2 LEU B 64 9.863 5.319 14.772 1.00 0.00 C ATOM 0 H LEU B 64 9.496 4.130 10.735 1.00 0.00 H new ATOM 0 HA LEU B 64 9.172 6.532 12.344 1.00 0.00 H new ATOM 0 HB2 LEU B 64 11.460 4.571 11.851 1.00 0.00 H new ATOM 0 HB3 LEU B 64 11.593 5.920 12.962 1.00 0.00 H new ATOM 0 HG LEU B 64 9.230 4.030 13.167 1.00 0.00 H new ATOM 0 HD11 LEU B 64 10.542 2.679 14.779 1.00 0.00 H new ATOM 0 HD12 LEU B 64 11.272 2.621 13.157 1.00 0.00 H new ATOM 0 HD13 LEU B 64 11.988 3.651 14.419 1.00 0.00 H new ATOM 0 HD21 LEU B 64 9.348 4.740 15.539 1.00 0.00 H new ATOM 0 HD22 LEU B 64 10.796 5.709 15.178 1.00 0.00 H new ATOM 0 HD23 LEU B 64 9.230 6.148 14.457 1.00 0.00 H new ATOM 2806 N TYR B 65 11.193 6.541 9.739 1.00 0.00 N ATOM 2807 CA TYR B 65 11.932 7.448 8.818 1.00 0.00 C ATOM 2808 C TYR B 65 11.115 8.722 8.583 1.00 0.00 C ATOM 2809 O TYR B 65 11.652 9.805 8.471 1.00 0.00 O ATOM 2810 CB TYR B 65 12.153 6.725 7.488 1.00 0.00 C ATOM 2811 CG TYR B 65 12.838 7.648 6.511 1.00 0.00 C ATOM 2812 CD1 TYR B 65 12.074 8.495 5.699 1.00 0.00 C ATOM 2813 CD2 TYR B 65 14.234 7.648 6.410 1.00 0.00 C ATOM 2814 CE1 TYR B 65 12.709 9.345 4.784 1.00 0.00 C ATOM 2815 CE2 TYR B 65 14.868 8.497 5.496 1.00 0.00 C ATOM 2816 CZ TYR B 65 14.105 9.345 4.683 1.00 0.00 C ATOM 2817 OH TYR B 65 14.730 10.183 3.782 1.00 0.00 O ATOM 0 H TYR B 65 11.205 5.556 9.474 1.00 0.00 H new ATOM 0 HA TYR B 65 12.892 7.719 9.257 1.00 0.00 H new ATOM 0 HB2 TYR B 65 12.759 5.833 7.645 1.00 0.00 H new ATOM 0 HB3 TYR B 65 11.198 6.394 7.081 1.00 0.00 H new ATOM 0 HD1 TYR B 65 10.997 8.493 5.778 1.00 0.00 H new ATOM 0 HD2 TYR B 65 14.821 6.993 7.037 1.00 0.00 H new ATOM 0 HE1 TYR B 65 12.122 10.000 4.157 1.00 0.00 H new ATOM 0 HE2 TYR B 65 15.945 8.498 5.417 1.00 0.00 H new ATOM 0 HH TYR B 65 15.701 10.060 3.839 1.00 0.00 H new ATOM 2827 N ASN B 66 9.819 8.596 8.511 1.00 0.00 N ATOM 2828 CA ASN B 66 8.956 9.790 8.287 1.00 0.00 C ATOM 2829 C ASN B 66 8.595 10.410 9.633 1.00 0.00 C ATOM 2830 O ASN B 66 8.698 11.603 9.835 1.00 0.00 O ATOM 2831 CB ASN B 66 7.671 9.345 7.607 1.00 0.00 C ATOM 2832 CG ASN B 66 7.137 10.470 6.719 1.00 0.00 C ATOM 2833 OD1 ASN B 66 7.669 10.725 5.657 1.00 0.00 O ATOM 2834 ND2 ASN B 66 6.100 11.157 7.112 1.00 0.00 N ATOM 0 H ASN B 66 9.318 7.712 8.598 1.00 0.00 H new ATOM 0 HA ASN B 66 9.486 10.515 7.669 1.00 0.00 H new ATOM 0 HB2 ASN B 66 7.856 8.453 7.008 1.00 0.00 H new ATOM 0 HB3 ASN B 66 6.926 9.077 8.356 1.00 0.00 H new ATOM 0 HD21 ASN B 66 5.735 11.909 6.527 1.00 0.00 H new ATOM 0 HD22 ASN B 66 5.654 10.942 8.004 1.00 0.00 H new ATOM 2841 N GLN B 67 8.169 9.592 10.553 1.00 0.00 N ATOM 2842 CA GLN B 67 7.787 10.094 11.904 1.00 0.00 C ATOM 2843 C GLN B 67 8.948 10.872 12.524 1.00 0.00 C ATOM 2844 O GLN B 67 8.791 11.563 13.511 1.00 0.00 O ATOM 2845 CB GLN B 67 7.445 8.900 12.796 1.00 0.00 C ATOM 2846 CG GLN B 67 5.953 8.584 12.680 1.00 0.00 C ATOM 2847 CD GLN B 67 5.189 9.310 13.789 1.00 0.00 C ATOM 2848 OE1 GLN B 67 5.099 10.521 13.788 1.00 0.00 O ATOM 2849 NE2 GLN B 67 4.630 8.614 14.742 1.00 0.00 N ATOM 0 H GLN B 67 8.068 8.585 10.426 1.00 0.00 H new ATOM 0 HA GLN B 67 6.926 10.756 11.814 1.00 0.00 H new ATOM 0 HB2 GLN B 67 8.035 8.032 12.501 1.00 0.00 H new ATOM 0 HB3 GLN B 67 7.701 9.122 13.832 1.00 0.00 H new ATOM 0 HG2 GLN B 67 5.580 8.894 11.704 1.00 0.00 H new ATOM 0 HG3 GLN B 67 5.791 7.509 12.756 1.00 0.00 H new ATOM 0 HE21 GLN B 67 4.706 7.597 14.742 1.00 0.00 H new ATOM 0 HE22 GLN B 67 4.117 9.088 15.486 1.00 0.00 H new ATOM 2858 N HIS B 68 10.112 10.760 11.957 1.00 0.00 N ATOM 2859 CA HIS B 68 11.290 11.486 12.513 1.00 0.00 C ATOM 2860 C HIS B 68 11.442 12.839 11.815 1.00 0.00 C ATOM 2861 O HIS B 68 11.675 13.850 12.448 1.00 0.00 O ATOM 2862 CB HIS B 68 12.554 10.654 12.291 1.00 0.00 C ATOM 2863 CG HIS B 68 12.775 9.751 13.472 1.00 0.00 C ATOM 2864 ND1 HIS B 68 12.216 8.485 13.554 1.00 0.00 N ATOM 2865 CD2 HIS B 68 13.495 9.917 14.627 1.00 0.00 C ATOM 2866 CE1 HIS B 68 12.605 7.944 14.723 1.00 0.00 C ATOM 2867 NE2 HIS B 68 13.388 8.775 15.416 1.00 0.00 N ATOM 0 H HIS B 68 10.303 10.196 11.129 1.00 0.00 H new ATOM 0 HA HIS B 68 11.141 11.647 13.581 1.00 0.00 H new ATOM 0 HB2 HIS B 68 12.457 10.062 11.381 1.00 0.00 H new ATOM 0 HB3 HIS B 68 13.414 11.309 12.155 1.00 0.00 H new ATOM 0 HD1 HIS B 68 11.618 8.044 12.855 1.00 0.00 H new ATOM 0 HD2 HIS B 68 14.060 10.800 14.886 1.00 0.00 H new ATOM 0 HE1 HIS B 68 12.319 6.958 15.060 1.00 0.00 H new ATOM 2875 N ASN B 69 11.318 12.868 10.517 1.00 0.00 N ATOM 2876 CA ASN B 69 11.463 14.159 9.787 1.00 0.00 C ATOM 2877 C ASN B 69 10.078 14.784 9.569 1.00 0.00 C ATOM 2878 O ASN B 69 9.187 14.135 9.059 1.00 0.00 O ATOM 2879 CB ASN B 69 12.123 13.904 8.430 1.00 0.00 C ATOM 2880 CG ASN B 69 13.580 13.485 8.641 1.00 0.00 C ATOM 2881 OD1 ASN B 69 13.921 12.922 9.662 1.00 0.00 O ATOM 2882 ND2 ASN B 69 14.460 13.737 7.711 1.00 0.00 N ATOM 0 H ASN B 69 11.123 12.056 9.931 1.00 0.00 H new ATOM 0 HA ASN B 69 12.081 14.839 10.373 1.00 0.00 H new ATOM 0 HB2 ASN B 69 11.584 13.124 7.892 1.00 0.00 H new ATOM 0 HB3 ASN B 69 12.078 14.804 7.817 1.00 0.00 H new ATOM 0 HD21 ASN B 69 15.433 13.461 7.842 1.00 0.00 H new ATOM 0 HD22 ASN B 69 14.175 14.210 6.853 1.00 0.00 H new ATOM 2889 N PRO B 70 9.937 16.029 9.959 1.00 0.00 N ATOM 2890 CA PRO B 70 8.668 16.763 9.813 1.00 0.00 C ATOM 2891 C PRO B 70 8.499 17.248 8.371 1.00 0.00 C ATOM 2892 O PRO B 70 9.119 18.205 7.951 1.00 0.00 O ATOM 2893 CB PRO B 70 8.826 17.948 10.770 1.00 0.00 C ATOM 2894 CG PRO B 70 10.348 18.146 10.970 1.00 0.00 C ATOM 2895 CD PRO B 70 11.021 16.816 10.581 1.00 0.00 C ATOM 0 HA PRO B 70 7.791 16.155 10.037 1.00 0.00 H new ATOM 0 HB2 PRO B 70 8.368 18.846 10.355 1.00 0.00 H new ATOM 0 HB3 PRO B 70 8.332 17.748 11.721 1.00 0.00 H new ATOM 0 HG2 PRO B 70 10.717 18.963 10.350 1.00 0.00 H new ATOM 0 HG3 PRO B 70 10.572 18.405 12.005 1.00 0.00 H new ATOM 0 HD2 PRO B 70 11.846 16.975 9.887 1.00 0.00 H new ATOM 0 HD3 PRO B 70 11.432 16.308 11.453 1.00 0.00 H new ATOM 2903 N GLY B 71 7.666 16.595 7.609 1.00 0.00 N ATOM 2904 CA GLY B 71 7.462 17.020 6.196 1.00 0.00 C ATOM 2905 C GLY B 71 7.966 15.925 5.253 1.00 0.00 C ATOM 2906 O GLY B 71 7.821 16.015 4.051 1.00 0.00 O ATOM 0 H GLY B 71 7.118 15.786 7.903 1.00 0.00 H new ATOM 0 HA2 GLY B 71 6.405 17.214 6.013 1.00 0.00 H new ATOM 0 HA3 GLY B 71 7.995 17.952 6.005 1.00 0.00 H new ATOM 2910 N ALA B 72 8.556 14.891 5.789 1.00 0.00 N ATOM 2911 CA ALA B 72 9.063 13.797 4.927 1.00 0.00 C ATOM 2912 C ALA B 72 7.903 13.203 4.140 1.00 0.00 C ATOM 2913 O ALA B 72 6.938 12.718 4.694 1.00 0.00 O ATOM 2914 CB ALA B 72 9.705 12.710 5.786 1.00 0.00 C ATOM 0 H ALA B 72 8.707 14.761 6.789 1.00 0.00 H new ATOM 0 HA ALA B 72 9.811 14.195 4.241 1.00 0.00 H new ATOM 0 HB1 ALA B 72 10.075 11.910 5.144 1.00 0.00 H new ATOM 0 HB2 ALA B 72 10.535 13.135 6.351 1.00 0.00 H new ATOM 0 HB3 ALA B 72 8.964 12.308 6.477 1.00 0.00 H new ATOM 2920 N SER B 73 7.998 13.248 2.852 1.00 0.00 N ATOM 2921 CA SER B 73 6.911 12.696 1.998 1.00 0.00 C ATOM 2922 C SER B 73 7.289 11.291 1.526 1.00 0.00 C ATOM 2923 O SER B 73 7.102 10.944 0.377 1.00 0.00 O ATOM 2924 CB SER B 73 6.706 13.604 0.786 1.00 0.00 C ATOM 2925 OG SER B 73 7.510 14.767 0.930 1.00 0.00 O ATOM 0 H SER B 73 8.787 13.646 2.343 1.00 0.00 H new ATOM 0 HA SER B 73 5.988 12.645 2.576 1.00 0.00 H new ATOM 0 HB2 SER B 73 6.972 13.075 -0.129 1.00 0.00 H new ATOM 0 HB3 SER B 73 5.656 13.882 0.699 1.00 0.00 H new ATOM 0 HG SER B 73 7.382 15.351 0.154 1.00 0.00 H new ATOM 2931 N ALA B 74 7.818 10.478 2.400 1.00 0.00 N ATOM 2932 CA ALA B 74 8.201 9.098 1.991 1.00 0.00 C ATOM 2933 C ALA B 74 7.636 8.090 2.994 1.00 0.00 C ATOM 2934 O ALA B 74 8.038 6.944 3.031 1.00 0.00 O ATOM 2935 CB ALA B 74 9.727 8.978 1.943 1.00 0.00 C ATOM 0 H ALA B 74 8.001 10.710 3.376 1.00 0.00 H new ATOM 0 HA ALA B 74 7.794 8.890 1.002 1.00 0.00 H new ATOM 0 HB1 ALA B 74 10.003 7.967 1.643 1.00 0.00 H new ATOM 0 HB2 ALA B 74 10.126 9.692 1.222 1.00 0.00 H new ATOM 0 HB3 ALA B 74 10.140 9.190 2.929 1.00 0.00 H new ATOM 2941 N ALA B 75 6.699 8.507 3.801 1.00 0.00 N ATOM 2942 CA ALA B 75 6.097 7.572 4.795 1.00 0.00 C ATOM 2943 C ALA B 75 5.614 6.316 4.060 1.00 0.00 C ATOM 2944 O ALA B 75 5.842 6.180 2.874 1.00 0.00 O ATOM 2945 CB ALA B 75 4.918 8.268 5.478 1.00 0.00 C ATOM 0 H ALA B 75 6.324 9.455 3.815 1.00 0.00 H new ATOM 0 HA ALA B 75 6.832 7.289 5.549 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.470 7.593 6.207 1.00 0.00 H new ATOM 0 HB2 ALA B 75 5.270 9.167 5.984 1.00 0.00 H new ATOM 0 HB3 ALA B 75 4.173 8.540 4.730 1.00 0.00 H new ATOM 2951 N PRO B 76 4.962 5.427 4.773 1.00 0.00 N ATOM 2952 CA PRO B 76 4.451 4.179 4.183 1.00 0.00 C ATOM 2953 C PRO B 76 3.173 4.460 3.396 1.00 0.00 C ATOM 2954 O PRO B 76 2.902 5.582 3.019 1.00 0.00 O ATOM 2955 CB PRO B 76 4.168 3.292 5.396 1.00 0.00 C ATOM 2956 CG PRO B 76 3.984 4.245 6.596 1.00 0.00 C ATOM 2957 CD PRO B 76 4.671 5.574 6.216 1.00 0.00 C ATOM 0 HA PRO B 76 5.146 3.714 3.484 1.00 0.00 H new ATOM 0 HB2 PRO B 76 3.273 2.690 5.237 1.00 0.00 H new ATOM 0 HB3 PRO B 76 4.991 2.600 5.572 1.00 0.00 H new ATOM 0 HG2 PRO B 76 2.926 4.402 6.807 1.00 0.00 H new ATOM 0 HG3 PRO B 76 4.429 3.823 7.497 1.00 0.00 H new ATOM 0 HD2 PRO B 76 4.021 6.428 6.407 1.00 0.00 H new ATOM 0 HD3 PRO B 76 5.582 5.731 6.793 1.00 0.00 H new ATOM 2965 N CYS B 77 2.387 3.453 3.137 1.00 0.00 N ATOM 2966 CA CYS B 77 1.137 3.686 2.367 1.00 0.00 C ATOM 2967 C CYS B 77 0.024 2.758 2.860 1.00 0.00 C ATOM 2968 O CYS B 77 -0.083 1.624 2.438 1.00 0.00 O ATOM 2969 CB CYS B 77 1.403 3.418 0.885 1.00 0.00 C ATOM 2970 SG CYS B 77 1.036 4.911 -0.068 1.00 0.00 S ATOM 0 H CYS B 77 2.554 2.488 3.422 1.00 0.00 H new ATOM 0 HA CYS B 77 0.820 4.719 2.509 1.00 0.00 H new ATOM 0 HB2 CYS B 77 2.442 3.125 0.738 1.00 0.00 H new ATOM 0 HB3 CYS B 77 0.786 2.590 0.537 1.00 0.00 H new ATOM 2975 N CYS B 78 -0.817 3.235 3.738 1.00 0.00 N ATOM 2976 CA CYS B 78 -1.937 2.384 4.235 1.00 0.00 C ATOM 2977 C CYS B 78 -2.720 1.859 3.023 1.00 0.00 C ATOM 2978 O CYS B 78 -2.985 2.589 2.088 1.00 0.00 O ATOM 2979 CB CYS B 78 -2.851 3.228 5.133 1.00 0.00 C ATOM 2980 SG CYS B 78 -4.298 2.256 5.630 1.00 0.00 S ATOM 0 H CYS B 78 -0.777 4.175 4.132 1.00 0.00 H new ATOM 0 HA CYS B 78 -1.554 1.544 4.815 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -2.303 3.558 6.016 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -3.170 4.125 4.602 1.00 0.00 H new ATOM 2985 N VAL B 79 -3.070 0.598 3.010 1.00 0.00 N ATOM 2986 CA VAL B 79 -3.805 0.042 1.838 1.00 0.00 C ATOM 2987 C VAL B 79 -4.900 -0.928 2.309 1.00 0.00 C ATOM 2988 O VAL B 79 -4.958 -1.267 3.468 1.00 0.00 O ATOM 2989 CB VAL B 79 -2.799 -0.680 0.928 1.00 0.00 C ATOM 2990 CG1 VAL B 79 -1.470 0.069 0.955 1.00 0.00 C ATOM 2991 CG2 VAL B 79 -2.568 -2.113 1.419 1.00 0.00 C ATOM 0 H VAL B 79 -2.879 -0.068 3.759 1.00 0.00 H new ATOM 0 HA VAL B 79 -4.287 0.848 1.284 1.00 0.00 H new ATOM 0 HB VAL B 79 -3.199 -0.708 -0.086 1.00 0.00 H new ATOM 0 HG11 VAL B 79 -0.753 -0.439 0.311 1.00 0.00 H new ATOM 0 HG12 VAL B 79 -1.619 1.088 0.598 1.00 0.00 H new ATOM 0 HG13 VAL B 79 -1.087 0.094 1.975 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -1.853 -2.611 0.764 1.00 0.00 H new ATOM 0 HG22 VAL B 79 -2.175 -2.090 2.435 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -3.512 -2.658 1.407 1.00 0.00 H new ATOM 3001 N PRO B 80 -5.739 -1.345 1.389 1.00 0.00 N ATOM 3002 CA PRO B 80 -6.847 -2.273 1.687 1.00 0.00 C ATOM 3003 C PRO B 80 -6.328 -3.706 1.832 1.00 0.00 C ATOM 3004 O PRO B 80 -6.071 -4.387 0.859 1.00 0.00 O ATOM 3005 CB PRO B 80 -7.765 -2.140 0.469 1.00 0.00 C ATOM 3006 CG PRO B 80 -6.890 -1.597 -0.681 1.00 0.00 C ATOM 3007 CD PRO B 80 -5.659 -0.940 -0.029 1.00 0.00 C ATOM 0 HA PRO B 80 -7.356 -2.044 2.624 1.00 0.00 H new ATOM 0 HB2 PRO B 80 -8.200 -3.104 0.204 1.00 0.00 H new ATOM 0 HB3 PRO B 80 -8.593 -1.463 0.679 1.00 0.00 H new ATOM 0 HG2 PRO B 80 -6.589 -2.402 -1.352 1.00 0.00 H new ATOM 0 HG3 PRO B 80 -7.443 -0.873 -1.280 1.00 0.00 H new ATOM 0 HD2 PRO B 80 -4.733 -1.284 -0.490 1.00 0.00 H new ATOM 0 HD3 PRO B 80 -5.684 0.145 -0.135 1.00 0.00 H new ATOM 3015 N GLN B 81 -6.174 -4.170 3.043 1.00 0.00 N ATOM 3016 CA GLN B 81 -5.676 -5.556 3.255 1.00 0.00 C ATOM 3017 C GLN B 81 -6.765 -6.550 2.849 1.00 0.00 C ATOM 3018 O GLN B 81 -6.595 -7.332 1.934 1.00 0.00 O ATOM 3019 CB GLN B 81 -5.333 -5.748 4.733 1.00 0.00 C ATOM 3020 CG GLN B 81 -4.462 -6.992 4.896 1.00 0.00 C ATOM 3021 CD GLN B 81 -4.172 -7.225 6.380 1.00 0.00 C ATOM 3022 OE1 GLN B 81 -3.371 -6.529 6.970 1.00 0.00 O ATOM 3023 NE2 GLN B 81 -4.796 -8.181 7.013 1.00 0.00 N ATOM 0 H GLN B 81 -6.373 -3.646 3.895 1.00 0.00 H new ATOM 0 HA GLN B 81 -4.785 -5.725 2.650 1.00 0.00 H new ATOM 0 HB2 GLN B 81 -4.808 -4.871 5.112 1.00 0.00 H new ATOM 0 HB3 GLN B 81 -6.246 -5.851 5.319 1.00 0.00 H new ATOM 0 HG2 GLN B 81 -4.968 -7.860 4.473 1.00 0.00 H new ATOM 0 HG3 GLN B 81 -3.528 -6.869 4.348 1.00 0.00 H new ATOM 0 HE21 GLN B 81 -5.469 -8.766 6.518 1.00 0.00 H new ATOM 0 HE22 GLN B 81 -4.611 -8.343 8.003 1.00 0.00 H new ATOM 3032 N ALA B 82 -7.885 -6.522 3.518 1.00 0.00 N ATOM 3033 CA ALA B 82 -8.985 -7.459 3.164 1.00 0.00 C ATOM 3034 C ALA B 82 -9.972 -6.741 2.244 1.00 0.00 C ATOM 3035 O ALA B 82 -10.074 -5.531 2.256 1.00 0.00 O ATOM 3036 CB ALA B 82 -9.705 -7.908 4.437 1.00 0.00 C ATOM 0 H ALA B 82 -8.085 -5.891 4.294 1.00 0.00 H new ATOM 0 HA ALA B 82 -8.576 -8.333 2.657 1.00 0.00 H new ATOM 0 HB1 ALA B 82 -10.511 -8.594 4.176 1.00 0.00 H new ATOM 0 HB2 ALA B 82 -8.998 -8.412 5.096 1.00 0.00 H new ATOM 0 HB3 ALA B 82 -10.120 -7.038 4.946 1.00 0.00 H new ATOM 3042 N LEU B 83 -10.696 -7.470 1.442 1.00 0.00 N ATOM 3043 CA LEU B 83 -11.665 -6.814 0.524 1.00 0.00 C ATOM 3044 C LEU B 83 -12.981 -7.581 0.522 1.00 0.00 C ATOM 3045 O LEU B 83 -13.227 -8.437 1.348 1.00 0.00 O ATOM 3046 CB LEU B 83 -11.100 -6.803 -0.897 1.00 0.00 C ATOM 3047 CG LEU B 83 -9.824 -5.972 -0.928 1.00 0.00 C ATOM 3048 CD1 LEU B 83 -8.877 -6.524 -1.996 1.00 0.00 C ATOM 3049 CD2 LEU B 83 -10.176 -4.525 -1.264 1.00 0.00 C ATOM 0 H LEU B 83 -10.659 -8.488 1.383 1.00 0.00 H new ATOM 0 HA LEU B 83 -11.836 -5.793 0.865 1.00 0.00 H new ATOM 0 HB2 LEU B 83 -10.892 -7.821 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU B 83 -11.834 -6.389 -1.589 1.00 0.00 H new ATOM 0 HG LEU B 83 -9.336 -6.017 0.046 1.00 0.00 H new ATOM 0 HD11 LEU B 83 -7.965 -5.928 -2.016 1.00 0.00 H new ATOM 0 HD12 LEU B 83 -8.629 -7.559 -1.762 1.00 0.00 H new ATOM 0 HD13 LEU B 83 -9.362 -6.478 -2.971 1.00 0.00 H new ATOM 0 HD21 LEU B 83 -9.266 -3.925 -1.288 1.00 0.00 H new ATOM 0 HD22 LEU B 83 -10.662 -4.486 -2.239 1.00 0.00 H new ATOM 0 HD23 LEU B 83 -10.852 -4.129 -0.506 1.00 0.00 H new ATOM 3061 N GLU B 84 -13.819 -7.274 -0.419 1.00 0.00 N ATOM 3062 CA GLU B 84 -15.130 -7.968 -0.525 1.00 0.00 C ATOM 3063 C GLU B 84 -15.549 -7.982 -1.995 1.00 0.00 C ATOM 3064 O GLU B 84 -15.038 -7.218 -2.786 1.00 0.00 O ATOM 3065 CB GLU B 84 -16.176 -7.220 0.303 1.00 0.00 C ATOM 3066 CG GLU B 84 -16.189 -7.771 1.730 1.00 0.00 C ATOM 3067 CD GLU B 84 -17.473 -7.333 2.437 1.00 0.00 C ATOM 3068 OE1 GLU B 84 -18.478 -8.004 2.266 1.00 0.00 O ATOM 3069 OE2 GLU B 84 -17.430 -6.335 3.137 1.00 0.00 O ATOM 0 H GLU B 84 -13.652 -6.562 -1.130 1.00 0.00 H new ATOM 0 HA GLU B 84 -15.048 -8.988 -0.149 1.00 0.00 H new ATOM 0 HB2 GLU B 84 -15.950 -6.154 0.316 1.00 0.00 H new ATOM 0 HB3 GLU B 84 -17.161 -7.332 -0.150 1.00 0.00 H new ATOM 0 HG2 GLU B 84 -16.125 -8.859 1.711 1.00 0.00 H new ATOM 0 HG3 GLU B 84 -15.319 -7.410 2.278 1.00 0.00 H new ATOM 3076 N PRO B 85 -16.465 -8.853 -2.318 1.00 0.00 N ATOM 3077 CA PRO B 85 -16.967 -8.988 -3.693 1.00 0.00 C ATOM 3078 C PRO B 85 -17.916 -7.836 -4.037 1.00 0.00 C ATOM 3079 O PRO B 85 -17.930 -6.816 -3.378 1.00 0.00 O ATOM 3080 CB PRO B 85 -17.689 -10.337 -3.683 1.00 0.00 C ATOM 3081 CG PRO B 85 -18.034 -10.634 -2.206 1.00 0.00 C ATOM 3082 CD PRO B 85 -17.086 -9.775 -1.349 1.00 0.00 C ATOM 0 HA PRO B 85 -16.180 -8.948 -4.446 1.00 0.00 H new ATOM 0 HB2 PRO B 85 -18.592 -10.299 -4.293 1.00 0.00 H new ATOM 0 HB3 PRO B 85 -17.055 -11.120 -4.099 1.00 0.00 H new ATOM 0 HG2 PRO B 85 -19.075 -10.389 -1.995 1.00 0.00 H new ATOM 0 HG3 PRO B 85 -17.904 -11.693 -1.984 1.00 0.00 H new ATOM 0 HD2 PRO B 85 -17.629 -9.233 -0.574 1.00 0.00 H new ATOM 0 HD3 PRO B 85 -16.338 -10.388 -0.845 1.00 0.00 H new ATOM 3090 N LEU B 86 -18.688 -7.979 -5.078 1.00 0.00 N ATOM 3091 CA LEU B 86 -19.609 -6.878 -5.479 1.00 0.00 C ATOM 3092 C LEU B 86 -20.652 -7.413 -6.476 1.00 0.00 C ATOM 3093 O LEU B 86 -20.324 -7.727 -7.598 1.00 0.00 O ATOM 3094 CB LEU B 86 -18.752 -5.755 -6.099 1.00 0.00 C ATOM 3095 CG LEU B 86 -19.488 -5.035 -7.236 1.00 0.00 C ATOM 3096 CD1 LEU B 86 -20.656 -4.216 -6.695 1.00 0.00 C ATOM 3097 CD2 LEU B 86 -18.514 -4.102 -7.955 1.00 0.00 C ATOM 0 H LEU B 86 -18.721 -8.810 -5.668 1.00 0.00 H new ATOM 0 HA LEU B 86 -20.154 -6.484 -4.621 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -18.484 -5.034 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -17.821 -6.176 -6.479 1.00 0.00 H new ATOM 0 HG LEU B 86 -19.876 -5.784 -7.927 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -21.162 -3.715 -7.520 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -21.358 -4.876 -6.186 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -20.283 -3.471 -5.992 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -19.033 -3.588 -8.764 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -18.125 -3.368 -7.249 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -17.688 -4.684 -8.365 1.00 0.00 H new ATOM 3109 N PRO B 87 -21.886 -7.496 -6.036 1.00 0.00 N ATOM 3110 CA PRO B 87 -22.994 -7.982 -6.878 1.00 0.00 C ATOM 3111 C PRO B 87 -23.403 -6.888 -7.863 1.00 0.00 C ATOM 3112 O PRO B 87 -23.901 -5.849 -7.480 1.00 0.00 O ATOM 3113 CB PRO B 87 -24.114 -8.272 -5.873 1.00 0.00 C ATOM 3114 CG PRO B 87 -23.798 -7.428 -4.617 1.00 0.00 C ATOM 3115 CD PRO B 87 -22.292 -7.111 -4.668 1.00 0.00 C ATOM 0 HA PRO B 87 -22.741 -8.859 -7.474 1.00 0.00 H new ATOM 0 HB2 PRO B 87 -25.086 -8.005 -6.287 1.00 0.00 H new ATOM 0 HB3 PRO B 87 -24.152 -9.334 -5.629 1.00 0.00 H new ATOM 0 HG2 PRO B 87 -24.387 -6.511 -4.608 1.00 0.00 H new ATOM 0 HG3 PRO B 87 -24.048 -7.976 -3.709 1.00 0.00 H new ATOM 0 HD2 PRO B 87 -22.101 -6.055 -4.478 1.00 0.00 H new ATOM 0 HD3 PRO B 87 -21.741 -7.675 -3.916 1.00 0.00 H new ATOM 3123 N ILE B 88 -23.177 -7.103 -9.128 1.00 0.00 N ATOM 3124 CA ILE B 88 -23.532 -6.060 -10.125 1.00 0.00 C ATOM 3125 C ILE B 88 -24.431 -6.639 -11.211 1.00 0.00 C ATOM 3126 O ILE B 88 -25.037 -7.679 -11.060 1.00 0.00 O ATOM 3127 CB ILE B 88 -22.252 -5.537 -10.784 1.00 0.00 C ATOM 3128 CG1 ILE B 88 -21.754 -6.551 -11.818 1.00 0.00 C ATOM 3129 CG2 ILE B 88 -21.177 -5.348 -9.723 1.00 0.00 C ATOM 3130 CD1 ILE B 88 -20.363 -6.154 -12.295 1.00 0.00 C ATOM 0 H ILE B 88 -22.764 -7.953 -9.512 1.00 0.00 H new ATOM 0 HA ILE B 88 -24.059 -5.255 -9.612 1.00 0.00 H new ATOM 0 HB ILE B 88 -22.464 -4.586 -11.273 1.00 0.00 H new ATOM 0 HG12 ILE B 88 -21.728 -7.549 -11.380 1.00 0.00 H new ATOM 0 HG13 ILE B 88 -22.441 -6.591 -12.663 1.00 0.00 H new ATOM 0 HG21 ILE B 88 -20.266 -4.976 -10.191 1.00 0.00 H new ATOM 0 HG22 ILE B 88 -21.522 -4.630 -8.979 1.00 0.00 H new ATOM 0 HG23 ILE B 88 -20.972 -6.303 -9.238 1.00 0.00 H new ATOM 0 HD11 ILE B 88 -20.011 -6.877 -13.031 1.00 0.00 H new ATOM 0 HD12 ILE B 88 -20.403 -5.164 -12.749 1.00 0.00 H new ATOM 0 HD13 ILE B 88 -19.679 -6.137 -11.447 1.00 0.00 H new ATOM 3142 N VAL B 89 -24.475 -5.959 -12.319 1.00 0.00 N ATOM 3143 CA VAL B 89 -25.284 -6.412 -13.477 1.00 0.00 C ATOM 3144 C VAL B 89 -24.813 -5.642 -14.706 1.00 0.00 C ATOM 3145 O VAL B 89 -25.010 -4.449 -14.810 1.00 0.00 O ATOM 3146 CB VAL B 89 -26.768 -6.114 -13.254 1.00 0.00 C ATOM 3147 CG1 VAL B 89 -27.584 -6.845 -14.319 1.00 0.00 C ATOM 3148 CG2 VAL B 89 -27.204 -6.584 -11.865 1.00 0.00 C ATOM 0 H VAL B 89 -23.970 -5.086 -12.472 1.00 0.00 H new ATOM 0 HA VAL B 89 -25.160 -7.487 -13.606 1.00 0.00 H new ATOM 0 HB VAL B 89 -26.933 -5.039 -13.325 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -28.644 -6.640 -14.170 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -27.283 -6.500 -15.308 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -27.408 -7.918 -14.240 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -28.262 -6.365 -11.722 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -27.041 -7.658 -11.777 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -26.620 -6.065 -11.105 1.00 0.00 H new ATOM 3158 N TYR B 90 -24.186 -6.301 -15.635 1.00 0.00 N ATOM 3159 CA TYR B 90 -23.701 -5.579 -16.839 1.00 0.00 C ATOM 3160 C TYR B 90 -24.315 -6.183 -18.099 1.00 0.00 C ATOM 3161 O TYR B 90 -25.192 -7.019 -18.038 1.00 0.00 O ATOM 3162 CB TYR B 90 -22.178 -5.672 -16.911 1.00 0.00 C ATOM 3163 CG TYR B 90 -21.721 -7.035 -16.452 1.00 0.00 C ATOM 3164 CD1 TYR B 90 -21.569 -7.294 -15.087 1.00 0.00 C ATOM 3165 CD2 TYR B 90 -21.438 -8.033 -17.389 1.00 0.00 C ATOM 3166 CE1 TYR B 90 -21.135 -8.552 -14.654 1.00 0.00 C ATOM 3167 CE2 TYR B 90 -21.005 -9.293 -16.958 1.00 0.00 C ATOM 3168 CZ TYR B 90 -20.853 -9.553 -15.591 1.00 0.00 C ATOM 3169 OH TYR B 90 -20.425 -10.794 -15.168 1.00 0.00 O ATOM 0 H TYR B 90 -23.989 -7.302 -15.614 1.00 0.00 H new ATOM 0 HA TYR B 90 -23.999 -4.533 -16.770 1.00 0.00 H new ATOM 0 HB2 TYR B 90 -21.842 -5.492 -17.932 1.00 0.00 H new ATOM 0 HB3 TYR B 90 -21.729 -4.900 -16.287 1.00 0.00 H new ATOM 0 HD1 TYR B 90 -21.787 -6.521 -14.365 1.00 0.00 H new ATOM 0 HD2 TYR B 90 -21.553 -7.833 -18.444 1.00 0.00 H new ATOM 0 HE1 TYR B 90 -21.018 -8.750 -13.599 1.00 0.00 H new ATOM 0 HE2 TYR B 90 -20.788 -10.065 -17.681 1.00 0.00 H new ATOM 0 HH TYR B 90 -20.275 -11.371 -15.946 1.00 0.00 H new ATOM 3179 N TYR B 91 -23.870 -5.748 -19.244 1.00 0.00 N ATOM 3180 CA TYR B 91 -24.435 -6.277 -20.512 1.00 0.00 C ATOM 3181 C TYR B 91 -23.322 -6.775 -21.430 1.00 0.00 C ATOM 3182 O TYR B 91 -22.358 -6.082 -21.693 1.00 0.00 O ATOM 3183 CB TYR B 91 -25.186 -5.160 -21.227 1.00 0.00 C ATOM 3184 CG TYR B 91 -26.632 -5.177 -20.820 1.00 0.00 C ATOM 3185 CD1 TYR B 91 -27.553 -5.941 -21.544 1.00 0.00 C ATOM 3186 CD2 TYR B 91 -27.055 -4.416 -19.728 1.00 0.00 C ATOM 3187 CE1 TYR B 91 -28.900 -5.945 -21.177 1.00 0.00 C ATOM 3188 CE2 TYR B 91 -28.405 -4.420 -19.354 1.00 0.00 C ATOM 3189 CZ TYR B 91 -29.329 -5.184 -20.081 1.00 0.00 C ATOM 3190 OH TYR B 91 -30.660 -5.186 -19.717 1.00 0.00 O ATOM 0 H TYR B 91 -23.137 -5.047 -19.355 1.00 0.00 H new ATOM 0 HA TYR B 91 -25.104 -7.105 -20.277 1.00 0.00 H new ATOM 0 HB2 TYR B 91 -24.741 -4.196 -20.982 1.00 0.00 H new ATOM 0 HB3 TYR B 91 -25.101 -5.285 -22.306 1.00 0.00 H new ATOM 0 HD1 TYR B 91 -27.222 -6.528 -22.388 1.00 0.00 H new ATOM 0 HD2 TYR B 91 -26.342 -3.825 -19.172 1.00 0.00 H new ATOM 0 HE1 TYR B 91 -29.611 -6.534 -21.737 1.00 0.00 H new ATOM 0 HE2 TYR B 91 -28.733 -3.836 -18.507 1.00 0.00 H new ATOM 0 HH TYR B 91 -30.787 -4.607 -18.936 1.00 0.00 H new ATOM 3200 N VAL B 92 -23.473 -7.955 -21.953 1.00 0.00 N ATOM 3201 CA VAL B 92 -22.459 -8.493 -22.895 1.00 0.00 C ATOM 3202 C VAL B 92 -23.081 -8.484 -24.284 1.00 0.00 C ATOM 3203 O VAL B 92 -23.773 -9.404 -24.673 1.00 0.00 O ATOM 3204 CB VAL B 92 -22.082 -9.921 -22.516 1.00 0.00 C ATOM 3205 CG1 VAL B 92 -20.635 -10.177 -22.932 1.00 0.00 C ATOM 3206 CG2 VAL B 92 -22.225 -10.107 -21.003 1.00 0.00 C ATOM 0 H VAL B 92 -24.261 -8.575 -21.767 1.00 0.00 H new ATOM 0 HA VAL B 92 -21.555 -7.885 -22.863 1.00 0.00 H new ATOM 0 HB VAL B 92 -22.742 -10.625 -23.024 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -20.355 -11.196 -22.665 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -20.537 -10.044 -24.009 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -19.979 -9.474 -22.418 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -21.955 -11.128 -20.735 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -21.565 -9.410 -20.487 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -23.257 -9.915 -20.709 1.00 0.00 H new ATOM 3216 N GLY B 93 -22.872 -7.437 -25.022 1.00 0.00 N ATOM 3217 CA GLY B 93 -23.488 -7.349 -26.372 1.00 0.00 C ATOM 3218 C GLY B 93 -24.974 -7.023 -26.199 1.00 0.00 C ATOM 3219 O GLY B 93 -25.387 -5.884 -26.303 1.00 0.00 O ATOM 0 H GLY B 93 -22.301 -6.636 -24.751 1.00 0.00 H new ATOM 0 HA2 GLY B 93 -22.996 -6.578 -26.965 1.00 0.00 H new ATOM 0 HA3 GLY B 93 -23.365 -8.290 -26.908 1.00 0.00 H new ATOM 3223 N ARG B 94 -25.781 -8.015 -25.932 1.00 0.00 N ATOM 3224 CA ARG B 94 -27.243 -7.766 -25.748 1.00 0.00 C ATOM 3225 C ARG B 94 -27.805 -8.640 -24.618 1.00 0.00 C ATOM 3226 O ARG B 94 -28.965 -8.544 -24.272 1.00 0.00 O ATOM 3227 CB ARG B 94 -27.963 -8.113 -27.042 1.00 0.00 C ATOM 3228 CG ARG B 94 -27.464 -7.201 -28.165 1.00 0.00 C ATOM 3229 CD ARG B 94 -28.657 -6.509 -28.823 1.00 0.00 C ATOM 3230 NE ARG B 94 -28.328 -5.077 -29.076 1.00 0.00 N ATOM 3231 CZ ARG B 94 -27.533 -4.750 -30.057 1.00 0.00 C ATOM 3232 NH1 ARG B 94 -26.298 -5.170 -30.063 1.00 0.00 N ATOM 3233 NH2 ARG B 94 -27.972 -3.999 -31.030 1.00 0.00 N ATOM 0 H ARG B 94 -25.492 -8.988 -25.833 1.00 0.00 H new ATOM 0 HA ARG B 94 -27.394 -6.718 -25.489 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -27.785 -9.157 -27.301 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -29.039 -7.995 -26.915 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -26.773 -6.458 -27.766 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -26.914 -7.783 -28.904 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -28.907 -7.006 -29.760 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -29.534 -6.583 -28.179 1.00 0.00 H new ATOM 0 HE ARG B 94 -28.726 -4.351 -28.480 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -25.954 -5.754 -29.301 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -25.676 -4.914 -30.830 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -28.937 -3.668 -31.023 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -27.350 -3.743 -31.797 1.00 0.00 H new ATOM 3247 N LYS B 95 -27.003 -9.492 -24.045 1.00 0.00 N ATOM 3248 CA LYS B 95 -27.509 -10.366 -22.948 1.00 0.00 C ATOM 3249 C LYS B 95 -27.002 -9.842 -21.599 1.00 0.00 C ATOM 3250 O LYS B 95 -25.811 -9.790 -21.375 1.00 0.00 O ATOM 3251 CB LYS B 95 -26.995 -11.791 -23.160 1.00 0.00 C ATOM 3252 CG LYS B 95 -28.179 -12.737 -23.362 1.00 0.00 C ATOM 3253 CD LYS B 95 -27.760 -14.164 -23.003 1.00 0.00 C ATOM 3254 CE LYS B 95 -28.972 -14.935 -22.477 1.00 0.00 C ATOM 3255 NZ LYS B 95 -30.177 -14.568 -23.273 1.00 0.00 N ATOM 0 H LYS B 95 -26.021 -9.622 -24.287 1.00 0.00 H new ATOM 0 HA LYS B 95 -28.599 -10.362 -22.954 1.00 0.00 H new ATOM 0 HB2 LYS B 95 -26.336 -11.826 -24.028 1.00 0.00 H new ATOM 0 HB3 LYS B 95 -26.406 -12.108 -22.300 1.00 0.00 H new ATOM 0 HG2 LYS B 95 -29.017 -12.425 -22.739 1.00 0.00 H new ATOM 0 HG3 LYS B 95 -28.518 -12.696 -24.397 1.00 0.00 H new ATOM 0 HD2 LYS B 95 -27.349 -14.665 -23.880 1.00 0.00 H new ATOM 0 HD3 LYS B 95 -26.973 -14.144 -22.249 1.00 0.00 H new ATOM 0 HE2 LYS B 95 -28.791 -16.008 -22.544 1.00 0.00 H new ATOM 0 HE3 LYS B 95 -29.134 -14.704 -21.424 1.00 0.00 H new ATOM 0 HZ1 LYS B 95 -30.862 -15.350 -23.246 1.00 0.00 H new ATOM 0 HZ2 LYS B 95 -30.611 -13.713 -22.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 95 -29.900 -14.385 -24.259 1.00 0.00 H new ATOM 3269 N PRO B 96 -27.915 -9.471 -20.737 1.00 0.00 N ATOM 3270 CA PRO B 96 -27.570 -8.947 -19.404 1.00 0.00 C ATOM 3271 C PRO B 96 -27.138 -10.092 -18.480 1.00 0.00 C ATOM 3272 O PRO B 96 -27.729 -11.154 -18.477 1.00 0.00 O ATOM 3273 CB PRO B 96 -28.872 -8.308 -18.918 1.00 0.00 C ATOM 3274 CG PRO B 96 -30.012 -8.973 -19.724 1.00 0.00 C ATOM 3275 CD PRO B 96 -29.367 -9.545 -21.001 1.00 0.00 C ATOM 0 HA PRO B 96 -26.740 -8.240 -19.420 1.00 0.00 H new ATOM 0 HB2 PRO B 96 -29.008 -8.468 -17.848 1.00 0.00 H new ATOM 0 HB3 PRO B 96 -28.860 -7.230 -19.080 1.00 0.00 H new ATOM 0 HG2 PRO B 96 -30.489 -9.762 -19.143 1.00 0.00 H new ATOM 0 HG3 PRO B 96 -30.787 -8.247 -19.972 1.00 0.00 H new ATOM 0 HD2 PRO B 96 -29.687 -10.571 -21.184 1.00 0.00 H new ATOM 0 HD3 PRO B 96 -29.642 -8.964 -21.881 1.00 0.00 H new ATOM 3283 N LYS B 97 -26.110 -9.890 -17.700 1.00 0.00 N ATOM 3284 CA LYS B 97 -25.645 -10.974 -16.788 1.00 0.00 C ATOM 3285 C LYS B 97 -25.221 -10.379 -15.443 1.00 0.00 C ATOM 3286 O LYS B 97 -24.396 -9.490 -15.377 1.00 0.00 O ATOM 3287 CB LYS B 97 -24.448 -11.690 -17.420 1.00 0.00 C ATOM 3288 CG LYS B 97 -24.802 -12.123 -18.845 1.00 0.00 C ATOM 3289 CD LYS B 97 -24.478 -13.608 -19.024 1.00 0.00 C ATOM 3290 CE LYS B 97 -24.970 -14.074 -20.395 1.00 0.00 C ATOM 3291 NZ LYS B 97 -25.348 -15.514 -20.323 1.00 0.00 N ATOM 0 H LYS B 97 -25.574 -9.024 -17.655 1.00 0.00 H new ATOM 0 HA LYS B 97 -26.459 -11.681 -16.629 1.00 0.00 H new ATOM 0 HB2 LYS B 97 -23.582 -11.028 -17.435 1.00 0.00 H new ATOM 0 HB3 LYS B 97 -24.175 -12.560 -16.822 1.00 0.00 H new ATOM 0 HG2 LYS B 97 -25.860 -11.945 -19.038 1.00 0.00 H new ATOM 0 HG3 LYS B 97 -24.242 -11.528 -19.567 1.00 0.00 H new ATOM 0 HD2 LYS B 97 -23.404 -13.770 -18.937 1.00 0.00 H new ATOM 0 HD3 LYS B 97 -24.954 -14.193 -18.237 1.00 0.00 H new ATOM 0 HE2 LYS B 97 -25.827 -13.477 -20.708 1.00 0.00 H new ATOM 0 HE3 LYS B 97 -24.190 -13.928 -21.142 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 -25.683 -15.832 -21.255 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 -24.520 -16.077 -20.042 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 -26.106 -15.639 -19.622 1.00 0.00 H new ATOM 3305 N VAL B 98 -25.773 -10.873 -14.366 1.00 0.00 N ATOM 3306 CA VAL B 98 -25.393 -10.347 -13.023 1.00 0.00 C ATOM 3307 C VAL B 98 -24.228 -11.172 -12.480 1.00 0.00 C ATOM 3308 O VAL B 98 -24.203 -12.380 -12.607 1.00 0.00 O ATOM 3309 CB VAL B 98 -26.582 -10.472 -12.069 1.00 0.00 C ATOM 3310 CG1 VAL B 98 -26.184 -9.951 -10.686 1.00 0.00 C ATOM 3311 CG2 VAL B 98 -27.756 -9.651 -12.606 1.00 0.00 C ATOM 0 H VAL B 98 -26.470 -11.618 -14.359 1.00 0.00 H new ATOM 0 HA VAL B 98 -25.103 -9.300 -13.108 1.00 0.00 H new ATOM 0 HB VAL B 98 -26.877 -11.519 -11.991 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -27.031 -10.040 -10.006 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -25.348 -10.537 -10.303 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -25.889 -8.905 -10.763 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -28.603 -9.740 -11.926 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -27.462 -8.604 -12.685 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -28.040 -10.023 -13.590 1.00 0.00 H new ATOM 3321 N GLU B 99 -23.257 -10.541 -11.878 1.00 0.00 N ATOM 3322 CA GLU B 99 -22.109 -11.317 -11.340 1.00 0.00 C ATOM 3323 C GLU B 99 -21.760 -10.822 -9.941 1.00 0.00 C ATOM 3324 O GLU B 99 -22.564 -10.223 -9.256 1.00 0.00 O ATOM 3325 CB GLU B 99 -20.896 -11.135 -12.247 1.00 0.00 C ATOM 3326 CG GLU B 99 -20.385 -12.503 -12.703 1.00 0.00 C ATOM 3327 CD GLU B 99 -18.856 -12.508 -12.690 1.00 0.00 C ATOM 3328 OE1 GLU B 99 -18.285 -11.522 -12.253 1.00 0.00 O ATOM 3329 OE2 GLU B 99 -18.283 -13.497 -13.115 1.00 0.00 O ATOM 0 H GLU B 99 -23.210 -9.532 -11.737 1.00 0.00 H new ATOM 0 HA GLU B 99 -22.384 -12.371 -11.298 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -21.164 -10.529 -13.112 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -20.109 -10.600 -11.715 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -20.767 -13.283 -12.045 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -20.751 -12.724 -13.706 1.00 0.00 H new ATOM 3336 N GLN B 100 -20.557 -11.074 -9.521 1.00 0.00 N ATOM 3337 CA GLN B 100 -20.122 -10.631 -8.172 1.00 0.00 C ATOM 3338 C GLN B 100 -18.634 -10.303 -8.221 1.00 0.00 C ATOM 3339 O GLN B 100 -17.798 -11.117 -7.881 1.00 0.00 O ATOM 3340 CB GLN B 100 -20.351 -11.757 -7.174 1.00 0.00 C ATOM 3341 CG GLN B 100 -21.808 -12.218 -7.242 1.00 0.00 C ATOM 3342 CD GLN B 100 -22.189 -12.902 -5.928 1.00 0.00 C ATOM 3343 OE1 GLN B 100 -21.573 -12.668 -4.907 1.00 0.00 O ATOM 3344 NE2 GLN B 100 -23.187 -13.743 -5.910 1.00 0.00 N ATOM 0 H GLN B 100 -19.849 -11.573 -10.060 1.00 0.00 H new ATOM 0 HA GLN B 100 -20.691 -9.752 -7.868 1.00 0.00 H new ATOM 0 HB2 GLN B 100 -19.685 -12.591 -7.393 1.00 0.00 H new ATOM 0 HB3 GLN B 100 -20.114 -11.416 -6.166 1.00 0.00 H new ATOM 0 HG2 GLN B 100 -22.462 -11.365 -7.423 1.00 0.00 H new ATOM 0 HG3 GLN B 100 -21.944 -12.907 -8.076 1.00 0.00 H new ATOM 0 HE21 GLN B 100 -23.704 -13.939 -6.767 1.00 0.00 H new ATOM 0 HE22 GLN B 100 -23.450 -14.204 -5.039 1.00 0.00 H new ATOM 3353 N LEU B 101 -18.295 -9.126 -8.655 1.00 0.00 N ATOM 3354 CA LEU B 101 -16.860 -8.753 -8.738 1.00 0.00 C ATOM 3355 C LEU B 101 -16.149 -9.197 -7.467 1.00 0.00 C ATOM 3356 O LEU B 101 -16.715 -9.203 -6.391 1.00 0.00 O ATOM 3357 CB LEU B 101 -16.718 -7.242 -8.915 1.00 0.00 C ATOM 3358 CG LEU B 101 -17.524 -6.781 -10.134 1.00 0.00 C ATOM 3359 CD1 LEU B 101 -17.012 -5.418 -10.595 1.00 0.00 C ATOM 3360 CD2 LEU B 101 -17.369 -7.790 -11.274 1.00 0.00 C ATOM 0 H LEU B 101 -18.950 -8.405 -8.956 1.00 0.00 H new ATOM 0 HA LEU B 101 -16.409 -9.248 -9.598 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -17.069 -6.728 -8.020 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -15.668 -6.979 -9.042 1.00 0.00 H new ATOM 0 HG LEU B 101 -18.576 -6.707 -9.859 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -17.584 -5.089 -11.462 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -17.127 -4.694 -9.788 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -15.959 -5.497 -10.864 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -17.945 -7.455 -12.137 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -16.317 -7.870 -11.549 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -17.734 -8.764 -10.950 1.00 0.00 H new ATOM 3372 N SER B 102 -14.921 -9.595 -7.593 1.00 0.00 N ATOM 3373 CA SER B 102 -14.161 -10.074 -6.398 1.00 0.00 C ATOM 3374 C SER B 102 -13.198 -8.998 -5.888 1.00 0.00 C ATOM 3375 O SER B 102 -12.479 -8.382 -6.651 1.00 0.00 O ATOM 3376 CB SER B 102 -13.366 -11.324 -6.779 1.00 0.00 C ATOM 3377 OG SER B 102 -13.429 -12.263 -5.714 1.00 0.00 O ATOM 0 H SER B 102 -14.403 -9.612 -8.471 1.00 0.00 H new ATOM 0 HA SER B 102 -14.872 -10.302 -5.604 1.00 0.00 H new ATOM 0 HB2 SER B 102 -13.771 -11.763 -7.691 1.00 0.00 H new ATOM 0 HB3 SER B 102 -12.329 -11.060 -6.986 1.00 0.00 H new ATOM 0 HG SER B 102 -12.922 -13.066 -5.956 1.00 0.00 H new ATOM 3383 N ASN B 103 -13.158 -8.789 -4.596 1.00 0.00 N ATOM 3384 CA ASN B 103 -12.214 -7.774 -4.032 1.00 0.00 C ATOM 3385 C ASN B 103 -12.509 -6.393 -4.612 1.00 0.00 C ATOM 3386 O ASN B 103 -11.620 -5.586 -4.795 1.00 0.00 O ATOM 3387 CB ASN B 103 -10.783 -8.163 -4.390 1.00 0.00 C ATOM 3388 CG ASN B 103 -10.378 -9.416 -3.609 1.00 0.00 C ATOM 3389 OD1 ASN B 103 -10.149 -9.355 -2.419 1.00 0.00 O ATOM 3390 ND2 ASN B 103 -10.279 -10.556 -4.236 1.00 0.00 N ATOM 0 H ASN B 103 -13.735 -9.275 -3.909 1.00 0.00 H new ATOM 0 HA ASN B 103 -12.338 -7.743 -2.950 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -10.704 -8.349 -5.461 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -10.104 -7.343 -4.158 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -10.009 -11.397 -3.726 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -10.472 -10.606 -5.236 1.00 0.00 H new ATOM 3397 N MET B 104 -13.741 -6.110 -4.895 1.00 0.00 N ATOM 3398 CA MET B 104 -14.080 -4.776 -5.454 1.00 0.00 C ATOM 3399 C MET B 104 -14.499 -3.841 -4.318 1.00 0.00 C ATOM 3400 O MET B 104 -15.067 -2.793 -4.544 1.00 0.00 O ATOM 3401 CB MET B 104 -15.229 -4.910 -6.455 1.00 0.00 C ATOM 3402 CG MET B 104 -15.558 -3.533 -7.033 1.00 0.00 C ATOM 3403 SD MET B 104 -15.390 -3.575 -8.833 1.00 0.00 S ATOM 3404 CE MET B 104 -16.686 -2.368 -9.200 1.00 0.00 C ATOM 0 H MET B 104 -14.531 -6.742 -4.765 1.00 0.00 H new ATOM 0 HA MET B 104 -13.207 -4.366 -5.963 1.00 0.00 H new ATOM 0 HB2 MET B 104 -14.951 -5.596 -7.255 1.00 0.00 H new ATOM 0 HB3 MET B 104 -16.107 -5.331 -5.965 1.00 0.00 H new ATOM 0 HG2 MET B 104 -16.573 -3.245 -6.759 1.00 0.00 H new ATOM 0 HG3 MET B 104 -14.889 -2.782 -6.613 1.00 0.00 H new ATOM 0 HE1 MET B 104 -17.408 -2.807 -9.889 1.00 0.00 H new ATOM 0 HE2 MET B 104 -17.191 -2.085 -8.277 1.00 0.00 H new ATOM 0 HE3 MET B 104 -16.241 -1.484 -9.656 1.00 0.00 H new ATOM 3414 N ILE B 105 -14.218 -4.208 -3.096 1.00 0.00 N ATOM 3415 CA ILE B 105 -14.598 -3.330 -1.951 1.00 0.00 C ATOM 3416 C ILE B 105 -13.537 -3.432 -0.854 1.00 0.00 C ATOM 3417 O ILE B 105 -12.702 -4.315 -0.866 1.00 0.00 O ATOM 3418 CB ILE B 105 -15.953 -3.766 -1.392 1.00 0.00 C ATOM 3419 CG1 ILE B 105 -17.022 -3.622 -2.479 1.00 0.00 C ATOM 3420 CG2 ILE B 105 -16.315 -2.880 -0.198 1.00 0.00 C ATOM 3421 CD1 ILE B 105 -18.402 -3.903 -1.882 1.00 0.00 C ATOM 0 H ILE B 105 -13.744 -5.074 -2.842 1.00 0.00 H new ATOM 0 HA ILE B 105 -14.666 -2.299 -2.297 1.00 0.00 H new ATOM 0 HB ILE B 105 -15.900 -4.806 -1.072 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -16.994 -2.617 -2.899 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -16.820 -4.315 -3.296 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -17.281 -3.187 0.204 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.552 -2.980 0.574 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -16.371 -1.840 -0.520 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -19.162 -3.800 -2.657 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -18.426 -4.917 -1.483 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -18.603 -3.192 -1.080 1.00 0.00 H new ATOM 3433 N VAL B 106 -13.558 -2.531 0.090 1.00 0.00 N ATOM 3434 CA VAL B 106 -12.547 -2.569 1.178 1.00 0.00 C ATOM 3435 C VAL B 106 -13.235 -2.866 2.515 1.00 0.00 C ATOM 3436 O VAL B 106 -14.308 -2.370 2.797 1.00 0.00 O ATOM 3437 CB VAL B 106 -11.854 -1.206 1.250 1.00 0.00 C ATOM 3438 CG1 VAL B 106 -11.123 -1.070 2.583 1.00 0.00 C ATOM 3439 CG2 VAL B 106 -10.848 -1.086 0.104 1.00 0.00 C ATOM 0 H VAL B 106 -14.234 -1.770 0.153 1.00 0.00 H new ATOM 0 HA VAL B 106 -11.815 -3.351 0.976 1.00 0.00 H new ATOM 0 HB VAL B 106 -12.601 -0.417 1.166 1.00 0.00 H new ATOM 0 HG11 VAL B 106 -10.631 -0.099 2.631 1.00 0.00 H new ATOM 0 HG12 VAL B 106 -11.839 -1.155 3.401 1.00 0.00 H new ATOM 0 HG13 VAL B 106 -10.377 -1.859 2.671 1.00 0.00 H new ATOM 0 HG21 VAL B 106 -10.354 -0.116 0.154 1.00 0.00 H new ATOM 0 HG22 VAL B 106 -10.103 -1.877 0.189 1.00 0.00 H new ATOM 0 HG23 VAL B 106 -11.369 -1.179 -0.849 1.00 0.00 H new ATOM 3449 N ARG B 107 -12.618 -3.667 3.342 1.00 0.00 N ATOM 3450 CA ARG B 107 -13.227 -3.991 4.665 1.00 0.00 C ATOM 3451 C ARG B 107 -12.220 -3.681 5.779 1.00 0.00 C ATOM 3452 O ARG B 107 -12.533 -3.757 6.951 1.00 0.00 O ATOM 3453 CB ARG B 107 -13.599 -5.475 4.705 1.00 0.00 C ATOM 3454 CG ARG B 107 -12.329 -6.322 4.602 1.00 0.00 C ATOM 3455 CD ARG B 107 -12.539 -7.647 5.339 1.00 0.00 C ATOM 3456 NE ARG B 107 -11.654 -7.692 6.537 1.00 0.00 N ATOM 3457 CZ ARG B 107 -11.856 -8.589 7.464 1.00 0.00 C ATOM 3458 NH1 ARG B 107 -12.901 -8.499 8.241 1.00 0.00 N ATOM 3459 NH2 ARG B 107 -11.014 -9.574 7.614 1.00 0.00 N ATOM 0 H ARG B 107 -11.718 -4.111 3.159 1.00 0.00 H new ATOM 0 HA ARG B 107 -14.124 -3.390 4.811 1.00 0.00 H new ATOM 0 HB2 ARG B 107 -14.127 -5.704 5.631 1.00 0.00 H new ATOM 0 HB3 ARG B 107 -14.276 -5.714 3.884 1.00 0.00 H new ATOM 0 HG2 ARG B 107 -12.088 -6.510 3.556 1.00 0.00 H new ATOM 0 HG3 ARG B 107 -11.484 -5.784 5.032 1.00 0.00 H new ATOM 0 HD2 ARG B 107 -13.582 -7.747 5.640 1.00 0.00 H new ATOM 0 HD3 ARG B 107 -12.316 -8.484 4.677 1.00 0.00 H new ATOM 0 HE ARG B 107 -10.891 -7.022 6.633 1.00 0.00 H new ATOM 0 HH11 ARG B 107 -13.559 -7.728 8.124 1.00 0.00 H new ATOM 0 HH12 ARG B 107 -13.060 -9.199 8.965 1.00 0.00 H new ATOM 0 HH21 ARG B 107 -10.197 -9.644 7.007 1.00 0.00 H new ATOM 0 HH22 ARG B 107 -11.172 -10.274 8.338 1.00 0.00 H new ATOM 3473 N SER B 108 -11.013 -3.333 5.420 1.00 0.00 N ATOM 3474 CA SER B 108 -9.982 -3.015 6.449 1.00 0.00 C ATOM 3475 C SER B 108 -8.645 -2.762 5.752 1.00 0.00 C ATOM 3476 O SER B 108 -8.205 -3.544 4.934 1.00 0.00 O ATOM 3477 CB SER B 108 -9.839 -4.191 7.415 1.00 0.00 C ATOM 3478 OG SER B 108 -10.777 -4.049 8.473 1.00 0.00 O ATOM 0 H SER B 108 -10.696 -3.255 4.454 1.00 0.00 H new ATOM 0 HA SER B 108 -10.282 -2.128 7.007 1.00 0.00 H new ATOM 0 HB2 SER B 108 -10.007 -5.131 6.889 1.00 0.00 H new ATOM 0 HB3 SER B 108 -8.826 -4.226 7.815 1.00 0.00 H new ATOM 0 HG SER B 108 -11.631 -3.730 8.113 1.00 0.00 H new ATOM 3484 N CYS B 109 -8.000 -1.669 6.055 1.00 0.00 N ATOM 3485 CA CYS B 109 -6.699 -1.371 5.390 1.00 0.00 C ATOM 3486 C CYS B 109 -5.530 -1.856 6.255 1.00 0.00 C ATOM 3487 O CYS B 109 -5.693 -2.674 7.139 1.00 0.00 O ATOM 3488 CB CYS B 109 -6.576 0.138 5.164 1.00 0.00 C ATOM 3489 SG CYS B 109 -7.929 0.694 4.101 1.00 0.00 S ATOM 0 H CYS B 109 -8.315 -0.973 6.730 1.00 0.00 H new ATOM 0 HA CYS B 109 -6.666 -1.892 4.433 1.00 0.00 H new ATOM 0 HB2 CYS B 109 -6.608 0.664 6.118 1.00 0.00 H new ATOM 0 HB3 CYS B 109 -5.616 0.371 4.703 1.00 0.00 H new ATOM 3494 N LYS B 110 -4.346 -1.361 5.995 1.00 0.00 N ATOM 3495 CA LYS B 110 -3.157 -1.787 6.784 1.00 0.00 C ATOM 3496 C LYS B 110 -1.988 -0.859 6.438 1.00 0.00 C ATOM 3497 O LYS B 110 -2.151 0.338 6.354 1.00 0.00 O ATOM 3498 CB LYS B 110 -2.807 -3.234 6.428 1.00 0.00 C ATOM 3499 CG LYS B 110 -2.501 -3.334 4.932 1.00 0.00 C ATOM 3500 CD LYS B 110 -2.276 -4.799 4.554 1.00 0.00 C ATOM 3501 CE LYS B 110 -0.888 -4.958 3.932 1.00 0.00 C ATOM 3502 NZ LYS B 110 -0.995 -5.747 2.672 1.00 0.00 N ATOM 0 H LYS B 110 -4.154 -0.676 5.264 1.00 0.00 H new ATOM 0 HA LYS B 110 -3.366 -1.729 7.852 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -1.946 -3.564 7.009 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -3.636 -3.893 6.685 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -3.327 -2.921 4.353 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -1.616 -2.745 4.691 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -2.365 -5.431 5.437 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -3.041 -5.126 3.850 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -0.456 -3.979 3.725 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -0.219 -5.459 4.632 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -0.051 -5.855 2.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -1.390 -6.686 2.883 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -1.619 -5.251 2.004 1.00 0.00 H new ATOM 3516 N CYS B 111 -0.811 -1.385 6.229 1.00 0.00 N ATOM 3517 CA CYS B 111 0.335 -0.497 5.885 1.00 0.00 C ATOM 3518 C CYS B 111 1.378 -1.284 5.089 1.00 0.00 C ATOM 3519 O CYS B 111 2.308 -1.835 5.642 1.00 0.00 O ATOM 3520 CB CYS B 111 0.967 0.044 7.170 1.00 0.00 C ATOM 3521 SG CYS B 111 -0.089 1.349 7.852 1.00 0.00 S ATOM 0 H CYS B 111 -0.595 -2.381 6.281 1.00 0.00 H new ATOM 0 HA CYS B 111 -0.023 0.336 5.280 1.00 0.00 H new ATOM 0 HB2 CYS B 111 1.087 -0.760 7.896 1.00 0.00 H new ATOM 0 HB3 CYS B 111 1.962 0.437 6.962 1.00 0.00 H new ATOM 3526 N SER B 112 1.231 -1.339 3.791 1.00 0.00 N ATOM 3527 CA SER B 112 2.217 -2.088 2.963 1.00 0.00 C ATOM 3528 C SER B 112 3.382 -1.164 2.604 1.00 0.00 C ATOM 3529 O SER B 112 3.121 -0.043 2.198 1.00 0.00 O ATOM 3530 CB SER B 112 1.540 -2.577 1.683 1.00 0.00 C ATOM 3531 OG SER B 112 2.376 -3.536 1.048 1.00 0.00 O ATOM 3532 OXT SER B 112 4.516 -1.591 2.742 1.00 0.00 O ATOM 0 H SER B 112 0.472 -0.898 3.271 1.00 0.00 H new ATOM 0 HA SER B 112 2.591 -2.944 3.525 1.00 0.00 H new ATOM 0 HB2 SER B 112 0.571 -3.019 1.916 1.00 0.00 H new ATOM 0 HB3 SER B 112 1.354 -1.738 1.012 1.00 0.00 H new ATOM 0 HG SER B 112 1.823 -4.249 0.664 1.00 0.00 H new