USER MOD reduce.3.24.130724 H: found=0, std=0, add=1748, rem=0, adj=54 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 Set 1.1: B 56 THR OG1 : rot -59:sc= 1.03 USER MOD Set 1.2: B 59 SER OG : rot -141:sc= 0.908 USER MOD Set 2.1: A 56 THR OG1 : rot -59:sc= 1.05 USER MOD Set 2.2: A 59 SER OG : rot -142:sc= 0.912 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 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 120:sc= -0.48 USER MOD Single : A 9 SER OG : rot 100:sc= 0.00217 USER MOD Single : A 10 SER OG : rot 49:sc= 0.242 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0583 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -1.57 X(o=-1.6,f=-1.6) USER MOD Single : A 19 GLN : amide:sc= -0.0824 K(o=-0.082,f=-1) USER MOD Single : A 21 TYR OH : rot 180:sc= -2.55! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HE2:sc= -3.98 X(o=-4,f=-3.9!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= -2.02 USER MOD Single : A 40 HIS : no HD1:sc= -0.434 K(o=-0.43,f=-1.3) USER MOD Single : A 42 ASN :FLIP amide:sc= -0.147 F(o=-1.4,f=-0.15) 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 57 GLN : amide:sc= -4.3! C(o=-4.3!,f=-9.7!) USER MOD Single : A 58 TYR OH : rot -178:sc= -8.73! 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= -12.6! C(o=-13!,f=-13!) USER MOD Single : A 67 GLN :FLIP amide:sc= -3.73! C(o=-4.3!,f=-3.7!) USER MOD Single : A 68 HIS : no HE2:sc= -0.558 K(o=-0.56,f=-1.8) USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN :FLIP amide:sc= -7.12! C(o=-8!,f=-7.1!) USER MOD Single : A 90 TYR OH : rot 180:sc= -0.755 USER MOD Single : A 91 TYR OH : rot 180:sc= -0.054 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.0412 K(o=-0.041,f=-2.1!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN :FLIP amide:sc= -1.36 F(o=-2.1,f=-1.4) USER MOD Single : A 104 MET CE :methyl -126:sc= -13.6! (180deg=-25.3!) USER MOD Single : A 108 SER OG : rot 66:sc= 0.842 USER MOD Single : A 110 LYS NZ :NH3+ 160:sc= -0.0945 (180deg=-0.633) USER MOD Single : A 112 SER OG : rot 130:sc= -3.44! 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 X(o=0,f=0) USER MOD Single : B 6 TYR OH : rot 120:sc= -0.445 USER MOD Single : B 9 SER OG : rot 102:sc= 0.00161 USER MOD Single : B 10 SER OG : rot 48:sc= 0.258 USER MOD Single : B 11 THR OG1 : rot 180:sc= 0.0362 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 ASN : amide:sc= -1.54! C(o=-1.5!,f=-1.5!) USER MOD Single : B 19 GLN : amide:sc= -0.0743 K(o=-0.074,f=-0.95) USER MOD Single : B 21 TYR OH : rot 180:sc= -2.57! USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 HIS : no HE2:sc= -4.03 X(o=-4,f=-4!) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 TYR OH : rot -117:sc= -1.88 USER MOD Single : B 40 HIS : no HD1:sc= -0.438 K(o=-0.44,f=-1.2) USER MOD Single : B 42 ASN :FLIP amide:sc= -0.163 F(o=-1.4,f=-0.16) 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 57 GLN : amide:sc= -4.36! C(o=-4.4!,f=-10!) USER MOD Single : B 58 TYR OH : rot -178:sc= -8.93! 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= -12.4! C(o=-12!,f=-13!) USER MOD Single : B 67 GLN :FLIP amide:sc= -3.72! C(o=-4.4!,f=-3.7!) USER MOD Single : B 68 HIS : no HE2:sc= -0.532 K(o=-0.53,f=-1.8) USER MOD Single : B 69 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 81 GLN :FLIP amide:sc= -6.36! C(o=-7.1!,f=-6.4!) USER MOD Single : B 90 TYR OH : rot 180:sc= -0.687 USER MOD Single : B 91 TYR OH : rot 180:sc= -0.0575 USER MOD Single : B 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 100 GLN : amide:sc= -0.0564 K(o=-0.056,f=-2.2!) USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 103 ASN :FLIP amide:sc= -1.36 F(o=-2.2,f=-1.4) USER MOD Single : B 104 MET CE :methyl -127:sc= -14.1! (180deg=-25.2!) USER MOD Single : B 108 SER OG : rot 27:sc= 0.828 USER MOD Single : B 110 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.21) USER MOD Single : B 112 SER OG : rot 130:sc= -3.81! USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.649 -3.094 -15.540 1.00 0.00 N ATOM 2 CA ALA A 1 8.549 -3.473 -14.414 1.00 0.00 C ATOM 3 C ALA A 1 8.507 -2.384 -13.340 1.00 0.00 C ATOM 4 O ALA A 1 8.841 -1.243 -13.586 1.00 0.00 O ATOM 5 CB ALA A 1 9.980 -3.622 -14.934 1.00 0.00 C ATOM 0 H1 ALA A 1 7.677 -3.834 -16.271 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.676 -2.992 -15.187 1.00 0.00 H new ATOM 0 H3 ALA A 1 7.965 -2.192 -15.949 1.00 0.00 H new ATOM 0 HA ALA A 1 8.218 -4.419 -13.986 1.00 0.00 H new ATOM 0 HB1 ALA A 1 10.639 -3.899 -14.111 1.00 0.00 H new ATOM 0 HB2 ALA A 1 10.010 -4.397 -15.700 1.00 0.00 H new ATOM 0 HB3 ALA A 1 10.312 -2.676 -15.362 1.00 0.00 H new ATOM 13 N LEU A 2 8.098 -2.728 -12.150 1.00 0.00 N ATOM 14 CA LEU A 2 8.035 -1.711 -11.062 1.00 0.00 C ATOM 15 C LEU A 2 9.047 -2.059 -9.977 1.00 0.00 C ATOM 16 O LEU A 2 8.728 -2.119 -8.806 1.00 0.00 O ATOM 17 CB LEU A 2 6.636 -1.694 -10.459 1.00 0.00 C ATOM 18 CG LEU A 2 5.686 -0.966 -11.410 1.00 0.00 C ATOM 19 CD1 LEU A 2 4.310 -0.832 -10.757 1.00 0.00 C ATOM 20 CD2 LEU A 2 6.241 0.427 -11.712 1.00 0.00 C ATOM 0 H LEU A 2 7.805 -3.668 -11.884 1.00 0.00 H new ATOM 0 HA LEU A 2 8.266 -0.729 -11.475 1.00 0.00 H new ATOM 0 HB2 LEU A 2 6.288 -2.713 -10.288 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.651 -1.196 -9.490 1.00 0.00 H new ATOM 0 HG LEU A 2 5.594 -1.534 -12.336 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.634 -0.313 -11.436 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.913 -1.823 -10.538 1.00 0.00 H new ATOM 0 HD13 LEU A 2 4.400 -0.264 -9.831 1.00 0.00 H new ATOM 0 HD21 LEU A 2 5.566 0.949 -12.390 1.00 0.00 H new ATOM 0 HD22 LEU A 2 6.331 0.992 -10.784 1.00 0.00 H new ATOM 0 HD23 LEU A 2 7.222 0.335 -12.177 1.00 0.00 H new ATOM 32 N ASP A 3 10.265 -2.283 -10.361 1.00 0.00 N ATOM 33 CA ASP A 3 11.311 -2.620 -9.361 1.00 0.00 C ATOM 34 C ASP A 3 12.246 -1.425 -9.196 1.00 0.00 C ATOM 35 O ASP A 3 12.043 -0.379 -9.780 1.00 0.00 O ATOM 36 CB ASP A 3 12.111 -3.835 -9.836 1.00 0.00 C ATOM 37 CG ASP A 3 12.178 -3.840 -11.366 1.00 0.00 C ATOM 38 OD1 ASP A 3 12.787 -2.937 -11.915 1.00 0.00 O ATOM 39 OD2 ASP A 3 11.618 -4.746 -11.961 1.00 0.00 O ATOM 0 H ASP A 3 10.586 -2.248 -11.329 1.00 0.00 H new ATOM 0 HA ASP A 3 10.841 -2.855 -8.406 1.00 0.00 H new ATOM 0 HB2 ASP A 3 13.117 -3.807 -9.418 1.00 0.00 H new ATOM 0 HB3 ASP A 3 11.644 -4.753 -9.479 1.00 0.00 H new ATOM 44 N THR A 4 13.266 -1.570 -8.402 1.00 0.00 N ATOM 45 CA THR A 4 14.216 -0.445 -8.191 1.00 0.00 C ATOM 46 C THR A 4 15.231 -0.390 -9.338 1.00 0.00 C ATOM 47 O THR A 4 16.232 0.295 -9.260 1.00 0.00 O ATOM 48 CB THR A 4 14.928 -0.654 -6.855 1.00 0.00 C ATOM 49 OG1 THR A 4 15.984 -1.589 -7.021 1.00 0.00 O ATOM 50 CG2 THR A 4 13.917 -1.189 -5.835 1.00 0.00 C ATOM 0 H THR A 4 13.484 -2.423 -7.887 1.00 0.00 H new ATOM 0 HA THR A 4 13.676 0.501 -8.173 1.00 0.00 H new ATOM 0 HB THR A 4 15.342 0.290 -6.502 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.441 -1.721 -6.164 1.00 0.00 H new ATOM 0 HG21 THR A 4 14.413 -1.342 -4.877 1.00 0.00 H new ATOM 0 HG22 THR A 4 13.107 -0.469 -5.713 1.00 0.00 H new ATOM 0 HG23 THR A 4 13.510 -2.136 -6.189 1.00 0.00 H new ATOM 58 N ASN A 5 14.975 -1.092 -10.410 1.00 0.00 N ATOM 59 CA ASN A 5 15.913 -1.062 -11.566 1.00 0.00 C ATOM 60 C ASN A 5 15.361 -0.117 -12.638 1.00 0.00 C ATOM 61 O ASN A 5 16.081 0.673 -13.215 1.00 0.00 O ATOM 62 CB ASN A 5 16.053 -2.470 -12.149 1.00 0.00 C ATOM 63 CG ASN A 5 17.462 -2.651 -12.718 1.00 0.00 C ATOM 64 OD1 ASN A 5 17.671 -2.517 -13.907 1.00 0.00 O ATOM 65 ND2 ASN A 5 18.443 -2.951 -11.913 1.00 0.00 N ATOM 0 H ASN A 5 14.155 -1.685 -10.533 1.00 0.00 H new ATOM 0 HA ASN A 5 16.890 -0.710 -11.235 1.00 0.00 H new ATOM 0 HB2 ASN A 5 15.863 -3.215 -11.376 1.00 0.00 H new ATOM 0 HB3 ASN A 5 15.311 -2.626 -12.932 1.00 0.00 H new ATOM 0 HD21 ASN A 5 19.386 -3.073 -12.282 1.00 0.00 H new ATOM 0 HD22 ASN A 5 18.267 -3.063 -10.915 1.00 0.00 H new ATOM 72 N TYR A 6 14.083 -0.196 -12.910 1.00 0.00 N ATOM 73 CA TYR A 6 13.477 0.687 -13.940 1.00 0.00 C ATOM 74 C TYR A 6 13.091 2.027 -13.306 1.00 0.00 C ATOM 75 O TYR A 6 12.937 3.023 -13.983 1.00 0.00 O ATOM 76 CB TYR A 6 12.231 -0.004 -14.494 1.00 0.00 C ATOM 77 CG TYR A 6 11.398 0.982 -15.274 1.00 0.00 C ATOM 78 CD1 TYR A 6 11.882 1.529 -16.468 1.00 0.00 C ATOM 79 CD2 TYR A 6 10.135 1.348 -14.798 1.00 0.00 C ATOM 80 CE1 TYR A 6 11.102 2.442 -17.187 1.00 0.00 C ATOM 81 CE2 TYR A 6 9.354 2.261 -15.516 1.00 0.00 C ATOM 82 CZ TYR A 6 9.837 2.808 -16.711 1.00 0.00 C ATOM 83 OH TYR A 6 9.067 3.709 -17.418 1.00 0.00 O ATOM 0 H TYR A 6 13.434 -0.839 -12.458 1.00 0.00 H new ATOM 0 HA TYR A 6 14.189 0.872 -14.744 1.00 0.00 H new ATOM 0 HB2 TYR A 6 12.521 -0.835 -15.136 1.00 0.00 H new ATOM 0 HB3 TYR A 6 11.644 -0.423 -13.677 1.00 0.00 H new ATOM 0 HD1 TYR A 6 12.858 1.246 -16.835 1.00 0.00 H new ATOM 0 HD2 TYR A 6 9.762 0.926 -13.876 1.00 0.00 H new ATOM 0 HE1 TYR A 6 11.476 2.864 -18.108 1.00 0.00 H new ATOM 0 HE2 TYR A 6 8.379 2.544 -15.148 1.00 0.00 H new ATOM 0 HH TYR A 6 8.223 3.284 -17.678 1.00 0.00 H new ATOM 93 N CYS A 7 12.928 2.056 -12.011 1.00 0.00 N ATOM 94 CA CYS A 7 12.549 3.329 -11.335 1.00 0.00 C ATOM 95 C CYS A 7 13.755 4.268 -11.265 1.00 0.00 C ATOM 96 O CYS A 7 13.613 5.456 -11.059 1.00 0.00 O ATOM 97 CB CYS A 7 12.054 3.027 -9.920 1.00 0.00 C ATOM 98 SG CYS A 7 10.261 2.789 -9.948 1.00 0.00 S ATOM 0 H CYS A 7 13.041 1.253 -11.392 1.00 0.00 H new ATOM 0 HA CYS A 7 11.756 3.812 -11.906 1.00 0.00 H new ATOM 0 HB2 CYS A 7 12.544 2.133 -9.534 1.00 0.00 H new ATOM 0 HB3 CYS A 7 12.313 3.847 -9.250 1.00 0.00 H new ATOM 103 N PHE A 8 14.939 3.751 -11.437 1.00 0.00 N ATOM 104 CA PHE A 8 16.144 4.625 -11.379 1.00 0.00 C ATOM 105 C PHE A 8 16.409 5.219 -12.764 1.00 0.00 C ATOM 106 O PHE A 8 17.536 5.294 -13.213 1.00 0.00 O ATOM 107 CB PHE A 8 17.354 3.800 -10.933 1.00 0.00 C ATOM 108 CG PHE A 8 17.481 3.840 -9.425 1.00 0.00 C ATOM 109 CD1 PHE A 8 16.402 4.262 -8.633 1.00 0.00 C ATOM 110 CD2 PHE A 8 18.683 3.455 -8.817 1.00 0.00 C ATOM 111 CE1 PHE A 8 16.529 4.299 -7.238 1.00 0.00 C ATOM 112 CE2 PHE A 8 18.807 3.490 -7.424 1.00 0.00 C ATOM 113 CZ PHE A 8 17.731 3.913 -6.634 1.00 0.00 C ATOM 0 H PHE A 8 15.125 2.764 -11.615 1.00 0.00 H new ATOM 0 HA PHE A 8 15.975 5.431 -10.665 1.00 0.00 H new ATOM 0 HB2 PHE A 8 17.246 2.769 -11.270 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.261 4.192 -11.393 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.474 4.558 -9.099 1.00 0.00 H new ATOM 0 HD2 PHE A 8 19.515 3.131 -9.425 1.00 0.00 H new ATOM 0 HE1 PHE A 8 15.699 4.625 -6.629 1.00 0.00 H new ATOM 0 HE2 PHE A 8 19.734 3.190 -6.957 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.829 3.941 -5.559 1.00 0.00 H new ATOM 123 N SER A 9 15.380 5.644 -13.444 1.00 0.00 N ATOM 124 CA SER A 9 15.573 6.235 -14.797 1.00 0.00 C ATOM 125 C SER A 9 15.328 7.747 -14.735 1.00 0.00 C ATOM 126 O SER A 9 16.198 8.507 -14.359 1.00 0.00 O ATOM 127 CB SER A 9 14.593 5.590 -15.780 1.00 0.00 C ATOM 128 OG SER A 9 15.060 4.291 -16.121 1.00 0.00 O ATOM 0 H SER A 9 14.413 5.607 -13.120 1.00 0.00 H new ATOM 0 HA SER A 9 16.593 6.051 -15.134 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.600 5.527 -15.334 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.502 6.204 -16.676 1.00 0.00 H new ATOM 0 HG SER A 9 14.573 3.621 -15.597 1.00 0.00 H new ATOM 134 N SER A 10 14.154 8.194 -15.098 1.00 0.00 N ATOM 135 CA SER A 10 13.875 9.659 -15.049 1.00 0.00 C ATOM 136 C SER A 10 12.374 9.912 -15.165 1.00 0.00 C ATOM 137 O SER A 10 11.837 10.827 -14.571 1.00 0.00 O ATOM 138 CB SER A 10 14.600 10.355 -16.201 1.00 0.00 C ATOM 139 OG SER A 10 15.705 11.087 -15.685 1.00 0.00 O ATOM 0 H SER A 10 13.382 7.613 -15.424 1.00 0.00 H new ATOM 0 HA SER A 10 14.230 10.057 -14.098 1.00 0.00 H new ATOM 0 HB2 SER A 10 14.944 9.619 -16.928 1.00 0.00 H new ATOM 0 HB3 SER A 10 13.917 11.025 -16.724 1.00 0.00 H new ATOM 0 HG SER A 10 16.229 10.511 -15.090 1.00 0.00 H new ATOM 145 N THR A 11 11.697 9.115 -15.932 1.00 0.00 N ATOM 146 CA THR A 11 10.229 9.305 -16.103 1.00 0.00 C ATOM 147 C THR A 11 9.472 8.384 -15.143 1.00 0.00 C ATOM 148 O THR A 11 10.022 7.885 -14.182 1.00 0.00 O ATOM 149 CB THR A 11 9.839 8.967 -17.543 1.00 0.00 C ATOM 150 OG1 THR A 11 10.972 8.459 -18.232 1.00 0.00 O ATOM 151 CG2 THR A 11 9.335 10.230 -18.245 1.00 0.00 C ATOM 0 H THR A 11 12.095 8.334 -16.453 1.00 0.00 H new ATOM 0 HA THR A 11 9.972 10.342 -15.885 1.00 0.00 H new ATOM 0 HB THR A 11 9.049 8.216 -17.540 1.00 0.00 H new ATOM 0 HG1 THR A 11 10.723 8.240 -19.154 1.00 0.00 H new ATOM 0 HG21 THR A 11 9.057 9.990 -19.271 1.00 0.00 H new ATOM 0 HG22 THR A 11 8.465 10.618 -17.715 1.00 0.00 H new ATOM 0 HG23 THR A 11 10.123 10.983 -18.250 1.00 0.00 H new ATOM 159 N GLU A 12 8.211 8.161 -15.399 1.00 0.00 N ATOM 160 CA GLU A 12 7.406 7.276 -14.510 1.00 0.00 C ATOM 161 C GLU A 12 7.004 8.040 -13.247 1.00 0.00 C ATOM 162 O GLU A 12 7.841 8.466 -12.475 1.00 0.00 O ATOM 163 CB GLU A 12 8.230 6.046 -14.124 1.00 0.00 C ATOM 164 CG GLU A 12 7.366 4.793 -14.263 1.00 0.00 C ATOM 165 CD GLU A 12 6.895 4.657 -15.713 1.00 0.00 C ATOM 166 OE1 GLU A 12 7.270 5.494 -16.517 1.00 0.00 O ATOM 167 OE2 GLU A 12 6.166 3.719 -15.994 1.00 0.00 O ATOM 0 H GLU A 12 7.702 8.556 -16.190 1.00 0.00 H new ATOM 0 HA GLU A 12 6.508 6.958 -15.040 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.109 5.968 -14.764 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.589 6.142 -13.099 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.936 3.911 -13.970 1.00 0.00 H new ATOM 0 HG3 GLU A 12 6.507 4.854 -13.595 1.00 0.00 H new ATOM 174 N LYS A 13 5.729 8.215 -13.031 1.00 0.00 N ATOM 175 CA LYS A 13 5.270 8.952 -11.820 1.00 0.00 C ATOM 176 C LYS A 13 4.233 8.111 -11.068 1.00 0.00 C ATOM 177 O LYS A 13 3.781 8.478 -10.002 1.00 0.00 O ATOM 178 CB LYS A 13 4.640 10.281 -12.242 1.00 0.00 C ATOM 179 CG LYS A 13 4.910 11.337 -11.170 1.00 0.00 C ATOM 180 CD LYS A 13 5.623 12.536 -11.800 1.00 0.00 C ATOM 181 CE LYS A 13 7.008 12.107 -12.286 1.00 0.00 C ATOM 182 NZ LYS A 13 7.172 12.487 -13.718 1.00 0.00 N ATOM 0 H LYS A 13 4.984 7.879 -13.642 1.00 0.00 H new ATOM 0 HA LYS A 13 6.122 9.143 -11.167 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.053 10.604 -13.198 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.566 10.158 -12.384 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.972 11.656 -10.715 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.523 10.914 -10.374 1.00 0.00 H new ATOM 0 HD2 LYS A 13 5.037 12.924 -12.633 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.715 13.342 -11.072 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.781 12.583 -11.682 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.129 11.030 -12.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 8.114 12.195 -14.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.443 12.014 -14.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 7.074 13.518 -13.817 1.00 0.00 H new ATOM 196 N ASN A 14 3.852 6.988 -11.613 1.00 0.00 N ATOM 197 CA ASN A 14 2.845 6.129 -10.926 1.00 0.00 C ATOM 198 C ASN A 14 3.540 5.294 -9.849 1.00 0.00 C ATOM 199 O ASN A 14 4.628 5.613 -9.414 1.00 0.00 O ATOM 200 CB ASN A 14 2.189 5.198 -11.948 1.00 0.00 C ATOM 201 CG ASN A 14 1.597 6.027 -13.090 1.00 0.00 C ATOM 202 OD1 ASN A 14 1.884 5.784 -14.245 1.00 0.00 O ATOM 203 ND2 ASN A 14 0.775 7.002 -12.813 1.00 0.00 N ATOM 0 H ASN A 14 4.194 6.628 -12.504 1.00 0.00 H new ATOM 0 HA ASN A 14 2.083 6.757 -10.465 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.924 4.494 -12.339 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.407 4.609 -11.469 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.373 7.560 -13.566 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.534 7.206 -11.843 1.00 0.00 H new ATOM 210 N CYS A 15 2.926 4.222 -9.418 1.00 0.00 N ATOM 211 CA CYS A 15 3.564 3.368 -8.374 1.00 0.00 C ATOM 212 C CYS A 15 4.966 2.984 -8.844 1.00 0.00 C ATOM 213 O CYS A 15 5.161 1.982 -9.504 1.00 0.00 O ATOM 214 CB CYS A 15 2.713 2.110 -8.156 1.00 0.00 C ATOM 215 SG CYS A 15 3.673 0.827 -7.302 1.00 0.00 S ATOM 0 H CYS A 15 2.013 3.903 -9.743 1.00 0.00 H new ATOM 0 HA CYS A 15 3.634 3.911 -7.432 1.00 0.00 H new ATOM 0 HB2 CYS A 15 1.829 2.360 -7.570 1.00 0.00 H new ATOM 0 HB3 CYS A 15 2.363 1.731 -9.116 1.00 0.00 H new ATOM 220 N CYS A 16 5.940 3.782 -8.516 1.00 0.00 N ATOM 221 CA CYS A 16 7.331 3.482 -8.944 1.00 0.00 C ATOM 222 C CYS A 16 8.255 3.604 -7.733 1.00 0.00 C ATOM 223 O CYS A 16 8.315 4.632 -7.083 1.00 0.00 O ATOM 224 CB CYS A 16 7.735 4.482 -10.043 1.00 0.00 C ATOM 225 SG CYS A 16 9.538 4.665 -10.131 1.00 0.00 S ATOM 0 H CYS A 16 5.831 4.634 -7.966 1.00 0.00 H new ATOM 0 HA CYS A 16 7.406 2.470 -9.343 1.00 0.00 H new ATOM 0 HB2 CYS A 16 7.354 4.142 -11.006 1.00 0.00 H new ATOM 0 HB3 CYS A 16 7.278 5.451 -9.843 1.00 0.00 H new ATOM 230 N VAL A 17 8.977 2.564 -7.424 1.00 0.00 N ATOM 231 CA VAL A 17 9.897 2.625 -6.257 1.00 0.00 C ATOM 232 C VAL A 17 10.887 3.774 -6.472 1.00 0.00 C ATOM 233 O VAL A 17 11.121 4.194 -7.586 1.00 0.00 O ATOM 234 CB VAL A 17 10.652 1.296 -6.141 1.00 0.00 C ATOM 235 CG1 VAL A 17 11.729 1.222 -7.214 1.00 0.00 C ATOM 236 CG2 VAL A 17 11.318 1.190 -4.772 1.00 0.00 C ATOM 0 H VAL A 17 8.970 1.677 -7.928 1.00 0.00 H new ATOM 0 HA VAL A 17 9.335 2.796 -5.339 1.00 0.00 H new ATOM 0 HB VAL A 17 9.941 0.479 -6.268 1.00 0.00 H new ATOM 0 HG11 VAL A 17 12.264 0.276 -7.128 1.00 0.00 H new ATOM 0 HG12 VAL A 17 11.267 1.290 -8.199 1.00 0.00 H new ATOM 0 HG13 VAL A 17 12.429 2.047 -7.084 1.00 0.00 H new ATOM 0 HG21 VAL A 17 11.852 0.242 -4.699 1.00 0.00 H new ATOM 0 HG22 VAL A 17 12.021 2.013 -4.645 1.00 0.00 H new ATOM 0 HG23 VAL A 17 10.557 1.239 -3.993 1.00 0.00 H new ATOM 246 N ARG A 18 11.471 4.286 -5.428 1.00 0.00 N ATOM 247 CA ARG A 18 12.442 5.401 -5.602 1.00 0.00 C ATOM 248 C ARG A 18 13.620 5.204 -4.658 1.00 0.00 C ATOM 249 O ARG A 18 13.811 4.146 -4.087 1.00 0.00 O ATOM 250 CB ARG A 18 11.777 6.739 -5.280 1.00 0.00 C ATOM 251 CG ARG A 18 10.369 6.773 -5.865 1.00 0.00 C ATOM 252 CD ARG A 18 10.433 7.187 -7.335 1.00 0.00 C ATOM 253 NE ARG A 18 9.256 8.041 -7.661 1.00 0.00 N ATOM 254 CZ ARG A 18 9.188 9.260 -7.201 1.00 0.00 C ATOM 255 NH1 ARG A 18 10.240 10.032 -7.240 1.00 0.00 N ATOM 256 NH2 ARG A 18 8.069 9.708 -6.702 1.00 0.00 N ATOM 0 H ARG A 18 11.320 3.984 -4.466 1.00 0.00 H new ATOM 0 HA ARG A 18 12.784 5.404 -6.637 1.00 0.00 H new ATOM 0 HB2 ARG A 18 11.735 6.884 -4.200 1.00 0.00 H new ATOM 0 HB3 ARG A 18 12.370 7.557 -5.689 1.00 0.00 H new ATOM 0 HG2 ARG A 18 9.903 5.792 -5.773 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.749 7.474 -5.306 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.357 7.732 -7.531 1.00 0.00 H new ATOM 0 HD3 ARG A 18 10.443 6.303 -7.973 1.00 0.00 H new ATOM 0 HE ARG A 18 8.504 7.673 -8.243 1.00 0.00 H new ATOM 0 HH11 ARG A 18 11.115 9.682 -7.630 1.00 0.00 H new ATOM 0 HH12 ARG A 18 10.187 10.985 -6.880 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.247 9.105 -6.671 1.00 0.00 H new ATOM 0 HH22 ARG A 18 8.016 10.661 -6.342 1.00 0.00 H new ATOM 270 N GLN A 19 14.403 6.227 -4.486 1.00 0.00 N ATOM 271 CA GLN A 19 15.575 6.126 -3.575 1.00 0.00 C ATOM 272 C GLN A 19 15.164 6.596 -2.181 1.00 0.00 C ATOM 273 O GLN A 19 14.454 7.570 -2.027 1.00 0.00 O ATOM 274 CB GLN A 19 16.713 7.005 -4.100 1.00 0.00 C ATOM 275 CG GLN A 19 16.283 8.473 -4.071 1.00 0.00 C ATOM 276 CD GLN A 19 17.212 9.259 -3.144 1.00 0.00 C ATOM 277 OE1 GLN A 19 17.592 8.778 -2.095 1.00 0.00 O ATOM 278 NE2 GLN A 19 17.596 10.457 -3.489 1.00 0.00 N ATOM 0 H GLN A 19 14.283 7.133 -4.938 1.00 0.00 H new ATOM 0 HA GLN A 19 15.916 5.092 -3.529 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.605 6.865 -3.490 1.00 0.00 H new ATOM 0 HB3 GLN A 19 16.973 6.712 -5.117 1.00 0.00 H new ATOM 0 HG2 GLN A 19 16.315 8.892 -5.077 1.00 0.00 H new ATOM 0 HG3 GLN A 19 15.253 8.554 -3.725 1.00 0.00 H new ATOM 0 HE21 GLN A 19 17.277 10.861 -4.370 1.00 0.00 H new ATOM 0 HE22 GLN A 19 18.215 10.990 -2.878 1.00 0.00 H new ATOM 287 N LEU A 20 15.596 5.907 -1.164 1.00 0.00 N ATOM 288 CA LEU A 20 15.220 6.313 0.217 1.00 0.00 C ATOM 289 C LEU A 20 16.357 5.986 1.176 1.00 0.00 C ATOM 290 O LEU A 20 16.140 5.451 2.243 1.00 0.00 O ATOM 291 CB LEU A 20 13.970 5.545 0.646 1.00 0.00 C ATOM 292 CG LEU A 20 13.439 6.110 1.964 1.00 0.00 C ATOM 293 CD1 LEU A 20 13.078 7.584 1.783 1.00 0.00 C ATOM 294 CD2 LEU A 20 12.192 5.330 2.382 1.00 0.00 C ATOM 0 H LEU A 20 16.192 5.082 -1.229 1.00 0.00 H new ATOM 0 HA LEU A 20 15.023 7.385 0.236 1.00 0.00 H new ATOM 0 HB2 LEU A 20 13.204 5.619 -0.126 1.00 0.00 H new ATOM 0 HB3 LEU A 20 14.205 4.487 0.762 1.00 0.00 H new ATOM 0 HG LEU A 20 14.206 6.018 2.733 1.00 0.00 H new ATOM 0 HD11 LEU A 20 12.700 7.984 2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 20 13.965 8.142 1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.311 7.679 1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 20 11.811 5.730 3.321 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.428 5.425 1.610 1.00 0.00 H new ATOM 0 HD23 LEU A 20 12.447 4.278 2.513 1.00 0.00 H new ATOM 306 N TYR A 21 17.571 6.300 0.822 1.00 0.00 N ATOM 307 CA TYR A 21 18.680 5.991 1.755 1.00 0.00 C ATOM 308 C TYR A 21 18.317 6.544 3.125 1.00 0.00 C ATOM 309 O TYR A 21 17.902 7.678 3.258 1.00 0.00 O ATOM 310 CB TYR A 21 19.984 6.635 1.288 1.00 0.00 C ATOM 311 CG TYR A 21 21.046 6.361 2.327 1.00 0.00 C ATOM 312 CD1 TYR A 21 21.037 7.062 3.541 1.00 0.00 C ATOM 313 CD2 TYR A 21 22.030 5.398 2.083 1.00 0.00 C ATOM 314 CE1 TYR A 21 22.015 6.801 4.509 1.00 0.00 C ATOM 315 CE2 TYR A 21 23.008 5.136 3.051 1.00 0.00 C ATOM 316 CZ TYR A 21 23.000 5.837 4.264 1.00 0.00 C ATOM 317 OH TYR A 21 23.964 5.579 5.216 1.00 0.00 O ATOM 0 H TYR A 21 17.837 6.748 -0.055 1.00 0.00 H new ATOM 0 HA TYR A 21 18.825 4.911 1.793 1.00 0.00 H new ATOM 0 HB2 TYR A 21 20.284 6.229 0.322 1.00 0.00 H new ATOM 0 HB3 TYR A 21 19.851 7.709 1.155 1.00 0.00 H new ATOM 0 HD1 TYR A 21 20.275 7.804 3.730 1.00 0.00 H new ATOM 0 HD2 TYR A 21 22.036 4.856 1.149 1.00 0.00 H new ATOM 0 HE1 TYR A 21 22.009 7.343 5.443 1.00 0.00 H new ATOM 0 HE2 TYR A 21 23.769 4.393 2.862 1.00 0.00 H new ATOM 0 HH TYR A 21 24.570 4.882 4.888 1.00 0.00 H new ATOM 327 N ILE A 22 18.464 5.758 4.146 1.00 0.00 N ATOM 328 CA ILE A 22 18.119 6.249 5.503 1.00 0.00 C ATOM 329 C ILE A 22 19.344 6.151 6.406 1.00 0.00 C ATOM 330 O ILE A 22 19.843 5.076 6.675 1.00 0.00 O ATOM 331 CB ILE A 22 16.991 5.396 6.083 1.00 0.00 C ATOM 332 CG1 ILE A 22 15.787 5.435 5.138 1.00 0.00 C ATOM 333 CG2 ILE A 22 16.584 5.949 7.450 1.00 0.00 C ATOM 334 CD1 ILE A 22 14.568 4.834 5.841 1.00 0.00 C ATOM 0 H ILE A 22 18.807 4.799 4.102 1.00 0.00 H new ATOM 0 HA ILE A 22 17.794 7.288 5.441 1.00 0.00 H new ATOM 0 HB ILE A 22 17.333 4.367 6.195 1.00 0.00 H new ATOM 0 HG12 ILE A 22 15.578 6.462 4.840 1.00 0.00 H new ATOM 0 HG13 ILE A 22 16.007 4.877 4.228 1.00 0.00 H new ATOM 0 HG21 ILE A 22 15.780 5.341 7.864 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.441 5.923 8.123 1.00 0.00 H new ATOM 0 HG23 ILE A 22 16.241 6.978 7.339 1.00 0.00 H new ATOM 0 HD11 ILE A 22 13.710 4.861 5.169 1.00 0.00 H new ATOM 0 HD12 ILE A 22 14.780 3.801 6.117 1.00 0.00 H new ATOM 0 HD13 ILE A 22 14.344 5.411 6.738 1.00 0.00 H new ATOM 346 N ASP A 23 19.822 7.259 6.895 1.00 0.00 N ATOM 347 CA ASP A 23 20.998 7.213 7.797 1.00 0.00 C ATOM 348 C ASP A 23 20.487 6.904 9.196 1.00 0.00 C ATOM 349 O ASP A 23 20.135 7.786 9.943 1.00 0.00 O ATOM 350 CB ASP A 23 21.725 8.559 7.780 1.00 0.00 C ATOM 351 CG ASP A 23 22.774 8.596 8.895 1.00 0.00 C ATOM 352 OD1 ASP A 23 22.926 7.592 9.572 1.00 0.00 O ATOM 353 OD2 ASP A 23 23.409 9.625 9.050 1.00 0.00 O ATOM 0 H ASP A 23 19.449 8.190 6.709 1.00 0.00 H new ATOM 0 HA ASP A 23 21.704 6.449 7.473 1.00 0.00 H new ATOM 0 HB2 ASP A 23 22.204 8.712 6.813 1.00 0.00 H new ATOM 0 HB3 ASP A 23 21.010 9.371 7.914 1.00 0.00 H new ATOM 358 N PHE A 24 20.420 5.636 9.514 1.00 0.00 N ATOM 359 CA PHE A 24 19.910 5.165 10.841 1.00 0.00 C ATOM 360 C PHE A 24 19.758 6.311 11.848 1.00 0.00 C ATOM 361 O PHE A 24 18.693 6.533 12.382 1.00 0.00 O ATOM 362 CB PHE A 24 20.880 4.125 11.406 1.00 0.00 C ATOM 363 CG PHE A 24 20.589 2.781 10.784 1.00 0.00 C ATOM 364 CD1 PHE A 24 19.457 2.058 11.179 1.00 0.00 C ATOM 365 CD2 PHE A 24 21.448 2.258 9.809 1.00 0.00 C ATOM 366 CE1 PHE A 24 19.183 0.815 10.600 1.00 0.00 C ATOM 367 CE2 PHE A 24 21.174 1.013 9.231 1.00 0.00 C ATOM 368 CZ PHE A 24 20.042 0.292 9.626 1.00 0.00 C ATOM 0 H PHE A 24 20.707 4.883 8.889 1.00 0.00 H new ATOM 0 HA PHE A 24 18.922 4.733 10.683 1.00 0.00 H new ATOM 0 HB2 PHE A 24 21.909 4.420 11.198 1.00 0.00 H new ATOM 0 HB3 PHE A 24 20.778 4.067 12.490 1.00 0.00 H new ATOM 0 HD1 PHE A 24 18.795 2.461 11.931 1.00 0.00 H new ATOM 0 HD2 PHE A 24 22.321 2.815 9.503 1.00 0.00 H new ATOM 0 HE1 PHE A 24 18.309 0.258 10.904 1.00 0.00 H new ATOM 0 HE2 PHE A 24 21.837 0.609 8.480 1.00 0.00 H new ATOM 0 HZ PHE A 24 19.831 -0.668 9.179 1.00 0.00 H new ATOM 378 N ARG A 25 20.813 7.025 12.127 1.00 0.00 N ATOM 379 CA ARG A 25 20.722 8.131 13.126 1.00 0.00 C ATOM 380 C ARG A 25 20.136 9.409 12.507 1.00 0.00 C ATOM 381 O ARG A 25 19.329 10.083 13.117 1.00 0.00 O ATOM 382 CB ARG A 25 22.121 8.433 13.664 1.00 0.00 C ATOM 383 CG ARG A 25 22.015 9.385 14.857 1.00 0.00 C ATOM 384 CD ARG A 25 23.403 9.926 15.202 1.00 0.00 C ATOM 385 NE ARG A 25 23.478 10.214 16.662 1.00 0.00 N ATOM 386 CZ ARG A 25 22.993 11.329 17.135 1.00 0.00 C ATOM 387 NH1 ARG A 25 21.781 11.699 16.823 1.00 0.00 N ATOM 388 NH2 ARG A 25 23.719 12.073 17.924 1.00 0.00 N ATOM 0 H ARG A 25 21.734 6.892 11.708 1.00 0.00 H new ATOM 0 HA ARG A 25 20.059 7.809 13.929 1.00 0.00 H new ATOM 0 HB2 ARG A 25 22.613 7.509 13.966 1.00 0.00 H new ATOM 0 HB3 ARG A 25 22.734 8.880 12.882 1.00 0.00 H new ATOM 0 HG2 ARG A 25 21.341 10.208 14.620 1.00 0.00 H new ATOM 0 HG3 ARG A 25 21.592 8.863 15.716 1.00 0.00 H new ATOM 0 HD2 ARG A 25 24.167 9.200 14.925 1.00 0.00 H new ATOM 0 HD3 ARG A 25 23.603 10.833 14.631 1.00 0.00 H new ATOM 0 HE ARG A 25 23.909 9.538 17.293 1.00 0.00 H new ATOM 0 HH11 ARG A 25 21.212 11.116 16.209 1.00 0.00 H new ATOM 0 HH12 ARG A 25 21.403 12.571 17.193 1.00 0.00 H new ATOM 0 HH21 ARG A 25 24.665 11.783 18.171 1.00 0.00 H new ATOM 0 HH22 ARG A 25 23.340 12.945 18.294 1.00 0.00 H new ATOM 402 N LYS A 26 20.553 9.772 11.327 1.00 0.00 N ATOM 403 CA LYS A 26 20.036 11.032 10.710 1.00 0.00 C ATOM 404 C LYS A 26 18.526 10.954 10.479 1.00 0.00 C ATOM 405 O LYS A 26 17.793 11.874 10.785 1.00 0.00 O ATOM 406 CB LYS A 26 20.715 11.245 9.362 1.00 0.00 C ATOM 407 CG LYS A 26 20.859 12.745 9.092 1.00 0.00 C ATOM 408 CD LYS A 26 22.010 13.308 9.927 1.00 0.00 C ATOM 409 CE LYS A 26 22.958 14.096 9.021 1.00 0.00 C ATOM 410 NZ LYS A 26 23.955 14.822 9.858 1.00 0.00 N ATOM 0 H LYS A 26 21.227 9.255 10.762 1.00 0.00 H new ATOM 0 HA LYS A 26 20.250 11.856 11.391 1.00 0.00 H new ATOM 0 HB2 LYS A 26 21.695 10.769 9.358 1.00 0.00 H new ATOM 0 HB3 LYS A 26 20.130 10.777 8.570 1.00 0.00 H new ATOM 0 HG2 LYS A 26 21.047 12.918 8.032 1.00 0.00 H new ATOM 0 HG3 LYS A 26 19.931 13.260 9.339 1.00 0.00 H new ATOM 0 HD2 LYS A 26 21.621 13.954 10.714 1.00 0.00 H new ATOM 0 HD3 LYS A 26 22.548 12.497 10.418 1.00 0.00 H new ATOM 0 HE2 LYS A 26 23.467 13.420 8.334 1.00 0.00 H new ATOM 0 HE3 LYS A 26 22.394 14.803 8.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 24.600 15.358 9.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 23.461 15.477 10.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 24.501 14.138 10.419 1.00 0.00 H new ATOM 424 N ASP A 27 18.065 9.890 9.891 1.00 0.00 N ATOM 425 CA ASP A 27 16.615 9.773 9.580 1.00 0.00 C ATOM 426 C ASP A 27 15.828 9.146 10.738 1.00 0.00 C ATOM 427 O ASP A 27 14.947 9.766 11.300 1.00 0.00 O ATOM 428 CB ASP A 27 16.469 8.900 8.339 1.00 0.00 C ATOM 429 CG ASP A 27 16.489 9.782 7.090 1.00 0.00 C ATOM 430 OD1 ASP A 27 15.612 10.621 6.967 1.00 0.00 O ATOM 431 OD2 ASP A 27 17.380 9.603 6.276 1.00 0.00 O ATOM 0 H ASP A 27 18.633 9.091 9.610 1.00 0.00 H new ATOM 0 HA ASP A 27 16.210 10.771 9.414 1.00 0.00 H new ATOM 0 HB2 ASP A 27 17.279 8.172 8.296 1.00 0.00 H new ATOM 0 HB3 ASP A 27 15.537 8.337 8.385 1.00 0.00 H new ATOM 436 N LEU A 28 16.104 7.918 11.080 1.00 0.00 N ATOM 437 CA LEU A 28 15.329 7.264 12.178 1.00 0.00 C ATOM 438 C LEU A 28 15.969 7.546 13.537 1.00 0.00 C ATOM 439 O LEU A 28 15.391 7.268 14.569 1.00 0.00 O ATOM 440 CB LEU A 28 15.306 5.752 11.952 1.00 0.00 C ATOM 441 CG LEU A 28 14.811 5.450 10.538 1.00 0.00 C ATOM 442 CD1 LEU A 28 14.986 3.959 10.250 1.00 0.00 C ATOM 443 CD2 LEU A 28 13.331 5.815 10.428 1.00 0.00 C ATOM 0 H LEU A 28 16.827 7.340 10.652 1.00 0.00 H new ATOM 0 HA LEU A 28 14.316 7.667 12.171 1.00 0.00 H new ATOM 0 HB2 LEU A 28 16.304 5.338 12.094 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.656 5.275 12.685 1.00 0.00 H new ATOM 0 HG LEU A 28 15.385 6.034 9.818 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.634 3.739 9.242 1.00 0.00 H new ATOM 0 HD12 LEU A 28 16.040 3.694 10.332 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.409 3.379 10.970 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.977 5.600 9.420 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.757 5.229 11.146 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.201 6.876 10.639 1.00 0.00 H new ATOM 455 N GLY A 29 17.156 8.081 13.560 1.00 0.00 N ATOM 456 CA GLY A 29 17.812 8.357 14.871 1.00 0.00 C ATOM 457 C GLY A 29 18.014 7.035 15.618 1.00 0.00 C ATOM 458 O GLY A 29 18.326 7.015 16.793 1.00 0.00 O ATOM 0 H GLY A 29 17.699 8.338 12.736 1.00 0.00 H new ATOM 0 HA2 GLY A 29 18.771 8.851 14.715 1.00 0.00 H new ATOM 0 HA3 GLY A 29 17.197 9.034 15.464 1.00 0.00 H new ATOM 462 N TRP A 30 17.834 5.929 14.945 1.00 0.00 N ATOM 463 CA TRP A 30 18.007 4.606 15.604 1.00 0.00 C ATOM 464 C TRP A 30 19.278 4.612 16.452 1.00 0.00 C ATOM 465 O TRP A 30 20.360 4.882 15.969 1.00 0.00 O ATOM 466 CB TRP A 30 18.115 3.519 14.533 1.00 0.00 C ATOM 467 CG TRP A 30 16.745 3.032 14.185 1.00 0.00 C ATOM 468 CD1 TRP A 30 15.594 3.659 14.516 1.00 0.00 C ATOM 469 CD2 TRP A 30 16.362 1.834 13.449 1.00 0.00 C ATOM 470 NE1 TRP A 30 14.530 2.921 14.032 1.00 0.00 N ATOM 471 CE2 TRP A 30 14.951 1.788 13.368 1.00 0.00 C ATOM 472 CE3 TRP A 30 17.095 0.793 12.852 1.00 0.00 C ATOM 473 CZ2 TRP A 30 14.289 0.747 12.718 1.00 0.00 C ATOM 474 CZ3 TRP A 30 16.431 -0.258 12.196 1.00 0.00 C ATOM 475 CH2 TRP A 30 15.031 -0.281 12.130 1.00 0.00 C ATOM 0 H TRP A 30 17.573 5.888 13.960 1.00 0.00 H new ATOM 0 HA TRP A 30 17.149 4.407 16.246 1.00 0.00 H new ATOM 0 HB2 TRP A 30 18.609 3.914 13.646 1.00 0.00 H new ATOM 0 HB3 TRP A 30 18.726 2.693 14.897 1.00 0.00 H new ATOM 0 HD1 TRP A 30 15.518 4.584 15.068 1.00 0.00 H new ATOM 0 HE1 TRP A 30 13.551 3.183 14.152 1.00 0.00 H new ATOM 0 HE3 TRP A 30 18.174 0.801 12.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 13.210 0.735 12.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 17.003 -1.053 11.740 1.00 0.00 H new ATOM 0 HH2 TRP A 30 14.527 -1.092 11.626 1.00 0.00 H new ATOM 486 N LYS A 31 19.151 4.320 17.715 1.00 0.00 N ATOM 487 CA LYS A 31 20.333 4.309 18.603 1.00 0.00 C ATOM 488 C LYS A 31 20.738 2.864 18.897 1.00 0.00 C ATOM 489 O LYS A 31 21.790 2.605 19.447 1.00 0.00 O ATOM 490 CB LYS A 31 19.956 5.001 19.906 1.00 0.00 C ATOM 491 CG LYS A 31 20.271 6.495 19.805 1.00 0.00 C ATOM 492 CD LYS A 31 20.129 7.141 21.185 1.00 0.00 C ATOM 493 CE LYS A 31 18.964 8.133 21.168 1.00 0.00 C ATOM 494 NZ LYS A 31 18.911 8.859 22.468 1.00 0.00 N ATOM 0 H LYS A 31 18.268 4.087 18.170 1.00 0.00 H new ATOM 0 HA LYS A 31 21.167 4.824 18.126 1.00 0.00 H new ATOM 0 HB2 LYS A 31 18.896 4.856 20.113 1.00 0.00 H new ATOM 0 HB3 LYS A 31 20.506 4.559 20.737 1.00 0.00 H new ATOM 0 HG2 LYS A 31 21.283 6.639 19.427 1.00 0.00 H new ATOM 0 HG3 LYS A 31 19.594 6.973 19.097 1.00 0.00 H new ATOM 0 HD2 LYS A 31 19.957 6.375 21.941 1.00 0.00 H new ATOM 0 HD3 LYS A 31 21.052 7.653 21.455 1.00 0.00 H new ATOM 0 HE2 LYS A 31 19.087 8.841 20.349 1.00 0.00 H new ATOM 0 HE3 LYS A 31 18.026 7.606 20.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 18.119 9.533 22.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 18.774 8.177 23.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 19.803 9.374 22.615 1.00 0.00 H new ATOM 508 N TRP A 32 19.910 1.918 18.543 1.00 0.00 N ATOM 509 CA TRP A 32 20.258 0.497 18.819 1.00 0.00 C ATOM 510 C TRP A 32 21.117 -0.057 17.686 1.00 0.00 C ATOM 511 O TRP A 32 21.563 -1.183 17.737 1.00 0.00 O ATOM 512 CB TRP A 32 18.982 -0.338 18.953 1.00 0.00 C ATOM 513 CG TRP A 32 18.377 -0.588 17.606 1.00 0.00 C ATOM 514 CD1 TRP A 32 17.638 0.302 16.911 1.00 0.00 C ATOM 515 CD2 TRP A 32 18.441 -1.791 16.785 1.00 0.00 C ATOM 516 NE1 TRP A 32 17.230 -0.279 15.728 1.00 0.00 N ATOM 517 CE2 TRP A 32 17.701 -1.568 15.601 1.00 0.00 C ATOM 518 CE3 TRP A 32 19.060 -3.041 16.952 1.00 0.00 C ATOM 519 CZ2 TRP A 32 17.576 -2.552 14.620 1.00 0.00 C ATOM 520 CZ3 TRP A 32 18.941 -4.034 15.966 1.00 0.00 C ATOM 521 CH2 TRP A 32 18.196 -3.789 14.803 1.00 0.00 C ATOM 0 H TRP A 32 19.014 2.067 18.078 1.00 0.00 H new ATOM 0 HA TRP A 32 20.818 0.446 19.753 1.00 0.00 H new ATOM 0 HB2 TRP A 32 19.210 -1.287 19.438 1.00 0.00 H new ATOM 0 HB3 TRP A 32 18.266 0.181 19.590 1.00 0.00 H new ATOM 0 HD1 TRP A 32 17.404 1.307 17.230 1.00 0.00 H new ATOM 0 HE1 TRP A 32 16.650 0.189 15.032 1.00 0.00 H new ATOM 0 HE3 TRP A 32 19.632 -3.240 17.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 17.003 -2.358 13.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 19.425 -4.990 16.104 1.00 0.00 H new ATOM 0 HH2 TRP A 32 18.102 -4.557 14.050 1.00 0.00 H new ATOM 532 N ILE A 33 21.352 0.719 16.667 1.00 0.00 N ATOM 533 CA ILE A 33 22.186 0.225 15.538 1.00 0.00 C ATOM 534 C ILE A 33 23.375 1.167 15.332 1.00 0.00 C ATOM 535 O ILE A 33 23.219 2.368 15.222 1.00 0.00 O ATOM 536 CB ILE A 33 21.326 0.151 14.269 1.00 0.00 C ATOM 537 CG1 ILE A 33 20.564 -1.172 14.274 1.00 0.00 C ATOM 538 CG2 ILE A 33 22.206 0.221 13.018 1.00 0.00 C ATOM 539 CD1 ILE A 33 19.593 -1.214 13.097 1.00 0.00 C ATOM 0 H ILE A 33 21.003 1.672 16.567 1.00 0.00 H new ATOM 0 HA ILE A 33 22.567 -0.771 15.763 1.00 0.00 H new ATOM 0 HB ILE A 33 20.633 0.992 14.255 1.00 0.00 H new ATOM 0 HG12 ILE A 33 21.264 -2.005 14.210 1.00 0.00 H new ATOM 0 HG13 ILE A 33 20.019 -1.285 15.211 1.00 0.00 H new ATOM 0 HG21 ILE A 33 21.579 0.167 12.128 1.00 0.00 H new ATOM 0 HG22 ILE A 33 22.760 1.160 13.015 1.00 0.00 H new ATOM 0 HG23 ILE A 33 22.907 -0.614 13.019 1.00 0.00 H new ATOM 0 HD11 ILE A 33 19.052 -2.160 13.105 1.00 0.00 H new ATOM 0 HD12 ILE A 33 18.884 -0.390 13.180 1.00 0.00 H new ATOM 0 HD13 ILE A 33 20.148 -1.122 12.164 1.00 0.00 H new ATOM 551 N HIS A 34 24.559 0.627 15.286 1.00 0.00 N ATOM 552 CA HIS A 34 25.768 1.478 15.093 1.00 0.00 C ATOM 553 C HIS A 34 26.128 1.526 13.605 1.00 0.00 C ATOM 554 O HIS A 34 26.267 2.585 13.025 1.00 0.00 O ATOM 555 CB HIS A 34 26.931 0.879 15.896 1.00 0.00 C ATOM 556 CG HIS A 34 28.244 1.414 15.386 1.00 0.00 C ATOM 557 ND1 HIS A 34 28.589 2.751 15.490 1.00 0.00 N ATOM 558 CD2 HIS A 34 29.303 0.799 14.766 1.00 0.00 C ATOM 559 CE1 HIS A 34 29.810 2.899 14.944 1.00 0.00 C ATOM 560 NE2 HIS A 34 30.291 1.739 14.487 1.00 0.00 N ATOM 0 H HIS A 34 24.744 -0.372 15.374 1.00 0.00 H new ATOM 0 HA HIS A 34 25.570 2.492 15.441 1.00 0.00 H new ATOM 0 HB2 HIS A 34 26.816 1.122 16.952 1.00 0.00 H new ATOM 0 HB3 HIS A 34 26.917 -0.208 15.815 1.00 0.00 H new ATOM 0 HD1 HIS A 34 28.021 3.489 15.905 1.00 0.00 H new ATOM 0 HD2 HIS A 34 29.361 -0.253 14.531 1.00 0.00 H new ATOM 0 HE1 HIS A 34 30.337 3.840 14.883 1.00 0.00 H new ATOM 568 N GLU A 35 26.288 0.390 12.983 1.00 0.00 N ATOM 569 CA GLU A 35 26.647 0.379 11.537 1.00 0.00 C ATOM 570 C GLU A 35 25.669 -0.513 10.766 1.00 0.00 C ATOM 571 O GLU A 35 25.068 -1.405 11.332 1.00 0.00 O ATOM 572 CB GLU A 35 28.069 -0.160 11.370 1.00 0.00 C ATOM 573 CG GLU A 35 29.071 0.979 11.564 1.00 0.00 C ATOM 574 CD GLU A 35 30.443 0.399 11.909 1.00 0.00 C ATOM 575 OE1 GLU A 35 30.489 -0.545 12.681 1.00 0.00 O ATOM 576 OE2 GLU A 35 31.426 0.908 11.398 1.00 0.00 O ATOM 0 H GLU A 35 26.186 -0.529 13.413 1.00 0.00 H new ATOM 0 HA GLU A 35 26.592 1.395 11.145 1.00 0.00 H new ATOM 0 HB2 GLU A 35 28.257 -0.952 12.095 1.00 0.00 H new ATOM 0 HB3 GLU A 35 28.189 -0.600 10.380 1.00 0.00 H new ATOM 0 HG2 GLU A 35 29.136 1.579 10.656 1.00 0.00 H new ATOM 0 HG3 GLU A 35 28.734 1.642 12.361 1.00 0.00 H new ATOM 583 N PRO A 36 25.543 -0.244 9.491 1.00 0.00 N ATOM 584 CA PRO A 36 26.281 0.843 8.819 1.00 0.00 C ATOM 585 C PRO A 36 25.634 2.196 9.124 1.00 0.00 C ATOM 586 O PRO A 36 24.578 2.270 9.720 1.00 0.00 O ATOM 587 CB PRO A 36 26.151 0.498 7.334 1.00 0.00 C ATOM 588 CG PRO A 36 24.904 -0.408 7.204 1.00 0.00 C ATOM 589 CD PRO A 36 24.647 -1.006 8.600 1.00 0.00 C ATOM 0 HA PRO A 36 27.318 0.923 9.144 1.00 0.00 H new ATOM 0 HB2 PRO A 36 26.039 1.401 6.734 1.00 0.00 H new ATOM 0 HB3 PRO A 36 27.043 -0.015 6.975 1.00 0.00 H new ATOM 0 HG2 PRO A 36 24.042 0.166 6.864 1.00 0.00 H new ATOM 0 HG3 PRO A 36 25.072 -1.196 6.470 1.00 0.00 H new ATOM 0 HD2 PRO A 36 23.604 -0.895 8.895 1.00 0.00 H new ATOM 0 HD3 PRO A 36 24.873 -2.072 8.624 1.00 0.00 H new ATOM 597 N LYS A 37 26.254 3.266 8.710 1.00 0.00 N ATOM 598 CA LYS A 37 25.680 4.606 8.962 1.00 0.00 C ATOM 599 C LYS A 37 24.232 4.634 8.477 1.00 0.00 C ATOM 600 O LYS A 37 23.373 5.250 9.077 1.00 0.00 O ATOM 601 CB LYS A 37 26.498 5.631 8.185 1.00 0.00 C ATOM 602 CG LYS A 37 27.636 6.156 9.061 1.00 0.00 C ATOM 603 CD LYS A 37 27.859 7.641 8.774 1.00 0.00 C ATOM 604 CE LYS A 37 26.590 8.424 9.117 1.00 0.00 C ATOM 605 NZ LYS A 37 26.960 9.692 9.806 1.00 0.00 N ATOM 0 H LYS A 37 27.140 3.264 8.205 1.00 0.00 H new ATOM 0 HA LYS A 37 25.705 4.836 10.027 1.00 0.00 H new ATOM 0 HB2 LYS A 37 26.903 5.177 7.280 1.00 0.00 H new ATOM 0 HB3 LYS A 37 25.859 6.456 7.869 1.00 0.00 H new ATOM 0 HG2 LYS A 37 27.395 6.011 10.114 1.00 0.00 H new ATOM 0 HG3 LYS A 37 28.550 5.595 8.863 1.00 0.00 H new ATOM 0 HD2 LYS A 37 28.699 8.014 9.361 1.00 0.00 H new ATOM 0 HD3 LYS A 37 28.115 7.785 7.724 1.00 0.00 H new ATOM 0 HE2 LYS A 37 26.028 8.642 8.209 1.00 0.00 H new ATOM 0 HE3 LYS A 37 25.942 7.825 9.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 26.098 10.225 10.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 27.479 9.473 10.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 27.562 10.264 9.180 1.00 0.00 H new ATOM 619 N GLY A 38 23.959 3.967 7.393 1.00 0.00 N ATOM 620 CA GLY A 38 22.569 3.944 6.856 1.00 0.00 C ATOM 621 C GLY A 38 22.441 2.816 5.833 1.00 0.00 C ATOM 622 O GLY A 38 23.071 1.784 5.951 1.00 0.00 O ATOM 0 H GLY A 38 24.640 3.434 6.852 1.00 0.00 H new ATOM 0 HA2 GLY A 38 21.856 3.797 7.667 1.00 0.00 H new ATOM 0 HA3 GLY A 38 22.331 4.901 6.391 1.00 0.00 H new ATOM 626 N TYR A 39 21.631 3.003 4.827 1.00 0.00 N ATOM 627 CA TYR A 39 21.464 1.939 3.798 1.00 0.00 C ATOM 628 C TYR A 39 20.452 2.402 2.747 1.00 0.00 C ATOM 629 O TYR A 39 19.857 3.452 2.871 1.00 0.00 O ATOM 630 CB TYR A 39 20.966 0.658 4.469 1.00 0.00 C ATOM 631 CG TYR A 39 19.514 0.812 4.850 1.00 0.00 C ATOM 632 CD1 TYR A 39 19.129 1.774 5.792 1.00 0.00 C ATOM 633 CD2 TYR A 39 18.555 -0.015 4.264 1.00 0.00 C ATOM 634 CE1 TYR A 39 17.781 1.907 6.145 1.00 0.00 C ATOM 635 CE2 TYR A 39 17.207 0.119 4.615 1.00 0.00 C ATOM 636 CZ TYR A 39 16.819 1.079 5.555 1.00 0.00 C ATOM 637 OH TYR A 39 15.490 1.210 5.903 1.00 0.00 O ATOM 0 H TYR A 39 21.078 3.846 4.674 1.00 0.00 H new ATOM 0 HA TYR A 39 22.421 1.743 3.314 1.00 0.00 H new ATOM 0 HB2 TYR A 39 21.086 -0.188 3.793 1.00 0.00 H new ATOM 0 HB3 TYR A 39 21.563 0.445 5.355 1.00 0.00 H new ATOM 0 HD1 TYR A 39 19.872 2.413 6.246 1.00 0.00 H new ATOM 0 HD2 TYR A 39 18.853 -0.758 3.540 1.00 0.00 H new ATOM 0 HE1 TYR A 39 17.483 2.648 6.872 1.00 0.00 H new ATOM 0 HE2 TYR A 39 16.465 -0.520 4.159 1.00 0.00 H new ATOM 0 HH TYR A 39 14.955 0.560 5.401 1.00 0.00 H new ATOM 647 N HIS A 40 20.250 1.628 1.715 1.00 0.00 N ATOM 648 CA HIS A 40 19.273 2.035 0.667 1.00 0.00 C ATOM 649 C HIS A 40 17.893 1.483 1.025 1.00 0.00 C ATOM 650 O HIS A 40 17.448 0.493 0.478 1.00 0.00 O ATOM 651 CB HIS A 40 19.714 1.477 -0.688 1.00 0.00 C ATOM 652 CG HIS A 40 21.083 2.000 -1.024 1.00 0.00 C ATOM 653 ND1 HIS A 40 22.224 1.550 -0.379 1.00 0.00 N ATOM 654 CD2 HIS A 40 21.510 2.936 -1.934 1.00 0.00 C ATOM 655 CE1 HIS A 40 23.274 2.210 -0.905 1.00 0.00 C ATOM 656 NE2 HIS A 40 22.893 3.066 -1.858 1.00 0.00 N ATOM 0 H HIS A 40 20.717 0.736 1.553 1.00 0.00 H new ATOM 0 HA HIS A 40 19.228 3.123 0.610 1.00 0.00 H new ATOM 0 HB2 HIS A 40 19.727 0.387 -0.658 1.00 0.00 H new ATOM 0 HB3 HIS A 40 19.003 1.766 -1.461 1.00 0.00 H new ATOM 0 HD2 HIS A 40 20.869 3.487 -2.606 1.00 0.00 H new ATOM 0 HE1 HIS A 40 24.298 2.065 -0.595 1.00 0.00 H new ATOM 0 HE2 HIS A 40 23.488 3.682 -2.411 1.00 0.00 H new ATOM 664 N ALA A 41 17.216 2.109 1.947 1.00 0.00 N ATOM 665 CA ALA A 41 15.869 1.616 2.352 1.00 0.00 C ATOM 666 C ALA A 41 14.930 1.598 1.143 1.00 0.00 C ATOM 667 O ALA A 41 14.077 0.740 1.026 1.00 0.00 O ATOM 668 CB ALA A 41 15.300 2.533 3.437 1.00 0.00 C ATOM 0 H ALA A 41 17.538 2.943 2.439 1.00 0.00 H new ATOM 0 HA ALA A 41 15.959 0.602 2.741 1.00 0.00 H new ATOM 0 HB1 ALA A 41 14.315 2.175 3.736 1.00 0.00 H new ATOM 0 HB2 ALA A 41 15.964 2.530 4.301 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.215 3.548 3.048 1.00 0.00 H new ATOM 674 N ASN A 42 15.075 2.529 0.242 1.00 0.00 N ATOM 675 CA ASN A 42 14.184 2.546 -0.952 1.00 0.00 C ATOM 676 C ASN A 42 12.723 2.544 -0.501 1.00 0.00 C ATOM 677 O ASN A 42 12.423 2.346 0.660 1.00 0.00 O ATOM 678 CB ASN A 42 14.445 1.301 -1.800 1.00 0.00 C ATOM 679 CG ASN A 42 15.642 1.548 -2.720 1.00 0.00 C ATOM 680 OD1 ASN A 42 16.686 2.178 -2.256 1.00 0.00 O flip ATOM 681 ND2 ASN A 42 15.625 1.166 -3.874 1.00 0.00 N flip ATOM 0 H ASN A 42 15.769 3.276 0.280 1.00 0.00 H new ATOM 0 HA ASN A 42 14.386 3.442 -1.539 1.00 0.00 H new ATOM 0 HB2 ASN A 42 14.640 0.444 -1.155 1.00 0.00 H new ATOM 0 HB3 ASN A 42 13.562 1.060 -2.392 1.00 0.00 H new ATOM 0 HD21 ASN A 42 14.809 0.673 -4.236 1.00 0.00 H new ATOM 0 HD22 ASN A 42 16.427 1.338 -4.480 1.00 0.00 H new ATOM 688 N PHE A 43 11.812 2.753 -1.410 1.00 0.00 N ATOM 689 CA PHE A 43 10.370 2.752 -1.033 1.00 0.00 C ATOM 690 C PHE A 43 9.521 3.038 -2.271 1.00 0.00 C ATOM 691 O PHE A 43 9.957 2.832 -3.380 1.00 0.00 O ATOM 692 CB PHE A 43 10.104 3.801 0.051 1.00 0.00 C ATOM 693 CG PHE A 43 10.192 5.201 -0.510 1.00 0.00 C ATOM 694 CD1 PHE A 43 11.272 5.586 -1.317 1.00 0.00 C ATOM 695 CD2 PHE A 43 9.192 6.125 -0.196 1.00 0.00 C ATOM 696 CE1 PHE A 43 11.346 6.896 -1.805 1.00 0.00 C ATOM 697 CE2 PHE A 43 9.267 7.429 -0.687 1.00 0.00 C ATOM 698 CZ PHE A 43 10.344 7.817 -1.490 1.00 0.00 C ATOM 0 H PHE A 43 12.003 2.924 -2.397 1.00 0.00 H new ATOM 0 HA PHE A 43 10.103 1.773 -0.634 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.116 3.640 0.481 1.00 0.00 H new ATOM 0 HB3 PHE A 43 10.826 3.684 0.859 1.00 0.00 H new ATOM 0 HD1 PHE A 43 12.046 4.873 -1.562 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.361 5.830 0.427 1.00 0.00 H new ATOM 0 HE1 PHE A 43 12.178 7.195 -2.425 1.00 0.00 H new ATOM 0 HE2 PHE A 43 8.491 8.141 -0.446 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.401 8.828 -1.866 1.00 0.00 H new ATOM 708 N CYS A 44 8.311 3.490 -2.105 1.00 0.00 N ATOM 709 CA CYS A 44 7.468 3.750 -3.308 1.00 0.00 C ATOM 710 C CYS A 44 6.621 5.009 -3.103 1.00 0.00 C ATOM 711 O CYS A 44 6.210 5.321 -2.003 1.00 0.00 O ATOM 712 CB CYS A 44 6.534 2.557 -3.552 1.00 0.00 C ATOM 713 SG CYS A 44 7.297 1.026 -2.948 1.00 0.00 S ATOM 0 H CYS A 44 7.873 3.689 -1.206 1.00 0.00 H new ATOM 0 HA CYS A 44 8.124 3.892 -4.167 1.00 0.00 H new ATOM 0 HB2 CYS A 44 5.583 2.722 -3.046 1.00 0.00 H new ATOM 0 HB3 CYS A 44 6.317 2.468 -4.617 1.00 0.00 H new ATOM 718 N LEU A 45 6.349 5.728 -4.160 1.00 0.00 N ATOM 719 CA LEU A 45 5.519 6.961 -4.034 1.00 0.00 C ATOM 720 C LEU A 45 4.672 7.137 -5.296 1.00 0.00 C ATOM 721 O LEU A 45 5.025 6.675 -6.362 1.00 0.00 O ATOM 722 CB LEU A 45 6.427 8.179 -3.869 1.00 0.00 C ATOM 723 CG LEU A 45 7.046 8.179 -2.475 1.00 0.00 C ATOM 724 CD1 LEU A 45 7.832 9.475 -2.277 1.00 0.00 C ATOM 725 CD2 LEU A 45 5.944 8.084 -1.418 1.00 0.00 C ATOM 0 H LEU A 45 6.666 5.514 -5.106 1.00 0.00 H new ATOM 0 HA LEU A 45 4.870 6.868 -3.163 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.212 8.164 -4.625 1.00 0.00 H new ATOM 0 HB3 LEU A 45 5.855 9.094 -4.022 1.00 0.00 H new ATOM 0 HG LEU A 45 7.713 7.323 -2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.277 9.482 -1.282 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.619 9.541 -3.028 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.160 10.327 -2.380 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.392 8.084 -0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.273 8.938 -1.514 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.381 7.162 -1.562 1.00 0.00 H new ATOM 737 N GLY A 46 3.559 7.810 -5.185 1.00 0.00 N ATOM 738 CA GLY A 46 2.694 8.024 -6.380 1.00 0.00 C ATOM 739 C GLY A 46 1.701 6.865 -6.521 1.00 0.00 C ATOM 740 O GLY A 46 2.017 5.738 -6.195 1.00 0.00 O ATOM 0 H GLY A 46 3.211 8.221 -4.319 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.155 8.967 -6.285 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.310 8.098 -7.277 1.00 0.00 H new ATOM 744 N PRO A 47 0.527 7.183 -7.008 1.00 0.00 N ATOM 745 CA PRO A 47 -0.545 6.193 -7.213 1.00 0.00 C ATOM 746 C PRO A 47 -0.292 5.401 -8.502 1.00 0.00 C ATOM 747 O PRO A 47 0.767 5.482 -9.090 1.00 0.00 O ATOM 748 CB PRO A 47 -1.804 7.054 -7.343 1.00 0.00 C ATOM 749 CG PRO A 47 -1.329 8.460 -7.779 1.00 0.00 C ATOM 750 CD PRO A 47 0.159 8.561 -7.396 1.00 0.00 C ATOM 0 HA PRO A 47 -0.616 5.460 -6.410 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -2.490 6.631 -8.077 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -2.341 7.102 -6.396 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.463 8.599 -8.852 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -1.910 9.237 -7.282 1.00 0.00 H new ATOM 0 HD2 PRO A 47 0.763 8.914 -8.232 1.00 0.00 H new ATOM 0 HD3 PRO A 47 0.312 9.261 -6.574 1.00 0.00 H new ATOM 758 N CYS A 48 -1.257 4.641 -8.950 1.00 0.00 N ATOM 759 CA CYS A 48 -1.060 3.859 -10.202 1.00 0.00 C ATOM 760 C CYS A 48 -2.374 3.783 -10.986 1.00 0.00 C ATOM 761 O CYS A 48 -3.442 3.798 -10.407 1.00 0.00 O ATOM 762 CB CYS A 48 -0.588 2.437 -9.870 1.00 0.00 C ATOM 763 SG CYS A 48 -1.325 1.877 -8.313 1.00 0.00 S ATOM 0 H CYS A 48 -2.168 4.529 -8.504 1.00 0.00 H new ATOM 0 HA CYS A 48 -0.303 4.359 -10.807 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -0.864 1.757 -10.676 1.00 0.00 H new ATOM 0 HB3 CYS A 48 0.499 2.416 -9.794 1.00 0.00 H new ATOM 768 N PRO A 49 -2.246 3.692 -12.286 1.00 0.00 N ATOM 769 CA PRO A 49 -3.402 3.596 -13.199 1.00 0.00 C ATOM 770 C PRO A 49 -4.077 2.221 -13.080 1.00 0.00 C ATOM 771 O PRO A 49 -3.989 1.565 -12.061 1.00 0.00 O ATOM 772 CB PRO A 49 -2.785 3.811 -14.587 1.00 0.00 C ATOM 773 CG PRO A 49 -1.284 3.471 -14.450 1.00 0.00 C ATOM 774 CD PRO A 49 -0.934 3.671 -12.966 1.00 0.00 C ATOM 0 HA PRO A 49 -4.186 4.321 -12.980 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -3.263 3.171 -15.329 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -2.922 4.840 -14.919 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -1.087 2.445 -14.762 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -0.678 4.119 -15.084 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -0.304 2.863 -12.593 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -0.388 4.601 -12.807 1.00 0.00 H new ATOM 782 N TYR A 50 -4.763 1.787 -14.106 1.00 0.00 N ATOM 783 CA TYR A 50 -5.454 0.460 -14.034 1.00 0.00 C ATOM 784 C TYR A 50 -4.634 -0.603 -14.768 1.00 0.00 C ATOM 785 O TYR A 50 -5.161 -1.596 -15.227 1.00 0.00 O ATOM 786 CB TYR A 50 -6.854 0.543 -14.667 1.00 0.00 C ATOM 787 CG TYR A 50 -6.987 1.799 -15.495 1.00 0.00 C ATOM 788 CD1 TYR A 50 -7.014 3.048 -14.865 1.00 0.00 C ATOM 789 CD2 TYR A 50 -7.079 1.715 -16.890 1.00 0.00 C ATOM 790 CE1 TYR A 50 -7.131 4.215 -15.629 1.00 0.00 C ATOM 791 CE2 TYR A 50 -7.197 2.882 -17.654 1.00 0.00 C ATOM 792 CZ TYR A 50 -7.222 4.132 -17.024 1.00 0.00 C ATOM 793 OH TYR A 50 -7.337 5.282 -17.776 1.00 0.00 O ATOM 0 H TYR A 50 -4.876 2.289 -14.987 1.00 0.00 H new ATOM 0 HA TYR A 50 -5.552 0.186 -12.984 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.029 -0.332 -15.293 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -7.614 0.533 -13.886 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -6.945 3.112 -13.789 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -7.059 0.751 -17.376 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -7.151 5.179 -15.143 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -7.269 2.818 -18.730 1.00 0.00 H new ATOM 0 HH TYR A 50 -7.388 5.048 -18.726 1.00 0.00 H new ATOM 803 N ILE A 51 -3.350 -0.410 -14.882 1.00 0.00 N ATOM 804 CA ILE A 51 -2.507 -1.419 -15.586 1.00 0.00 C ATOM 805 C ILE A 51 -1.120 -1.450 -14.945 1.00 0.00 C ATOM 806 O ILE A 51 -0.157 -1.891 -15.539 1.00 0.00 O ATOM 807 CB ILE A 51 -2.376 -1.034 -17.058 1.00 0.00 C ATOM 808 CG1 ILE A 51 -2.113 0.470 -17.164 1.00 0.00 C ATOM 809 CG2 ILE A 51 -3.672 -1.377 -17.795 1.00 0.00 C ATOM 810 CD1 ILE A 51 -1.274 0.756 -18.412 1.00 0.00 C ATOM 0 H ILE A 51 -2.848 0.400 -14.520 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.970 -2.402 -15.508 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.549 -1.584 -17.507 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.057 1.012 -17.216 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.592 0.822 -16.274 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.577 -1.102 -18.845 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -3.863 -2.447 -17.716 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -4.501 -0.827 -17.349 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -1.087 1.827 -18.487 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.324 0.226 -18.341 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -1.813 0.419 -19.298 1.00 0.00 H new ATOM 822 N TRP A 52 -1.017 -0.972 -13.741 1.00 0.00 N ATOM 823 CA TRP A 52 0.300 -0.951 -13.047 1.00 0.00 C ATOM 824 C TRP A 52 0.351 -2.053 -11.987 1.00 0.00 C ATOM 825 O TRP A 52 0.218 -1.802 -10.806 1.00 0.00 O ATOM 826 CB TRP A 52 0.477 0.408 -12.386 1.00 0.00 C ATOM 827 CG TRP A 52 1.820 0.966 -12.731 1.00 0.00 C ATOM 828 CD1 TRP A 52 2.579 1.701 -11.892 1.00 0.00 C ATOM 829 CD2 TRP A 52 2.576 0.855 -13.976 1.00 0.00 C ATOM 830 NE1 TRP A 52 3.753 2.047 -12.534 1.00 0.00 N ATOM 831 CE2 TRP A 52 3.801 1.548 -13.819 1.00 0.00 C ATOM 832 CE3 TRP A 52 2.327 0.229 -15.213 1.00 0.00 C ATOM 833 CZ2 TRP A 52 4.745 1.614 -14.845 1.00 0.00 C ATOM 834 CZ3 TRP A 52 3.274 0.295 -16.248 1.00 0.00 C ATOM 835 CH2 TRP A 52 4.480 0.986 -16.064 1.00 0.00 C ATOM 0 H TRP A 52 -1.794 -0.591 -13.201 1.00 0.00 H new ATOM 0 HA TRP A 52 1.100 -1.124 -13.767 1.00 0.00 H new ATOM 0 HB2 TRP A 52 -0.307 1.089 -12.718 1.00 0.00 H new ATOM 0 HB3 TRP A 52 0.379 0.312 -11.305 1.00 0.00 H new ATOM 0 HD1 TRP A 52 2.312 1.975 -10.882 1.00 0.00 H new ATOM 0 HE1 TRP A 52 4.494 2.604 -12.109 1.00 0.00 H new ATOM 0 HE3 TRP A 52 1.401 -0.306 -15.367 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 5.673 2.146 -14.697 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 3.072 -0.190 -17.192 1.00 0.00 H new ATOM 0 HH2 TRP A 52 5.204 1.033 -16.864 1.00 0.00 H new ATOM 846 N SER A 53 0.553 -3.274 -12.404 1.00 0.00 N ATOM 847 CA SER A 53 0.624 -4.399 -11.429 1.00 0.00 C ATOM 848 C SER A 53 -0.468 -4.240 -10.371 1.00 0.00 C ATOM 849 O SER A 53 -0.200 -3.912 -9.232 1.00 0.00 O ATOM 850 CB SER A 53 1.994 -4.394 -10.751 1.00 0.00 C ATOM 851 OG SER A 53 3.009 -4.457 -11.745 1.00 0.00 O ATOM 0 H SER A 53 0.672 -3.541 -13.381 1.00 0.00 H new ATOM 0 HA SER A 53 0.477 -5.342 -11.956 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.112 -3.492 -10.150 1.00 0.00 H new ATOM 0 HB3 SER A 53 2.080 -5.243 -10.072 1.00 0.00 H new ATOM 0 HG SER A 53 3.889 -4.452 -11.314 1.00 0.00 H new ATOM 857 N LEU A 54 -1.699 -4.478 -10.732 1.00 0.00 N ATOM 858 CA LEU A 54 -2.804 -4.347 -9.741 1.00 0.00 C ATOM 859 C LEU A 54 -2.946 -5.666 -8.977 1.00 0.00 C ATOM 860 O LEU A 54 -2.997 -6.729 -9.561 1.00 0.00 O ATOM 861 CB LEU A 54 -4.109 -4.025 -10.471 1.00 0.00 C ATOM 862 CG LEU A 54 -3.992 -2.650 -11.133 1.00 0.00 C ATOM 863 CD1 LEU A 54 -5.057 -2.510 -12.222 1.00 0.00 C ATOM 864 CD2 LEU A 54 -4.197 -1.560 -10.078 1.00 0.00 C ATOM 0 H LEU A 54 -1.987 -4.757 -11.670 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.581 -3.542 -9.040 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.316 -4.787 -11.223 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.943 -4.034 -9.770 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.003 -2.547 -11.580 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.971 -1.530 -12.691 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -4.913 -3.286 -12.974 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.047 -2.614 -11.778 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.114 -0.580 -10.547 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.186 -1.667 -9.632 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.437 -1.657 -9.303 1.00 0.00 H new ATOM 876 N ASP A 55 -2.997 -5.606 -7.674 1.00 0.00 N ATOM 877 CA ASP A 55 -3.122 -6.859 -6.876 1.00 0.00 C ATOM 878 C ASP A 55 -4.594 -7.138 -6.564 1.00 0.00 C ATOM 879 O ASP A 55 -5.070 -8.245 -6.721 1.00 0.00 O ATOM 880 CB ASP A 55 -2.347 -6.703 -5.565 1.00 0.00 C ATOM 881 CG ASP A 55 -1.078 -7.558 -5.616 1.00 0.00 C ATOM 882 OD1 ASP A 55 -1.068 -8.525 -6.360 1.00 0.00 O ATOM 883 OD2 ASP A 55 -0.138 -7.231 -4.910 1.00 0.00 O ATOM 0 H ASP A 55 -2.958 -4.745 -7.128 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.715 -7.691 -7.451 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -2.087 -5.656 -5.407 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.970 -7.008 -4.724 1.00 0.00 H new ATOM 888 N THR A 56 -5.318 -6.150 -6.115 1.00 0.00 N ATOM 889 CA THR A 56 -6.755 -6.373 -5.786 1.00 0.00 C ATOM 890 C THR A 56 -7.640 -5.781 -6.886 1.00 0.00 C ATOM 891 O THR A 56 -7.163 -5.170 -7.821 1.00 0.00 O ATOM 892 CB THR A 56 -7.085 -5.700 -4.453 1.00 0.00 C ATOM 893 OG1 THR A 56 -7.458 -4.350 -4.686 1.00 0.00 O ATOM 894 CG2 THR A 56 -5.860 -5.744 -3.537 1.00 0.00 C ATOM 0 H THR A 56 -4.978 -5.200 -5.962 1.00 0.00 H new ATOM 0 HA THR A 56 -6.941 -7.444 -5.712 1.00 0.00 H new ATOM 0 HB THR A 56 -7.910 -6.228 -3.974 1.00 0.00 H new ATOM 0 HG1 THR A 56 -6.724 -3.880 -5.134 1.00 0.00 H new ATOM 0 HG21 THR A 56 -6.098 -5.264 -2.588 1.00 0.00 H new ATOM 0 HG22 THR A 56 -5.577 -6.781 -3.358 1.00 0.00 H new ATOM 0 HG23 THR A 56 -5.032 -5.218 -4.012 1.00 0.00 H new ATOM 902 N GLN A 57 -8.929 -5.956 -6.775 1.00 0.00 N ATOM 903 CA GLN A 57 -9.851 -5.404 -7.807 1.00 0.00 C ATOM 904 C GLN A 57 -10.130 -3.932 -7.504 1.00 0.00 C ATOM 905 O GLN A 57 -10.306 -3.128 -8.398 1.00 0.00 O ATOM 906 CB GLN A 57 -11.165 -6.187 -7.789 1.00 0.00 C ATOM 907 CG GLN A 57 -11.619 -6.455 -9.225 1.00 0.00 C ATOM 908 CD GLN A 57 -13.147 -6.429 -9.292 1.00 0.00 C ATOM 909 OE1 GLN A 57 -13.786 -5.714 -8.547 1.00 0.00 O ATOM 910 NE2 GLN A 57 -13.763 -7.184 -10.160 1.00 0.00 N ATOM 0 H GLN A 57 -9.384 -6.458 -6.013 1.00 0.00 H new ATOM 0 HA GLN A 57 -9.390 -5.492 -8.791 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -11.032 -7.129 -7.257 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -11.929 -5.623 -7.254 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -11.202 -5.703 -9.895 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -11.246 -7.423 -9.561 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -13.226 -7.784 -10.786 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -14.782 -7.174 -10.213 1.00 0.00 H new ATOM 919 N TYR A 58 -10.170 -3.569 -6.250 1.00 0.00 N ATOM 920 CA TYR A 58 -10.435 -2.146 -5.896 1.00 0.00 C ATOM 921 C TYR A 58 -9.251 -1.288 -6.363 1.00 0.00 C ATOM 922 O TYR A 58 -9.316 -0.076 -6.366 1.00 0.00 O ATOM 923 CB TYR A 58 -10.624 -2.025 -4.370 1.00 0.00 C ATOM 924 CG TYR A 58 -10.195 -0.656 -3.890 1.00 0.00 C ATOM 925 CD1 TYR A 58 -11.084 0.423 -3.947 1.00 0.00 C ATOM 926 CD2 TYR A 58 -8.899 -0.469 -3.395 1.00 0.00 C ATOM 927 CE1 TYR A 58 -10.677 1.688 -3.507 1.00 0.00 C ATOM 928 CE2 TYR A 58 -8.494 0.796 -2.958 1.00 0.00 C ATOM 929 CZ TYR A 58 -9.383 1.873 -3.014 1.00 0.00 C ATOM 930 OH TYR A 58 -8.981 3.121 -2.588 1.00 0.00 O ATOM 0 H TYR A 58 -10.031 -4.196 -5.457 1.00 0.00 H new ATOM 0 HA TYR A 58 -11.343 -1.797 -6.388 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -11.669 -2.196 -4.112 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -10.041 -2.794 -3.863 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -12.084 0.280 -4.330 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -8.212 -1.301 -3.351 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -11.363 2.521 -3.549 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -7.494 0.941 -2.577 1.00 0.00 H new ATOM 0 HH TYR A 58 -8.044 3.084 -2.304 1.00 0.00 H new ATOM 940 N SER A 59 -8.173 -1.909 -6.758 1.00 0.00 N ATOM 941 CA SER A 59 -6.994 -1.126 -7.222 1.00 0.00 C ATOM 942 C SER A 59 -7.254 -0.610 -8.639 1.00 0.00 C ATOM 943 O SER A 59 -6.644 0.342 -9.086 1.00 0.00 O ATOM 944 CB SER A 59 -5.754 -2.022 -7.222 1.00 0.00 C ATOM 945 OG SER A 59 -5.635 -2.656 -5.955 1.00 0.00 O ATOM 0 H SER A 59 -8.058 -2.922 -6.779 1.00 0.00 H new ATOM 0 HA SER A 59 -6.829 -0.282 -6.552 1.00 0.00 H new ATOM 0 HB2 SER A 59 -5.832 -2.770 -8.011 1.00 0.00 H new ATOM 0 HB3 SER A 59 -4.863 -1.430 -7.431 1.00 0.00 H new ATOM 0 HG SER A 59 -4.689 -2.709 -5.703 1.00 0.00 H new ATOM 951 N LYS A 60 -8.159 -1.227 -9.349 1.00 0.00 N ATOM 952 CA LYS A 60 -8.462 -0.771 -10.734 1.00 0.00 C ATOM 953 C LYS A 60 -9.544 0.308 -10.683 1.00 0.00 C ATOM 954 O LYS A 60 -9.445 1.334 -11.327 1.00 0.00 O ATOM 955 CB LYS A 60 -8.962 -1.955 -11.563 1.00 0.00 C ATOM 956 CG LYS A 60 -9.550 -1.444 -12.880 1.00 0.00 C ATOM 957 CD LYS A 60 -10.069 -2.626 -13.701 1.00 0.00 C ATOM 958 CE LYS A 60 -11.582 -2.755 -13.511 1.00 0.00 C ATOM 959 NZ LYS A 60 -12.168 -3.484 -14.672 1.00 0.00 N ATOM 0 H LYS A 60 -8.702 -2.029 -9.028 1.00 0.00 H new ATOM 0 HA LYS A 60 -7.560 -0.364 -11.191 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -8.142 -2.645 -11.762 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -9.717 -2.509 -11.006 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -10.360 -0.743 -12.681 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -8.790 -0.902 -13.443 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -9.835 -2.480 -14.756 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -9.573 -3.545 -13.389 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -11.799 -3.289 -12.586 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.034 -1.767 -13.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -13.196 -3.572 -14.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -11.972 -2.957 -15.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -11.745 -4.432 -14.736 1.00 0.00 H new ATOM 973 N VAL A 61 -10.579 0.085 -9.919 1.00 0.00 N ATOM 974 CA VAL A 61 -11.668 1.091 -9.821 1.00 0.00 C ATOM 975 C VAL A 61 -11.106 2.392 -9.246 1.00 0.00 C ATOM 976 O VAL A 61 -11.114 3.421 -9.888 1.00 0.00 O ATOM 977 CB VAL A 61 -12.764 0.548 -8.903 1.00 0.00 C ATOM 978 CG1 VAL A 61 -13.703 1.680 -8.488 1.00 0.00 C ATOM 979 CG2 VAL A 61 -13.561 -0.525 -9.647 1.00 0.00 C ATOM 0 H VAL A 61 -10.715 -0.755 -9.357 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.084 1.288 -10.809 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.306 0.117 -8.012 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -14.481 1.286 -7.834 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.137 2.446 -7.958 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -14.161 2.116 -9.375 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -14.343 -0.914 -8.995 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -14.014 -0.090 -10.538 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.894 -1.337 -9.939 1.00 0.00 H new ATOM 989 N LEU A 62 -10.620 2.354 -8.037 1.00 0.00 N ATOM 990 CA LEU A 62 -10.060 3.587 -7.418 1.00 0.00 C ATOM 991 C LEU A 62 -8.998 4.186 -8.345 1.00 0.00 C ATOM 992 O LEU A 62 -8.879 5.387 -8.470 1.00 0.00 O ATOM 993 CB LEU A 62 -9.438 3.225 -6.069 1.00 0.00 C ATOM 994 CG LEU A 62 -8.664 4.415 -5.496 1.00 0.00 C ATOM 995 CD1 LEU A 62 -9.584 5.263 -4.612 1.00 0.00 C ATOM 996 CD2 LEU A 62 -7.505 3.890 -4.657 1.00 0.00 C ATOM 0 H LEU A 62 -10.586 1.521 -7.450 1.00 0.00 H new ATOM 0 HA LEU A 62 -10.850 4.322 -7.267 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.219 2.923 -5.372 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -8.769 2.372 -6.188 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.289 5.031 -6.313 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.024 6.107 -4.209 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -10.420 5.632 -5.206 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.963 4.654 -3.791 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.946 4.729 -4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.893 3.276 -3.844 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.846 3.288 -5.283 1.00 0.00 H new ATOM 1008 N ALA A 63 -8.227 3.359 -9.003 1.00 0.00 N ATOM 1009 CA ALA A 63 -7.183 3.896 -9.921 1.00 0.00 C ATOM 1010 C ALA A 63 -7.816 4.956 -10.826 1.00 0.00 C ATOM 1011 O ALA A 63 -7.239 5.993 -11.083 1.00 0.00 O ATOM 1012 CB ALA A 63 -6.613 2.760 -10.776 1.00 0.00 C ATOM 0 H ALA A 63 -8.276 2.342 -8.944 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.375 4.342 -9.340 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.850 3.156 -11.446 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.170 2.004 -10.128 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.413 2.310 -11.363 1.00 0.00 H new ATOM 1018 N LEU A 64 -9.007 4.706 -11.298 1.00 0.00 N ATOM 1019 CA LEU A 64 -9.696 5.699 -12.174 1.00 0.00 C ATOM 1020 C LEU A 64 -10.273 6.810 -11.302 1.00 0.00 C ATOM 1021 O LEU A 64 -10.231 7.972 -11.644 1.00 0.00 O ATOM 1022 CB LEU A 64 -10.840 5.007 -12.916 1.00 0.00 C ATOM 1023 CG LEU A 64 -10.269 4.065 -13.969 1.00 0.00 C ATOM 1024 CD1 LEU A 64 -11.346 3.071 -14.396 1.00 0.00 C ATOM 1025 CD2 LEU A 64 -9.814 4.875 -15.184 1.00 0.00 C ATOM 0 H LEU A 64 -9.536 3.853 -11.114 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.988 6.114 -12.891 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.459 4.450 -12.213 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.483 5.750 -13.388 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.418 3.525 -13.553 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.940 2.396 -15.149 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.673 2.495 -13.531 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -12.195 3.612 -14.813 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.405 4.202 -15.938 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -10.665 5.414 -15.601 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.047 5.587 -14.880 1.00 0.00 H new ATOM 1037 N TYR A 65 -10.817 6.452 -10.176 1.00 0.00 N ATOM 1038 CA TYR A 65 -11.407 7.474 -9.264 1.00 0.00 C ATOM 1039 C TYR A 65 -10.431 8.643 -9.100 1.00 0.00 C ATOM 1040 O TYR A 65 -10.829 9.775 -8.914 1.00 0.00 O ATOM 1041 CB TYR A 65 -11.670 6.822 -7.906 1.00 0.00 C ATOM 1042 CG TYR A 65 -12.177 7.851 -6.927 1.00 0.00 C ATOM 1043 CD1 TYR A 65 -11.270 8.583 -6.152 1.00 0.00 C ATOM 1044 CD2 TYR A 65 -13.555 8.066 -6.785 1.00 0.00 C ATOM 1045 CE1 TYR A 65 -11.737 9.529 -5.233 1.00 0.00 C ATOM 1046 CE2 TYR A 65 -14.022 9.015 -5.865 1.00 0.00 C ATOM 1047 CZ TYR A 65 -13.112 9.745 -5.089 1.00 0.00 C ATOM 1048 OH TYR A 65 -13.573 10.678 -4.183 1.00 0.00 O ATOM 0 H TYR A 65 -10.880 5.490 -9.844 1.00 0.00 H new ATOM 0 HA TYR A 65 -12.341 7.852 -9.680 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -12.401 6.020 -8.014 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.754 6.369 -7.528 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -10.209 8.417 -6.264 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -14.255 7.502 -7.383 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -11.036 10.092 -4.635 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -15.083 9.183 -5.754 1.00 0.00 H new ATOM 0 HH TYR A 65 -14.552 10.704 -4.210 1.00 0.00 H new ATOM 1058 N ASN A 66 -9.157 8.374 -9.172 1.00 0.00 N ATOM 1059 CA ASN A 66 -8.148 9.462 -9.027 1.00 0.00 C ATOM 1060 C ASN A 66 -7.720 9.939 -10.412 1.00 0.00 C ATOM 1061 O ASN A 66 -7.698 11.117 -10.704 1.00 0.00 O ATOM 1062 CB ASN A 66 -6.927 8.906 -8.311 1.00 0.00 C ATOM 1063 CG ASN A 66 -6.250 10.015 -7.504 1.00 0.00 C ATOM 1064 OD1 ASN A 66 -6.912 10.792 -6.842 1.00 0.00 O ATOM 1065 ND2 ASN A 66 -4.950 10.123 -7.529 1.00 0.00 N ATOM 0 H ASN A 66 -8.769 7.443 -9.326 1.00 0.00 H new ATOM 0 HA ASN A 66 -8.578 10.289 -8.463 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -7.221 8.091 -7.650 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.226 8.492 -9.036 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -4.489 10.859 -6.994 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -4.395 9.472 -8.084 1.00 0.00 H new ATOM 1072 N GLN A 67 -7.377 9.013 -11.266 1.00 0.00 N ATOM 1073 CA GLN A 67 -6.942 9.370 -12.646 1.00 0.00 C ATOM 1074 C GLN A 67 -7.987 10.260 -13.316 1.00 0.00 C ATOM 1075 O GLN A 67 -7.727 10.897 -14.318 1.00 0.00 O ATOM 1076 CB GLN A 67 -6.767 8.086 -13.458 1.00 0.00 C ATOM 1077 CG GLN A 67 -5.324 7.590 -13.336 1.00 0.00 C ATOM 1078 CD GLN A 67 -4.888 7.629 -11.869 1.00 0.00 C ATOM 1079 OE1 GLN A 67 -4.386 8.730 -11.380 1.00 0.00 O flip ATOM 1080 NE2 GLN A 67 -5.001 6.648 -11.162 1.00 0.00 N flip ATOM 0 H GLN A 67 -7.380 8.013 -11.063 1.00 0.00 H new ATOM 0 HA GLN A 67 -5.998 9.914 -12.598 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -7.456 7.321 -13.100 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -7.011 8.270 -14.504 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -5.245 6.574 -13.722 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -4.663 8.213 -13.939 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -5.393 5.787 -11.543 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.704 6.685 -10.187 1.00 0.00 H new ATOM 1089 N HIS A 68 -9.164 10.310 -12.769 1.00 0.00 N ATOM 1090 CA HIS A 68 -10.231 11.162 -13.367 1.00 0.00 C ATOM 1091 C HIS A 68 -10.172 12.563 -12.759 1.00 0.00 C ATOM 1092 O HIS A 68 -10.329 13.555 -13.443 1.00 0.00 O ATOM 1093 CB HIS A 68 -11.603 10.543 -13.086 1.00 0.00 C ATOM 1094 CG HIS A 68 -11.980 9.622 -14.213 1.00 0.00 C ATOM 1095 ND1 HIS A 68 -11.620 8.283 -14.233 1.00 0.00 N ATOM 1096 CD2 HIS A 68 -12.691 9.836 -15.366 1.00 0.00 C ATOM 1097 CE1 HIS A 68 -12.113 7.750 -15.366 1.00 0.00 C ATOM 1098 NE2 HIS A 68 -12.774 8.654 -16.093 1.00 0.00 N ATOM 0 H HIS A 68 -9.438 9.797 -11.931 1.00 0.00 H new ATOM 0 HA HIS A 68 -10.076 11.227 -14.444 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -11.579 9.993 -12.145 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -12.352 11.327 -12.978 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -11.081 7.792 -13.520 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -13.122 10.780 -15.664 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -11.989 6.716 -15.653 1.00 0.00 H new ATOM 1106 N ASN A 69 -9.950 12.654 -11.477 1.00 0.00 N ATOM 1107 CA ASN A 69 -9.883 13.992 -10.828 1.00 0.00 C ATOM 1108 C ASN A 69 -8.415 14.388 -10.619 1.00 0.00 C ATOM 1109 O ASN A 69 -7.681 13.685 -9.952 1.00 0.00 O ATOM 1110 CB ASN A 69 -10.588 13.930 -9.470 1.00 0.00 C ATOM 1111 CG ASN A 69 -12.100 13.829 -9.684 1.00 0.00 C ATOM 1112 OD1 ASN A 69 -12.785 14.831 -9.740 1.00 0.00 O ATOM 1113 ND2 ASN A 69 -12.652 12.653 -9.807 1.00 0.00 N ATOM 0 H ASN A 69 -9.812 11.860 -10.852 1.00 0.00 H new ATOM 0 HA ASN A 69 -10.372 14.730 -11.464 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -10.232 13.070 -8.902 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -10.351 14.818 -8.885 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -13.659 12.575 -9.950 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -12.077 11.812 -9.760 1.00 0.00 H new ATOM 1120 N PRO A 70 -8.027 15.502 -11.190 1.00 0.00 N ATOM 1121 CA PRO A 70 -6.649 16.009 -11.073 1.00 0.00 C ATOM 1122 C PRO A 70 -6.445 16.666 -9.705 1.00 0.00 C ATOM 1123 O PRO A 70 -6.685 17.844 -9.529 1.00 0.00 O ATOM 1124 CB PRO A 70 -6.546 17.042 -12.199 1.00 0.00 C ATOM 1125 CG PRO A 70 -7.995 17.475 -12.525 1.00 0.00 C ATOM 1126 CD PRO A 70 -8.918 16.359 -12.000 1.00 0.00 C ATOM 0 HA PRO A 70 -5.893 15.228 -11.154 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -5.945 17.897 -11.889 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -6.061 16.614 -13.076 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -8.231 18.428 -12.050 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -8.126 17.613 -13.598 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -9.733 16.765 -11.401 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -9.372 15.800 -12.818 1.00 0.00 H new ATOM 1134 N GLY A 71 -6.010 15.910 -8.735 1.00 0.00 N ATOM 1135 CA GLY A 71 -5.798 16.488 -7.378 1.00 0.00 C ATOM 1136 C GLY A 71 -6.680 15.750 -6.369 1.00 0.00 C ATOM 1137 O GLY A 71 -7.109 16.308 -5.379 1.00 0.00 O ATOM 0 H GLY A 71 -5.792 14.917 -8.823 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.749 16.401 -7.093 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -6.041 17.551 -7.381 1.00 0.00 H new ATOM 1141 N ALA A 72 -6.951 14.496 -6.610 1.00 0.00 N ATOM 1142 CA ALA A 72 -7.798 13.720 -5.670 1.00 0.00 C ATOM 1143 C ALA A 72 -6.902 13.007 -4.663 1.00 0.00 C ATOM 1144 O ALA A 72 -6.007 12.266 -5.019 1.00 0.00 O ATOM 1145 CB ALA A 72 -8.617 12.688 -6.443 1.00 0.00 C ATOM 0 H ALA A 72 -6.619 13.976 -7.422 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.476 14.396 -5.148 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.237 12.121 -5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.254 13.197 -7.166 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -7.945 12.008 -6.967 1.00 0.00 H new ATOM 1151 N SER A 73 -7.137 13.235 -3.409 1.00 0.00 N ATOM 1152 CA SER A 73 -6.303 12.587 -2.357 1.00 0.00 C ATOM 1153 C SER A 73 -6.862 11.200 -2.027 1.00 0.00 C ATOM 1154 O SER A 73 -6.577 10.643 -0.985 1.00 0.00 O ATOM 1155 CB SER A 73 -6.314 13.451 -1.096 1.00 0.00 C ATOM 1156 OG SER A 73 -5.469 14.577 -1.290 1.00 0.00 O ATOM 0 H SER A 73 -7.875 13.846 -3.059 1.00 0.00 H new ATOM 0 HA SER A 73 -5.282 12.484 -2.724 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.330 13.778 -0.875 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.973 12.869 -0.240 1.00 0.00 H new ATOM 0 HG SER A 73 -5.476 15.134 -0.484 1.00 0.00 H new ATOM 1162 N ALA A 74 -7.649 10.632 -2.900 1.00 0.00 N ATOM 1163 CA ALA A 74 -8.209 9.280 -2.616 1.00 0.00 C ATOM 1164 C ALA A 74 -7.717 8.287 -3.670 1.00 0.00 C ATOM 1165 O ALA A 74 -8.484 7.552 -4.257 1.00 0.00 O ATOM 1166 CB ALA A 74 -9.738 9.336 -2.632 1.00 0.00 C ATOM 0 H ALA A 74 -7.927 11.042 -3.792 1.00 0.00 H new ATOM 0 HA ALA A 74 -7.875 8.954 -1.631 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.141 8.345 -2.424 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.084 10.036 -1.871 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -10.080 9.668 -3.612 1.00 0.00 H new ATOM 1172 N ALA A 75 -6.436 8.260 -3.904 1.00 0.00 N ATOM 1173 CA ALA A 75 -5.867 7.316 -4.908 1.00 0.00 C ATOM 1174 C ALA A 75 -5.502 6.004 -4.199 1.00 0.00 C ATOM 1175 O ALA A 75 -5.783 5.849 -3.027 1.00 0.00 O ATOM 1176 CB ALA A 75 -4.620 7.948 -5.524 1.00 0.00 C ATOM 0 H ALA A 75 -5.751 8.856 -3.439 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.591 7.109 -5.696 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.193 7.267 -6.261 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.889 8.886 -6.010 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -3.886 8.142 -4.742 1.00 0.00 H new ATOM 1182 N PRO A 76 -4.883 5.095 -4.917 1.00 0.00 N ATOM 1183 CA PRO A 76 -4.476 3.798 -4.348 1.00 0.00 C ATOM 1184 C PRO A 76 -3.234 3.984 -3.483 1.00 0.00 C ATOM 1185 O PRO A 76 -2.928 5.080 -3.056 1.00 0.00 O ATOM 1186 CB PRO A 76 -4.174 2.937 -5.575 1.00 0.00 C ATOM 1187 CG PRO A 76 -3.877 3.920 -6.728 1.00 0.00 C ATOM 1188 CD PRO A 76 -4.528 5.262 -6.343 1.00 0.00 C ATOM 0 HA PRO A 76 -5.234 3.346 -3.708 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -3.321 2.283 -5.391 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -5.021 2.296 -5.819 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -2.803 4.037 -6.870 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.284 3.548 -7.668 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -3.840 6.095 -6.488 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.409 5.467 -6.952 1.00 0.00 H new ATOM 1196 N CYS A 77 -2.515 2.933 -3.208 1.00 0.00 N ATOM 1197 CA CYS A 77 -1.308 3.095 -2.357 1.00 0.00 C ATOM 1198 C CYS A 77 -0.192 2.148 -2.804 1.00 0.00 C ATOM 1199 O CYS A 77 -0.128 1.006 -2.394 1.00 0.00 O ATOM 1200 CB CYS A 77 -1.673 2.807 -0.904 1.00 0.00 C ATOM 1201 SG CYS A 77 -0.967 4.100 0.142 1.00 0.00 S ATOM 0 H CYS A 77 -2.707 1.984 -3.530 1.00 0.00 H new ATOM 0 HA CYS A 77 -0.948 4.119 -2.455 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -2.756 2.776 -0.786 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -1.292 1.830 -0.606 1.00 0.00 H new ATOM 1206 N CYS A 78 0.705 2.627 -3.624 1.00 0.00 N ATOM 1207 CA CYS A 78 1.839 1.772 -4.076 1.00 0.00 C ATOM 1208 C CYS A 78 2.608 1.301 -2.833 1.00 0.00 C ATOM 1209 O CYS A 78 2.745 2.035 -1.874 1.00 0.00 O ATOM 1210 CB CYS A 78 2.751 2.599 -4.990 1.00 0.00 C ATOM 1211 SG CYS A 78 4.178 1.612 -5.506 1.00 0.00 S ATOM 0 H CYS A 78 0.701 3.575 -4.000 1.00 0.00 H new ATOM 0 HA CYS A 78 1.479 0.906 -4.631 1.00 0.00 H new ATOM 0 HB2 CYS A 78 2.194 2.933 -5.866 1.00 0.00 H new ATOM 0 HB3 CYS A 78 3.088 3.494 -4.467 1.00 0.00 H new ATOM 1216 N VAL A 79 3.086 0.080 -2.815 1.00 0.00 N ATOM 1217 CA VAL A 79 3.804 -0.410 -1.602 1.00 0.00 C ATOM 1218 C VAL A 79 4.969 -1.337 -1.986 1.00 0.00 C ATOM 1219 O VAL A 79 5.047 -1.805 -3.099 1.00 0.00 O ATOM 1220 CB VAL A 79 2.799 -1.162 -0.722 1.00 0.00 C ATOM 1221 CG1 VAL A 79 1.458 -0.437 -0.771 1.00 0.00 C ATOM 1222 CG2 VAL A 79 2.604 -2.589 -1.242 1.00 0.00 C ATOM 0 H VAL A 79 3.010 -0.590 -3.580 1.00 0.00 H new ATOM 0 HA VAL A 79 4.224 0.438 -1.061 1.00 0.00 H new ATOM 0 HB VAL A 79 3.178 -1.199 0.299 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.736 -0.965 -0.148 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.581 0.581 -0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.097 -0.408 -1.799 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.888 -3.112 -0.608 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.227 -2.555 -2.264 1.00 0.00 H new ATOM 0 HG23 VAL A 79 3.558 -3.116 -1.224 1.00 0.00 H new ATOM 1232 N PRO A 80 5.843 -1.577 -1.036 1.00 0.00 N ATOM 1233 CA PRO A 80 7.020 -2.444 -1.233 1.00 0.00 C ATOM 1234 C PRO A 80 6.619 -3.921 -1.185 1.00 0.00 C ATOM 1235 O PRO A 80 6.554 -4.522 -0.131 1.00 0.00 O ATOM 1236 CB PRO A 80 7.930 -2.096 -0.052 1.00 0.00 C ATOM 1237 CG PRO A 80 7.016 -1.487 1.035 1.00 0.00 C ATOM 1238 CD PRO A 80 5.738 -1.006 0.324 1.00 0.00 C ATOM 0 HA PRO A 80 7.500 -2.290 -2.199 1.00 0.00 H new ATOM 0 HB2 PRO A 80 8.439 -2.984 0.321 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.703 -1.388 -0.352 1.00 0.00 H new ATOM 0 HG2 PRO A 80 6.778 -2.227 1.799 1.00 0.00 H new ATOM 0 HG3 PRO A 80 7.514 -0.658 1.538 1.00 0.00 H new ATOM 0 HD2 PRO A 80 4.842 -1.357 0.835 1.00 0.00 H new ATOM 0 HD3 PRO A 80 5.683 0.082 0.296 1.00 0.00 H new ATOM 1246 N GLN A 81 6.357 -4.513 -2.318 1.00 0.00 N ATOM 1247 CA GLN A 81 5.972 -5.949 -2.330 1.00 0.00 C ATOM 1248 C GLN A 81 7.173 -6.790 -1.894 1.00 0.00 C ATOM 1249 O GLN A 81 7.167 -7.400 -0.843 1.00 0.00 O ATOM 1250 CB GLN A 81 5.550 -6.344 -3.746 1.00 0.00 C ATOM 1251 CG GLN A 81 5.348 -7.858 -3.825 1.00 0.00 C ATOM 1252 CD GLN A 81 3.868 -8.191 -3.634 1.00 0.00 C ATOM 1253 OE1 GLN A 81 3.124 -7.405 -2.906 1.00 0.00 O flip ATOM 1254 NE2 GLN A 81 3.382 -9.175 -4.155 1.00 0.00 N flip ATOM 0 H GLN A 81 6.393 -4.064 -3.233 1.00 0.00 H new ATOM 0 HA GLN A 81 5.141 -6.120 -1.646 1.00 0.00 H new ATOM 0 HB2 GLN A 81 4.627 -5.831 -4.017 1.00 0.00 H new ATOM 0 HB3 GLN A 81 6.310 -6.032 -4.462 1.00 0.00 H new ATOM 0 HG2 GLN A 81 5.693 -8.231 -4.789 1.00 0.00 H new ATOM 0 HG3 GLN A 81 5.944 -8.355 -3.059 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.963 -9.790 -4.724 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.393 -9.386 -4.023 1.00 0.00 H new ATOM 1263 N ALA A 82 8.207 -6.822 -2.690 1.00 0.00 N ATOM 1264 CA ALA A 82 9.407 -7.618 -2.317 1.00 0.00 C ATOM 1265 C ALA A 82 10.331 -6.756 -1.457 1.00 0.00 C ATOM 1266 O ALA A 82 10.303 -5.543 -1.526 1.00 0.00 O ATOM 1267 CB ALA A 82 10.146 -8.058 -3.582 1.00 0.00 C ATOM 0 H ALA A 82 8.271 -6.331 -3.582 1.00 0.00 H new ATOM 0 HA ALA A 82 9.101 -8.501 -1.756 1.00 0.00 H new ATOM 0 HB1 ALA A 82 11.025 -8.641 -3.306 1.00 0.00 H new ATOM 0 HB2 ALA A 82 9.484 -8.668 -4.196 1.00 0.00 H new ATOM 0 HB3 ALA A 82 10.457 -7.179 -4.146 1.00 0.00 H new ATOM 1273 N LEU A 83 11.147 -7.366 -0.644 1.00 0.00 N ATOM 1274 CA LEU A 83 12.065 -6.572 0.218 1.00 0.00 C ATOM 1275 C LEU A 83 13.428 -7.246 0.275 1.00 0.00 C ATOM 1276 O LEU A 83 13.731 -8.149 -0.479 1.00 0.00 O ATOM 1277 CB LEU A 83 11.497 -6.493 1.636 1.00 0.00 C ATOM 1278 CG LEU A 83 10.172 -5.743 1.608 1.00 0.00 C ATOM 1279 CD1 LEU A 83 9.258 -6.281 2.707 1.00 0.00 C ATOM 1280 CD2 LEU A 83 10.431 -4.256 1.847 1.00 0.00 C ATOM 0 H LEU A 83 11.218 -8.378 -0.539 1.00 0.00 H new ATOM 0 HA LEU A 83 12.165 -5.570 -0.200 1.00 0.00 H new ATOM 0 HB2 LEU A 83 11.352 -7.496 2.038 1.00 0.00 H new ATOM 0 HB3 LEU A 83 12.202 -5.985 2.294 1.00 0.00 H new ATOM 0 HG LEU A 83 9.694 -5.882 0.638 1.00 0.00 H new ATOM 0 HD11 LEU A 83 8.310 -5.744 2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 83 9.077 -7.343 2.542 1.00 0.00 H new ATOM 0 HD13 LEU A 83 9.734 -6.140 3.677 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.485 -3.714 1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 83 10.907 -4.121 2.818 1.00 0.00 H new ATOM 0 HD23 LEU A 83 11.086 -3.871 1.065 1.00 0.00 H new ATOM 1292 N GLU A 84 14.243 -6.811 1.184 1.00 0.00 N ATOM 1293 CA GLU A 84 15.594 -7.406 1.337 1.00 0.00 C ATOM 1294 C GLU A 84 16.031 -7.239 2.791 1.00 0.00 C ATOM 1295 O GLU A 84 15.510 -6.397 3.495 1.00 0.00 O ATOM 1296 CB GLU A 84 16.583 -6.688 0.415 1.00 0.00 C ATOM 1297 CG GLU A 84 16.600 -7.376 -0.953 1.00 0.00 C ATOM 1298 CD GLU A 84 17.026 -8.835 -0.788 1.00 0.00 C ATOM 1299 OE1 GLU A 84 16.163 -9.659 -0.530 1.00 0.00 O ATOM 1300 OE2 GLU A 84 18.208 -9.105 -0.922 1.00 0.00 O ATOM 0 H GLU A 84 14.029 -6.058 1.838 1.00 0.00 H new ATOM 0 HA GLU A 84 15.570 -8.463 1.071 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.299 -5.642 0.304 1.00 0.00 H new ATOM 0 HB3 GLU A 84 17.581 -6.702 0.853 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.612 -7.325 -1.409 1.00 0.00 H new ATOM 0 HG3 GLU A 84 17.288 -6.859 -1.623 1.00 0.00 H new ATOM 1307 N PRO A 85 16.970 -8.043 3.200 1.00 0.00 N ATOM 1308 CA PRO A 85 17.491 -8.003 4.573 1.00 0.00 C ATOM 1309 C PRO A 85 18.396 -6.785 4.769 1.00 0.00 C ATOM 1310 O PRO A 85 18.335 -5.829 4.019 1.00 0.00 O ATOM 1311 CB PRO A 85 18.259 -9.319 4.709 1.00 0.00 C ATOM 1312 CG PRO A 85 18.595 -9.777 3.271 1.00 0.00 C ATOM 1313 CD PRO A 85 17.604 -9.058 2.337 1.00 0.00 C ATOM 0 HA PRO A 85 16.712 -7.907 5.329 1.00 0.00 H new ATOM 0 HB2 PRO A 85 19.168 -9.180 5.295 1.00 0.00 H new ATOM 0 HB3 PRO A 85 17.658 -10.068 5.225 1.00 0.00 H new ATOM 0 HG2 PRO A 85 19.623 -9.523 3.014 1.00 0.00 H new ATOM 0 HG3 PRO A 85 18.501 -10.859 3.177 1.00 0.00 H new ATOM 0 HD2 PRO A 85 18.115 -8.599 1.491 1.00 0.00 H new ATOM 0 HD3 PRO A 85 16.868 -9.750 1.928 1.00 0.00 H new ATOM 1321 N LEU A 86 19.211 -6.793 5.784 1.00 0.00 N ATOM 1322 CA LEU A 86 20.088 -5.619 6.043 1.00 0.00 C ATOM 1323 C LEU A 86 21.190 -6.006 7.046 1.00 0.00 C ATOM 1324 O LEU A 86 20.919 -6.219 8.206 1.00 0.00 O ATOM 1325 CB LEU A 86 19.195 -4.484 6.588 1.00 0.00 C ATOM 1326 CG LEU A 86 19.930 -3.626 7.625 1.00 0.00 C ATOM 1327 CD1 LEU A 86 21.077 -2.858 6.978 1.00 0.00 C ATOM 1328 CD2 LEU A 86 18.948 -2.629 8.243 1.00 0.00 C ATOM 0 H LEU A 86 19.308 -7.562 6.447 1.00 0.00 H new ATOM 0 HA LEU A 86 20.584 -5.284 5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.866 -3.853 5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 86 18.300 -4.911 7.039 1.00 0.00 H new ATOM 0 HG LEU A 86 20.337 -4.283 8.393 1.00 0.00 H new ATOM 0 HD11 LEU A 86 21.584 -2.257 7.733 1.00 0.00 H new ATOM 0 HD12 LEU A 86 21.785 -3.562 6.540 1.00 0.00 H new ATOM 0 HD13 LEU A 86 20.684 -2.206 6.198 1.00 0.00 H new ATOM 0 HD21 LEU A 86 19.467 -2.017 8.981 1.00 0.00 H new ATOM 0 HD22 LEU A 86 18.541 -1.988 7.462 1.00 0.00 H new ATOM 0 HD23 LEU A 86 18.136 -3.171 8.728 1.00 0.00 H new ATOM 1340 N PRO A 87 22.410 -6.080 6.563 1.00 0.00 N ATOM 1341 CA PRO A 87 23.571 -6.431 7.403 1.00 0.00 C ATOM 1342 C PRO A 87 23.956 -5.231 8.264 1.00 0.00 C ATOM 1343 O PRO A 87 24.374 -4.205 7.766 1.00 0.00 O ATOM 1344 CB PRO A 87 24.666 -6.764 6.387 1.00 0.00 C ATOM 1345 CG PRO A 87 24.265 -6.061 5.070 1.00 0.00 C ATOM 1346 CD PRO A 87 22.746 -5.814 5.149 1.00 0.00 C ATOM 0 HA PRO A 87 23.386 -7.258 8.089 1.00 0.00 H new ATOM 0 HB2 PRO A 87 25.638 -6.414 6.734 1.00 0.00 H new ATOM 0 HB3 PRO A 87 24.748 -7.841 6.243 1.00 0.00 H new ATOM 0 HG2 PRO A 87 24.805 -5.121 4.952 1.00 0.00 H new ATOM 0 HG3 PRO A 87 24.513 -6.681 4.209 1.00 0.00 H new ATOM 0 HD2 PRO A 87 22.493 -4.793 4.865 1.00 0.00 H new ATOM 0 HD3 PRO A 87 22.199 -6.476 4.478 1.00 0.00 H new ATOM 1354 N ILE A 88 23.796 -5.341 9.553 1.00 0.00 N ATOM 1355 CA ILE A 88 24.129 -4.192 10.435 1.00 0.00 C ATOM 1356 C ILE A 88 25.095 -4.621 11.532 1.00 0.00 C ATOM 1357 O ILE A 88 25.738 -5.649 11.461 1.00 0.00 O ATOM 1358 CB ILE A 88 22.845 -3.674 11.088 1.00 0.00 C ATOM 1359 CG1 ILE A 88 22.448 -4.598 12.247 1.00 0.00 C ATOM 1360 CG2 ILE A 88 21.730 -3.666 10.053 1.00 0.00 C ATOM 1361 CD1 ILE A 88 21.046 -4.251 12.741 1.00 0.00 C ATOM 0 H ILE A 88 23.451 -6.173 10.031 1.00 0.00 H new ATOM 0 HA ILE A 88 24.596 -3.412 9.833 1.00 0.00 H new ATOM 0 HB ILE A 88 23.010 -2.665 11.467 1.00 0.00 H new ATOM 0 HG12 ILE A 88 22.480 -5.637 11.920 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.164 -4.498 13.063 1.00 0.00 H new ATOM 0 HG21 ILE A 88 20.812 -3.298 10.510 1.00 0.00 H new ATOM 0 HG22 ILE A 88 22.008 -3.016 9.224 1.00 0.00 H new ATOM 0 HG23 ILE A 88 21.570 -4.679 9.682 1.00 0.00 H new ATOM 0 HD11 ILE A 88 20.776 -4.913 13.563 1.00 0.00 H new ATOM 0 HD12 ILE A 88 21.027 -3.217 13.087 1.00 0.00 H new ATOM 0 HD13 ILE A 88 20.332 -4.374 11.926 1.00 0.00 H new ATOM 1373 N VAL A 89 25.158 -3.828 12.558 1.00 0.00 N ATOM 1374 CA VAL A 89 26.033 -4.128 13.717 1.00 0.00 C ATOM 1375 C VAL A 89 25.583 -3.256 14.883 1.00 0.00 C ATOM 1376 O VAL A 89 25.732 -2.051 14.856 1.00 0.00 O ATOM 1377 CB VAL A 89 27.491 -3.798 13.397 1.00 0.00 C ATOM 1378 CG1 VAL A 89 28.384 -4.362 14.501 1.00 0.00 C ATOM 1379 CG2 VAL A 89 27.892 -4.411 12.054 1.00 0.00 C ATOM 0 H VAL A 89 24.626 -2.962 12.643 1.00 0.00 H new ATOM 0 HA VAL A 89 25.960 -5.188 13.959 1.00 0.00 H new ATOM 0 HB VAL A 89 27.609 -2.716 13.338 1.00 0.00 H new ATOM 0 HG11 VAL A 89 29.426 -4.131 14.280 1.00 0.00 H new ATOM 0 HG12 VAL A 89 28.108 -3.915 15.456 1.00 0.00 H new ATOM 0 HG13 VAL A 89 28.256 -5.443 14.556 1.00 0.00 H new ATOM 0 HG21 VAL A 89 28.933 -4.168 11.839 1.00 0.00 H new ATOM 0 HG22 VAL A 89 27.774 -5.494 12.099 1.00 0.00 H new ATOM 0 HG23 VAL A 89 27.255 -4.009 11.266 1.00 0.00 H new ATOM 1389 N TYR A 90 25.029 -3.840 15.902 1.00 0.00 N ATOM 1390 CA TYR A 90 24.570 -3.020 17.051 1.00 0.00 C ATOM 1391 C TYR A 90 25.317 -3.432 18.315 1.00 0.00 C ATOM 1392 O TYR A 90 26.266 -4.188 18.269 1.00 0.00 O ATOM 1393 CB TYR A 90 23.066 -3.206 17.243 1.00 0.00 C ATOM 1394 CG TYR A 90 22.675 -4.631 16.944 1.00 0.00 C ATOM 1395 CD1 TYR A 90 22.481 -5.037 15.618 1.00 0.00 C ATOM 1396 CD2 TYR A 90 22.494 -5.543 17.988 1.00 0.00 C ATOM 1397 CE1 TYR A 90 22.105 -6.356 15.335 1.00 0.00 C ATOM 1398 CE2 TYR A 90 22.119 -6.862 17.706 1.00 0.00 C ATOM 1399 CZ TYR A 90 21.924 -7.269 16.381 1.00 0.00 C ATOM 1400 OH TYR A 90 21.553 -8.569 16.105 1.00 0.00 O ATOM 0 H TYR A 90 24.874 -4.844 15.990 1.00 0.00 H new ATOM 0 HA TYR A 90 24.776 -1.969 16.850 1.00 0.00 H new ATOM 0 HB2 TYR A 90 22.789 -2.952 18.266 1.00 0.00 H new ATOM 0 HB3 TYR A 90 22.522 -2.527 16.587 1.00 0.00 H new ATOM 0 HD1 TYR A 90 22.622 -4.332 14.812 1.00 0.00 H new ATOM 0 HD2 TYR A 90 22.643 -5.230 19.011 1.00 0.00 H new ATOM 0 HE1 TYR A 90 21.955 -6.668 14.312 1.00 0.00 H new ATOM 0 HE2 TYR A 90 21.980 -7.567 18.512 1.00 0.00 H new ATOM 0 HH TYR A 90 21.472 -9.071 16.943 1.00 0.00 H new ATOM 1410 N TYR A 91 24.913 -2.925 19.444 1.00 0.00 N ATOM 1411 CA TYR A 91 25.619 -3.273 20.704 1.00 0.00 C ATOM 1412 C TYR A 91 24.621 -3.663 21.793 1.00 0.00 C ATOM 1413 O TYR A 91 23.668 -2.960 22.063 1.00 0.00 O ATOM 1414 CB TYR A 91 26.407 -2.058 21.185 1.00 0.00 C ATOM 1415 CG TYR A 91 27.803 -2.108 20.629 1.00 0.00 C ATOM 1416 CD1 TYR A 91 28.070 -1.573 19.366 1.00 0.00 C ATOM 1417 CD2 TYR A 91 28.833 -2.675 21.383 1.00 0.00 C ATOM 1418 CE1 TYR A 91 29.373 -1.608 18.853 1.00 0.00 C ATOM 1419 CE2 TYR A 91 30.135 -2.710 20.878 1.00 0.00 C ATOM 1420 CZ TYR A 91 30.407 -2.176 19.612 1.00 0.00 C ATOM 1421 OH TYR A 91 31.693 -2.209 19.110 1.00 0.00 O ATOM 0 H TYR A 91 24.125 -2.285 19.548 1.00 0.00 H new ATOM 0 HA TYR A 91 26.284 -4.115 20.509 1.00 0.00 H new ATOM 0 HB2 TYR A 91 25.911 -1.141 20.867 1.00 0.00 H new ATOM 0 HB3 TYR A 91 26.439 -2.041 22.274 1.00 0.00 H new ATOM 0 HD1 TYR A 91 27.272 -1.133 18.786 1.00 0.00 H new ATOM 0 HD2 TYR A 91 28.622 -3.087 22.359 1.00 0.00 H new ATOM 0 HE1 TYR A 91 29.581 -1.199 17.875 1.00 0.00 H new ATOM 0 HE2 TYR A 91 30.930 -3.148 21.463 1.00 0.00 H new ATOM 0 HH TYR A 91 32.288 -2.635 19.762 1.00 0.00 H new ATOM 1431 N VAL A 92 24.861 -4.764 22.446 1.00 0.00 N ATOM 1432 CA VAL A 92 23.962 -5.189 23.549 1.00 0.00 C ATOM 1433 C VAL A 92 24.693 -4.930 24.859 1.00 0.00 C ATOM 1434 O VAL A 92 25.456 -5.751 25.330 1.00 0.00 O ATOM 1435 CB VAL A 92 23.644 -6.676 23.432 1.00 0.00 C ATOM 1436 CG1 VAL A 92 22.253 -6.926 24.009 1.00 0.00 C ATOM 1437 CG2 VAL A 92 23.679 -7.095 21.962 1.00 0.00 C ATOM 0 H VAL A 92 25.645 -5.390 22.261 1.00 0.00 H new ATOM 0 HA VAL A 92 23.025 -4.635 23.505 1.00 0.00 H new ATOM 0 HB VAL A 92 24.382 -7.259 23.982 1.00 0.00 H new ATOM 0 HG11 VAL A 92 22.012 -7.986 23.932 1.00 0.00 H new ATOM 0 HG12 VAL A 92 22.234 -6.625 25.056 1.00 0.00 H new ATOM 0 HG13 VAL A 92 21.518 -6.346 23.451 1.00 0.00 H new ATOM 0 HG21 VAL A 92 23.451 -8.158 21.881 1.00 0.00 H new ATOM 0 HG22 VAL A 92 22.939 -6.522 21.403 1.00 0.00 H new ATOM 0 HG23 VAL A 92 24.671 -6.904 21.553 1.00 0.00 H new ATOM 1447 N GLY A 93 24.491 -3.784 25.435 1.00 0.00 N ATOM 1448 CA GLY A 93 25.204 -3.455 26.697 1.00 0.00 C ATOM 1449 C GLY A 93 26.639 -3.047 26.351 1.00 0.00 C ATOM 1450 O GLY A 93 26.974 -1.880 26.320 1.00 0.00 O ATOM 0 H GLY A 93 23.863 -3.059 25.088 1.00 0.00 H new ATOM 0 HA2 GLY A 93 24.695 -2.645 27.220 1.00 0.00 H new ATOM 0 HA3 GLY A 93 25.206 -4.315 27.367 1.00 0.00 H new ATOM 1454 N ARG A 94 27.491 -4.004 26.091 1.00 0.00 N ATOM 1455 CA ARG A 94 28.908 -3.673 25.748 1.00 0.00 C ATOM 1456 C ARG A 94 29.469 -4.657 24.712 1.00 0.00 C ATOM 1457 O ARG A 94 30.589 -4.514 24.260 1.00 0.00 O ATOM 1458 CB ARG A 94 29.751 -3.761 27.013 1.00 0.00 C ATOM 1459 CG ARG A 94 29.196 -2.799 28.067 1.00 0.00 C ATOM 1460 CD ARG A 94 30.205 -2.649 29.206 1.00 0.00 C ATOM 1461 NE ARG A 94 29.621 -1.792 30.276 1.00 0.00 N ATOM 1462 CZ ARG A 94 30.276 -0.749 30.709 1.00 0.00 C ATOM 1463 NH1 ARG A 94 31.176 -0.886 31.644 1.00 0.00 N ATOM 1464 NH2 ARG A 94 30.029 0.429 30.206 1.00 0.00 N ATOM 0 H ARG A 94 27.268 -4.999 26.101 1.00 0.00 H new ATOM 0 HA ARG A 94 28.939 -2.668 25.327 1.00 0.00 H new ATOM 0 HB2 ARG A 94 29.744 -4.781 27.397 1.00 0.00 H new ATOM 0 HB3 ARG A 94 30.788 -3.512 26.789 1.00 0.00 H new ATOM 0 HG2 ARG A 94 28.994 -1.827 27.617 1.00 0.00 H new ATOM 0 HG3 ARG A 94 28.249 -3.174 28.454 1.00 0.00 H new ATOM 0 HD2 ARG A 94 30.463 -3.628 29.609 1.00 0.00 H new ATOM 0 HD3 ARG A 94 31.128 -2.205 28.833 1.00 0.00 H new ATOM 0 HE ARG A 94 28.709 -2.020 30.671 1.00 0.00 H new ATOM 0 HH11 ARG A 94 31.368 -1.808 32.036 1.00 0.00 H new ATOM 0 HH12 ARG A 94 31.688 -0.071 31.982 1.00 0.00 H new ATOM 0 HH21 ARG A 94 29.325 0.534 29.475 1.00 0.00 H new ATOM 0 HH22 ARG A 94 30.540 1.245 30.543 1.00 0.00 H new ATOM 1478 N LYS A 95 28.719 -5.652 24.333 1.00 0.00 N ATOM 1479 CA LYS A 95 29.237 -6.629 23.333 1.00 0.00 C ATOM 1480 C LYS A 95 28.705 -6.265 21.942 1.00 0.00 C ATOM 1481 O LYS A 95 27.521 -6.066 21.773 1.00 0.00 O ATOM 1482 CB LYS A 95 28.765 -8.035 23.708 1.00 0.00 C ATOM 1483 CG LYS A 95 29.474 -8.490 24.986 1.00 0.00 C ATOM 1484 CD LYS A 95 30.342 -9.712 24.681 1.00 0.00 C ATOM 1485 CE LYS A 95 31.389 -9.883 25.783 1.00 0.00 C ATOM 1486 NZ LYS A 95 32.699 -9.352 25.311 1.00 0.00 N ATOM 0 H LYS A 95 27.773 -5.832 24.670 1.00 0.00 H new ATOM 0 HA LYS A 95 30.327 -6.600 23.324 1.00 0.00 H new ATOM 0 HB2 LYS A 95 27.685 -8.039 23.858 1.00 0.00 H new ATOM 0 HB3 LYS A 95 28.977 -8.730 22.895 1.00 0.00 H new ATOM 0 HG2 LYS A 95 30.091 -7.682 25.380 1.00 0.00 H new ATOM 0 HG3 LYS A 95 28.740 -8.734 25.754 1.00 0.00 H new ATOM 0 HD2 LYS A 95 29.720 -10.605 24.614 1.00 0.00 H new ATOM 0 HD3 LYS A 95 30.832 -9.591 23.715 1.00 0.00 H new ATOM 0 HE2 LYS A 95 31.074 -9.356 26.683 1.00 0.00 H new ATOM 0 HE3 LYS A 95 31.485 -10.936 26.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 33.411 -9.468 26.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 33.000 -9.874 24.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 32.601 -8.343 25.080 1.00 0.00 H new ATOM 1500 N PRO A 96 29.593 -6.192 20.982 1.00 0.00 N ATOM 1501 CA PRO A 96 29.226 -5.852 19.596 1.00 0.00 C ATOM 1502 C PRO A 96 28.610 -7.072 18.900 1.00 0.00 C ATOM 1503 O PRO A 96 29.023 -8.193 19.117 1.00 0.00 O ATOM 1504 CB PRO A 96 30.562 -5.472 18.953 1.00 0.00 C ATOM 1505 CG PRO A 96 31.664 -6.143 19.807 1.00 0.00 C ATOM 1506 CD PRO A 96 31.036 -6.438 21.183 1.00 0.00 C ATOM 0 HA PRO A 96 28.487 -5.054 19.528 1.00 0.00 H new ATOM 0 HB2 PRO A 96 30.608 -5.816 17.920 1.00 0.00 H new ATOM 0 HB3 PRO A 96 30.690 -4.390 18.934 1.00 0.00 H new ATOM 0 HG2 PRO A 96 32.014 -7.062 19.336 1.00 0.00 H new ATOM 0 HG3 PRO A 96 32.529 -5.487 19.908 1.00 0.00 H new ATOM 0 HD2 PRO A 96 31.225 -7.465 21.495 1.00 0.00 H new ATOM 0 HD3 PRO A 96 31.447 -5.789 21.956 1.00 0.00 H new ATOM 1514 N LYS A 97 27.624 -6.865 18.068 1.00 0.00 N ATOM 1515 CA LYS A 97 26.986 -8.016 17.368 1.00 0.00 C ATOM 1516 C LYS A 97 26.588 -7.606 15.947 1.00 0.00 C ATOM 1517 O LYS A 97 26.155 -6.497 15.707 1.00 0.00 O ATOM 1518 CB LYS A 97 25.731 -8.447 18.134 1.00 0.00 C ATOM 1519 CG LYS A 97 26.130 -9.049 19.483 1.00 0.00 C ATOM 1520 CD LYS A 97 25.496 -10.433 19.632 1.00 0.00 C ATOM 1521 CE LYS A 97 24.045 -10.285 20.096 1.00 0.00 C ATOM 1522 NZ LYS A 97 23.316 -11.564 19.865 1.00 0.00 N ATOM 0 H LYS A 97 27.234 -5.950 17.844 1.00 0.00 H new ATOM 0 HA LYS A 97 27.695 -8.842 17.323 1.00 0.00 H new ATOM 0 HB2 LYS A 97 25.075 -7.590 18.287 1.00 0.00 H new ATOM 0 HB3 LYS A 97 25.170 -9.177 17.551 1.00 0.00 H new ATOM 0 HG2 LYS A 97 27.215 -9.125 19.553 1.00 0.00 H new ATOM 0 HG3 LYS A 97 25.803 -8.398 20.294 1.00 0.00 H new ATOM 0 HD2 LYS A 97 25.532 -10.965 18.681 1.00 0.00 H new ATOM 0 HD3 LYS A 97 26.060 -11.027 20.351 1.00 0.00 H new ATOM 0 HE2 LYS A 97 24.015 -10.023 21.154 1.00 0.00 H new ATOM 0 HE3 LYS A 97 23.559 -9.474 19.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 22.330 -11.463 20.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 23.333 -11.795 18.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 23.775 -12.327 20.402 1.00 0.00 H new ATOM 1536 N VAL A 98 26.722 -8.500 15.005 1.00 0.00 N ATOM 1537 CA VAL A 98 26.341 -8.175 13.600 1.00 0.00 C ATOM 1538 C VAL A 98 25.178 -9.075 13.186 1.00 0.00 C ATOM 1539 O VAL A 98 25.199 -10.268 13.412 1.00 0.00 O ATOM 1540 CB VAL A 98 27.529 -8.429 12.672 1.00 0.00 C ATOM 1541 CG1 VAL A 98 27.078 -8.286 11.216 1.00 0.00 C ATOM 1542 CG2 VAL A 98 28.632 -7.412 12.965 1.00 0.00 C ATOM 0 H VAL A 98 27.080 -9.444 15.148 1.00 0.00 H new ATOM 0 HA VAL A 98 26.049 -7.127 13.531 1.00 0.00 H new ATOM 0 HB VAL A 98 27.910 -9.437 12.838 1.00 0.00 H new ATOM 0 HG11 VAL A 98 27.924 -8.467 10.553 1.00 0.00 H new ATOM 0 HG12 VAL A 98 26.291 -9.011 11.006 1.00 0.00 H new ATOM 0 HG13 VAL A 98 26.697 -7.278 11.051 1.00 0.00 H new ATOM 0 HG21 VAL A 98 29.479 -7.593 12.303 1.00 0.00 H new ATOM 0 HG22 VAL A 98 28.251 -6.404 12.799 1.00 0.00 H new ATOM 0 HG23 VAL A 98 28.953 -7.512 14.002 1.00 0.00 H new ATOM 1552 N GLU A 99 24.159 -8.525 12.584 1.00 0.00 N ATOM 1553 CA GLU A 99 23.012 -9.376 12.172 1.00 0.00 C ATOM 1554 C GLU A 99 22.599 -9.039 10.746 1.00 0.00 C ATOM 1555 O GLU A 99 23.364 -8.502 9.969 1.00 0.00 O ATOM 1556 CB GLU A 99 21.829 -9.129 13.104 1.00 0.00 C ATOM 1557 CG GLU A 99 21.354 -10.455 13.698 1.00 0.00 C ATOM 1558 CD GLU A 99 19.842 -10.400 13.926 1.00 0.00 C ATOM 1559 OE1 GLU A 99 19.231 -9.437 13.490 1.00 0.00 O ATOM 1560 OE2 GLU A 99 19.319 -11.320 14.533 1.00 0.00 O ATOM 0 H GLU A 99 24.073 -7.533 12.362 1.00 0.00 H new ATOM 0 HA GLU A 99 23.313 -10.422 12.225 1.00 0.00 H new ATOM 0 HB2 GLU A 99 22.119 -8.445 13.902 1.00 0.00 H new ATOM 0 HB3 GLU A 99 21.016 -8.653 12.556 1.00 0.00 H new ATOM 0 HG2 GLU A 99 21.601 -11.276 13.025 1.00 0.00 H new ATOM 0 HG3 GLU A 99 21.868 -10.649 14.640 1.00 0.00 H new ATOM 1567 N GLN A 100 21.387 -9.354 10.403 1.00 0.00 N ATOM 1568 CA GLN A 100 20.890 -9.066 9.034 1.00 0.00 C ATOM 1569 C GLN A 100 19.388 -8.814 9.102 1.00 0.00 C ATOM 1570 O GLN A 100 18.589 -9.696 8.858 1.00 0.00 O ATOM 1571 CB GLN A 100 21.149 -10.272 8.144 1.00 0.00 C ATOM 1572 CG GLN A 100 22.632 -10.647 8.199 1.00 0.00 C ATOM 1573 CD GLN A 100 22.951 -11.634 7.075 1.00 0.00 C ATOM 1574 OE1 GLN A 100 22.198 -11.762 6.131 1.00 0.00 O ATOM 1575 NE2 GLN A 100 24.046 -12.343 7.137 1.00 0.00 N ATOM 0 H GLN A 100 20.711 -9.804 11.020 1.00 0.00 H new ATOM 0 HA GLN A 100 21.401 -8.193 8.628 1.00 0.00 H new ATOM 0 HB2 GLN A 100 20.539 -11.114 8.470 1.00 0.00 H new ATOM 0 HB3 GLN A 100 20.859 -10.047 7.118 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.248 -9.753 8.098 1.00 0.00 H new ATOM 0 HG3 GLN A 100 22.870 -11.091 9.166 1.00 0.00 H new ATOM 0 HE21 GLN A 100 24.679 -12.236 7.930 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.268 -13.004 6.393 1.00 0.00 H new ATOM 1584 N LEU A 101 18.997 -7.623 9.444 1.00 0.00 N ATOM 1585 CA LEU A 101 17.545 -7.320 9.541 1.00 0.00 C ATOM 1586 C LEU A 101 16.826 -7.913 8.335 1.00 0.00 C ATOM 1587 O LEU A 101 17.367 -8.001 7.252 1.00 0.00 O ATOM 1588 CB LEU A 101 17.327 -5.808 9.591 1.00 0.00 C ATOM 1589 CG LEU A 101 18.142 -5.199 10.737 1.00 0.00 C ATOM 1590 CD1 LEU A 101 17.546 -3.847 11.124 1.00 0.00 C ATOM 1591 CD2 LEU A 101 18.108 -6.129 11.950 1.00 0.00 C ATOM 0 H LEU A 101 19.620 -6.845 9.661 1.00 0.00 H new ATOM 0 HA LEU A 101 17.143 -7.759 10.454 1.00 0.00 H new ATOM 0 HB2 LEU A 101 17.624 -5.358 8.644 1.00 0.00 H new ATOM 0 HB3 LEU A 101 16.268 -5.589 9.730 1.00 0.00 H new ATOM 0 HG LEU A 101 19.174 -5.067 10.410 1.00 0.00 H new ATOM 0 HD11 LEU A 101 18.126 -3.414 11.939 1.00 0.00 H new ATOM 0 HD12 LEU A 101 17.573 -3.178 10.264 1.00 0.00 H new ATOM 0 HD13 LEU A 101 16.513 -3.983 11.445 1.00 0.00 H new ATOM 0 HD21 LEU A 101 18.689 -5.690 12.761 1.00 0.00 H new ATOM 0 HD22 LEU A 101 17.077 -6.265 12.275 1.00 0.00 H new ATOM 0 HD23 LEU A 101 18.534 -7.095 11.680 1.00 0.00 H new ATOM 1603 N SER A 102 15.618 -8.347 8.530 1.00 0.00 N ATOM 1604 CA SER A 102 14.855 -8.974 7.407 1.00 0.00 C ATOM 1605 C SER A 102 13.836 -7.996 6.810 1.00 0.00 C ATOM 1606 O SER A 102 13.199 -7.240 7.516 1.00 0.00 O ATOM 1607 CB SER A 102 14.120 -10.208 7.928 1.00 0.00 C ATOM 1608 OG SER A 102 15.040 -11.283 8.057 1.00 0.00 O ATOM 0 H SER A 102 15.119 -8.298 9.418 1.00 0.00 H new ATOM 0 HA SER A 102 15.562 -9.252 6.625 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.659 -9.991 8.892 1.00 0.00 H new ATOM 0 HB3 SER A 102 13.316 -10.482 7.245 1.00 0.00 H new ATOM 0 HG SER A 102 14.572 -12.076 8.393 1.00 0.00 H new ATOM 1614 N ASN A 103 13.664 -8.027 5.511 1.00 0.00 N ATOM 1615 CA ASN A 103 12.667 -7.122 4.860 1.00 0.00 C ATOM 1616 C ASN A 103 12.882 -5.684 5.321 1.00 0.00 C ATOM 1617 O ASN A 103 11.948 -4.919 5.454 1.00 0.00 O ATOM 1618 CB ASN A 103 11.255 -7.561 5.242 1.00 0.00 C ATOM 1619 CG ASN A 103 10.828 -8.738 4.362 1.00 0.00 C ATOM 1620 OD1 ASN A 103 11.741 -9.475 3.791 1.00 0.00 O flip ATOM 1621 ND2 ASN A 103 9.651 -8.988 4.191 1.00 0.00 N flip ATOM 0 H ASN A 103 14.171 -8.640 4.873 1.00 0.00 H new ATOM 0 HA ASN A 103 12.795 -7.177 3.779 1.00 0.00 H new ATOM 0 HB2 ASN A 103 11.225 -7.850 6.293 1.00 0.00 H new ATOM 0 HB3 ASN A 103 10.559 -6.731 5.119 1.00 0.00 H new ATOM 0 HD21 ASN A 103 8.937 -8.412 4.637 1.00 0.00 H new ATOM 0 HD22 ASN A 103 9.377 -9.774 3.601 1.00 0.00 H new ATOM 1628 N MET A 104 14.102 -5.305 5.552 1.00 0.00 N ATOM 1629 CA MET A 104 14.369 -3.911 5.988 1.00 0.00 C ATOM 1630 C MET A 104 14.703 -3.062 4.761 1.00 0.00 C ATOM 1631 O MET A 104 15.127 -1.931 4.875 1.00 0.00 O ATOM 1632 CB MET A 104 15.549 -3.892 6.962 1.00 0.00 C ATOM 1633 CG MET A 104 15.818 -2.452 7.405 1.00 0.00 C ATOM 1634 SD MET A 104 15.755 -2.355 9.211 1.00 0.00 S ATOM 1635 CE MET A 104 16.930 -0.992 9.403 1.00 0.00 C ATOM 0 H MET A 104 14.926 -5.899 5.458 1.00 0.00 H new ATOM 0 HA MET A 104 13.488 -3.507 6.488 1.00 0.00 H new ATOM 0 HB2 MET A 104 15.330 -4.516 7.828 1.00 0.00 H new ATOM 0 HB3 MET A 104 16.436 -4.309 6.485 1.00 0.00 H new ATOM 0 HG2 MET A 104 16.794 -2.126 7.046 1.00 0.00 H new ATOM 0 HG3 MET A 104 15.078 -1.781 6.968 1.00 0.00 H new ATOM 0 HE1 MET A 104 17.721 -1.288 10.092 1.00 0.00 H new ATOM 0 HE2 MET A 104 17.365 -0.748 8.434 1.00 0.00 H new ATOM 0 HE3 MET A 104 16.412 -0.118 9.799 1.00 0.00 H new ATOM 1645 N ILE A 105 14.508 -3.599 3.585 1.00 0.00 N ATOM 1646 CA ILE A 105 14.809 -2.821 2.351 1.00 0.00 C ATOM 1647 C ILE A 105 13.739 -3.110 1.300 1.00 0.00 C ATOM 1648 O ILE A 105 12.956 -4.027 1.438 1.00 0.00 O ATOM 1649 CB ILE A 105 16.178 -3.228 1.804 1.00 0.00 C ATOM 1650 CG1 ILE A 105 17.250 -2.960 2.861 1.00 0.00 C ATOM 1651 CG2 ILE A 105 16.487 -2.413 0.547 1.00 0.00 C ATOM 1652 CD1 ILE A 105 18.632 -3.242 2.270 1.00 0.00 C ATOM 0 H ILE A 105 14.153 -4.542 3.428 1.00 0.00 H new ATOM 0 HA ILE A 105 14.817 -1.757 2.587 1.00 0.00 H new ATOM 0 HB ILE A 105 16.169 -4.289 1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 105 17.192 -1.925 3.199 1.00 0.00 H new ATOM 0 HG13 ILE A 105 17.081 -3.591 3.734 1.00 0.00 H new ATOM 0 HG21 ILE A 105 17.463 -2.702 0.156 1.00 0.00 H new ATOM 0 HG22 ILE A 105 15.723 -2.603 -0.207 1.00 0.00 H new ATOM 0 HG23 ILE A 105 16.496 -1.352 0.795 1.00 0.00 H new ATOM 0 HD11 ILE A 105 19.396 -3.051 3.024 1.00 0.00 H new ATOM 0 HD12 ILE A 105 18.687 -4.284 1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 105 18.800 -2.593 1.411 1.00 0.00 H new ATOM 1664 N VAL A 106 13.693 -2.334 0.254 1.00 0.00 N ATOM 1665 CA VAL A 106 12.669 -2.563 -0.795 1.00 0.00 C ATOM 1666 C VAL A 106 13.339 -3.104 -2.062 1.00 0.00 C ATOM 1667 O VAL A 106 14.393 -2.651 -2.461 1.00 0.00 O ATOM 1668 CB VAL A 106 11.974 -1.237 -1.102 1.00 0.00 C ATOM 1669 CG1 VAL A 106 11.197 -1.357 -2.409 1.00 0.00 C ATOM 1670 CG2 VAL A 106 11.009 -0.896 0.036 1.00 0.00 C ATOM 0 H VAL A 106 14.323 -1.550 0.082 1.00 0.00 H new ATOM 0 HA VAL A 106 11.937 -3.291 -0.446 1.00 0.00 H new ATOM 0 HB VAL A 106 12.721 -0.449 -1.197 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.702 -0.410 -2.626 1.00 0.00 H new ATOM 0 HG12 VAL A 106 11.884 -1.602 -3.219 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.449 -2.145 -2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 106 10.511 0.050 -0.180 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.263 -1.685 0.129 1.00 0.00 H new ATOM 0 HG23 VAL A 106 11.564 -0.809 0.970 1.00 0.00 H new ATOM 1680 N ARG A 107 12.728 -4.066 -2.697 1.00 0.00 N ATOM 1681 CA ARG A 107 13.319 -4.635 -3.941 1.00 0.00 C ATOM 1682 C ARG A 107 12.264 -4.634 -5.052 1.00 0.00 C ATOM 1683 O ARG A 107 12.530 -5.018 -6.174 1.00 0.00 O ATOM 1684 CB ARG A 107 13.782 -6.069 -3.677 1.00 0.00 C ATOM 1685 CG ARG A 107 14.587 -6.575 -4.876 1.00 0.00 C ATOM 1686 CD ARG A 107 15.129 -7.974 -4.576 1.00 0.00 C ATOM 1687 NE ARG A 107 16.476 -8.128 -5.195 1.00 0.00 N ATOM 1688 CZ ARG A 107 16.912 -9.314 -5.522 1.00 0.00 C ATOM 1689 NH1 ARG A 107 16.653 -9.801 -6.705 1.00 0.00 N ATOM 1690 NH2 ARG A 107 17.607 -10.012 -4.666 1.00 0.00 N ATOM 0 H ARG A 107 11.843 -4.483 -2.408 1.00 0.00 H new ATOM 0 HA ARG A 107 14.172 -4.030 -4.249 1.00 0.00 H new ATOM 0 HB2 ARG A 107 14.392 -6.105 -2.775 1.00 0.00 H new ATOM 0 HB3 ARG A 107 12.921 -6.715 -3.505 1.00 0.00 H new ATOM 0 HG2 ARG A 107 13.957 -6.601 -5.765 1.00 0.00 H new ATOM 0 HG3 ARG A 107 15.410 -5.893 -5.088 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.192 -8.128 -3.499 1.00 0.00 H new ATOM 0 HD3 ARG A 107 14.449 -8.731 -4.967 1.00 0.00 H new ATOM 0 HE ARG A 107 17.057 -7.307 -5.363 1.00 0.00 H new ATOM 0 HH11 ARG A 107 16.110 -9.255 -7.374 1.00 0.00 H new ATOM 0 HH12 ARG A 107 16.994 -10.728 -6.961 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.809 -9.631 -3.742 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.948 -10.939 -4.921 1.00 0.00 H new ATOM 1704 N SER A 108 11.069 -4.204 -4.748 1.00 0.00 N ATOM 1705 CA SER A 108 9.995 -4.174 -5.781 1.00 0.00 C ATOM 1706 C SER A 108 8.703 -3.652 -5.148 1.00 0.00 C ATOM 1707 O SER A 108 8.278 -4.123 -4.112 1.00 0.00 O ATOM 1708 CB SER A 108 9.764 -5.585 -6.321 1.00 0.00 C ATOM 1709 OG SER A 108 10.700 -5.851 -7.357 1.00 0.00 O ATOM 0 H SER A 108 10.790 -3.871 -3.825 1.00 0.00 H new ATOM 0 HA SER A 108 10.294 -3.519 -6.600 1.00 0.00 H new ATOM 0 HB2 SER A 108 9.874 -6.316 -5.520 1.00 0.00 H new ATOM 0 HB3 SER A 108 8.747 -5.679 -6.701 1.00 0.00 H new ATOM 0 HG SER A 108 11.605 -5.874 -6.982 1.00 0.00 H new ATOM 1715 N CYS A 109 8.085 -2.675 -5.752 1.00 0.00 N ATOM 1716 CA CYS A 109 6.826 -2.118 -5.168 1.00 0.00 C ATOM 1717 C CYS A 109 5.598 -2.790 -5.797 1.00 0.00 C ATOM 1718 O CYS A 109 5.706 -3.775 -6.500 1.00 0.00 O ATOM 1719 CB CYS A 109 6.766 -0.613 -5.433 1.00 0.00 C ATOM 1720 SG CYS A 109 8.141 0.205 -4.589 1.00 0.00 S ATOM 0 H CYS A 109 8.393 -2.238 -6.621 1.00 0.00 H new ATOM 0 HA CYS A 109 6.823 -2.309 -4.095 1.00 0.00 H new ATOM 0 HB2 CYS A 109 6.817 -0.420 -6.505 1.00 0.00 H new ATOM 0 HB3 CYS A 109 5.817 -0.209 -5.081 1.00 0.00 H new ATOM 1725 N LYS A 110 4.429 -2.256 -5.542 1.00 0.00 N ATOM 1726 CA LYS A 110 3.181 -2.841 -6.109 1.00 0.00 C ATOM 1727 C LYS A 110 2.037 -1.862 -5.846 1.00 0.00 C ATOM 1728 O LYS A 110 2.267 -0.710 -5.553 1.00 0.00 O ATOM 1729 CB LYS A 110 2.882 -4.180 -5.432 1.00 0.00 C ATOM 1730 CG LYS A 110 2.822 -5.286 -6.487 1.00 0.00 C ATOM 1731 CD LYS A 110 2.971 -6.645 -5.803 1.00 0.00 C ATOM 1732 CE LYS A 110 2.626 -7.763 -6.787 1.00 0.00 C ATOM 1733 NZ LYS A 110 3.254 -7.474 -8.108 1.00 0.00 N ATOM 0 H LYS A 110 4.288 -1.431 -4.959 1.00 0.00 H new ATOM 0 HA LYS A 110 3.296 -3.011 -7.180 1.00 0.00 H new ATOM 0 HB2 LYS A 110 3.653 -4.407 -4.696 1.00 0.00 H new ATOM 0 HB3 LYS A 110 1.935 -4.124 -4.895 1.00 0.00 H new ATOM 0 HG2 LYS A 110 1.876 -5.239 -7.026 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.615 -5.147 -7.222 1.00 0.00 H new ATOM 0 HD2 LYS A 110 3.991 -6.770 -5.441 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.315 -6.698 -4.934 1.00 0.00 H new ATOM 0 HE2 LYS A 110 2.981 -8.720 -6.405 1.00 0.00 H new ATOM 0 HE3 LYS A 110 1.545 -7.845 -6.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 3.317 -8.352 -8.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 2.675 -6.781 -8.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.208 -7.088 -7.962 1.00 0.00 H new ATOM 1747 N CYS A 111 0.809 -2.292 -5.940 1.00 0.00 N ATOM 1748 CA CYS A 111 -0.314 -1.344 -5.682 1.00 0.00 C ATOM 1749 C CYS A 111 -1.424 -2.040 -4.890 1.00 0.00 C ATOM 1750 O CYS A 111 -2.352 -2.582 -5.454 1.00 0.00 O ATOM 1751 CB CYS A 111 -0.876 -0.838 -7.014 1.00 0.00 C ATOM 1752 SG CYS A 111 0.060 0.620 -7.543 1.00 0.00 S ATOM 0 H CYS A 111 0.536 -3.245 -6.181 1.00 0.00 H new ATOM 0 HA CYS A 111 0.062 -0.502 -5.100 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -0.811 -1.620 -7.770 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -1.931 -0.587 -6.905 1.00 0.00 H new ATOM 1757 N SER A 112 -1.342 -2.021 -3.585 1.00 0.00 N ATOM 1758 CA SER A 112 -2.403 -2.674 -2.769 1.00 0.00 C ATOM 1759 C SER A 112 -3.541 -1.677 -2.532 1.00 0.00 C ATOM 1760 O SER A 112 -4.686 -2.064 -2.701 1.00 0.00 O ATOM 1761 CB SER A 112 -1.821 -3.110 -1.425 1.00 0.00 C ATOM 1762 OG SER A 112 -2.803 -3.842 -0.704 1.00 0.00 O ATOM 1763 OXT SER A 112 -3.247 -0.544 -2.189 1.00 0.00 O ATOM 0 H SER A 112 -0.590 -1.583 -3.053 1.00 0.00 H new ATOM 0 HA SER A 112 -2.784 -3.548 -3.298 1.00 0.00 H new ATOM 0 HB2 SER A 112 -0.935 -3.725 -1.582 1.00 0.00 H new ATOM 0 HB3 SER A 112 -1.507 -2.238 -0.851 1.00 0.00 H new ATOM 0 HG SER A 112 -2.415 -4.684 -0.386 1.00 0.00 H new TER 1769 SER A 112 ATOM 1770 N ALA B 1 -7.713 -1.910 15.781 1.00 0.00 N ATOM 1771 CA ALA B 1 -8.632 -2.347 14.692 1.00 0.00 C ATOM 1772 C ALA B 1 -8.576 -1.338 13.543 1.00 0.00 C ATOM 1773 O ALA B 1 -8.898 -0.178 13.707 1.00 0.00 O ATOM 1774 CB ALA B 1 -10.062 -2.426 15.232 1.00 0.00 C ATOM 0 H1 ALA B 1 -7.750 -2.595 16.563 1.00 0.00 H new ATOM 0 H2 ALA B 1 -6.741 -1.856 15.414 1.00 0.00 H new ATOM 0 H3 ALA B 1 -8.005 -0.974 16.127 1.00 0.00 H new ATOM 0 HA ALA B 1 -8.326 -3.328 14.330 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -10.734 -2.746 14.436 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -10.102 -3.144 16.051 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -10.369 -1.445 15.594 1.00 0.00 H new ATOM 1782 N LEU B 2 -8.170 -1.770 12.380 1.00 0.00 N ATOM 1783 CA LEU B 2 -8.095 -0.833 11.224 1.00 0.00 C ATOM 1784 C LEU B 2 -9.111 -1.242 10.165 1.00 0.00 C ATOM 1785 O LEU B 2 -8.793 -1.396 9.003 1.00 0.00 O ATOM 1786 CB LEU B 2 -6.694 -0.874 10.620 1.00 0.00 C ATOM 1787 CG LEU B 2 -5.712 -0.163 11.553 1.00 0.00 C ATOM 1788 CD1 LEU B 2 -4.388 0.067 10.821 1.00 0.00 C ATOM 1789 CD2 LEU B 2 -6.297 1.184 11.983 1.00 0.00 C ATOM 0 H LEU B 2 -7.888 -2.730 12.181 1.00 0.00 H new ATOM 0 HA LEU B 2 -8.314 0.178 11.568 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -6.383 -1.907 10.467 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -6.695 -0.393 9.642 1.00 0.00 H new ATOM 0 HG LEU B 2 -5.538 -0.781 12.434 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -3.688 0.574 11.486 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -3.969 -0.892 10.516 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -4.562 0.684 9.939 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -5.596 1.689 12.648 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -6.472 1.802 11.103 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -7.240 1.021 12.506 1.00 0.00 H new ATOM 1801 N ASP B 3 -10.334 -1.407 10.562 1.00 0.00 N ATOM 1802 CA ASP B 3 -11.387 -1.794 9.588 1.00 0.00 C ATOM 1803 C ASP B 3 -12.301 -0.595 9.346 1.00 0.00 C ATOM 1804 O ASP B 3 -12.077 0.484 9.857 1.00 0.00 O ATOM 1805 CB ASP B 3 -12.207 -2.958 10.148 1.00 0.00 C ATOM 1806 CG ASP B 3 -12.271 -2.858 11.674 1.00 0.00 C ATOM 1807 OD1 ASP B 3 -12.863 -1.909 12.161 1.00 0.00 O ATOM 1808 OD2 ASP B 3 -11.726 -3.732 12.329 1.00 0.00 O ATOM 0 H ASP B 3 -10.654 -1.291 11.523 1.00 0.00 H new ATOM 0 HA ASP B 3 -10.925 -2.103 8.651 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -13.214 -2.940 9.730 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -11.757 -3.906 9.855 1.00 0.00 H new ATOM 1813 N THR B 4 -13.326 -0.775 8.567 1.00 0.00 N ATOM 1814 CA THR B 4 -14.256 0.350 8.283 1.00 0.00 C ATOM 1815 C THR B 4 -15.266 0.502 9.424 1.00 0.00 C ATOM 1816 O THR B 4 -16.254 1.198 9.302 1.00 0.00 O ATOM 1817 CB THR B 4 -14.975 0.067 6.965 1.00 0.00 C ATOM 1818 OG1 THR B 4 -16.051 -0.833 7.196 1.00 0.00 O ATOM 1819 CG2 THR B 4 -13.979 -0.559 5.984 1.00 0.00 C ATOM 0 H THR B 4 -13.562 -1.657 8.112 1.00 0.00 H new ATOM 0 HA THR B 4 -13.697 1.282 8.202 1.00 0.00 H new ATOM 0 HB THR B 4 -15.369 0.994 6.549 1.00 0.00 H new ATOM 0 HG1 THR B 4 -16.514 -1.014 6.351 1.00 0.00 H new ATOM 0 HG21 THR B 4 -14.481 -0.766 5.039 1.00 0.00 H new ATOM 0 HG22 THR B 4 -13.153 0.132 5.813 1.00 0.00 H new ATOM 0 HG23 THR B 4 -13.593 -1.489 6.401 1.00 0.00 H new ATOM 1827 N ASN B 5 -15.018 -0.130 10.542 1.00 0.00 N ATOM 1828 CA ASN B 5 -15.953 -0.005 11.693 1.00 0.00 C ATOM 1829 C ASN B 5 -15.382 1.001 12.698 1.00 0.00 C ATOM 1830 O ASN B 5 -16.088 1.841 13.220 1.00 0.00 O ATOM 1831 CB ASN B 5 -16.118 -1.367 12.370 1.00 0.00 C ATOM 1832 CG ASN B 5 -17.535 -1.488 12.936 1.00 0.00 C ATOM 1833 OD1 ASN B 5 -17.748 -1.295 14.116 1.00 0.00 O ATOM 1834 ND2 ASN B 5 -18.517 -1.802 12.137 1.00 0.00 N ATOM 0 H ASN B 5 -14.207 -0.727 10.705 1.00 0.00 H new ATOM 0 HA ASN B 5 -16.924 0.341 11.340 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -15.932 -2.166 11.653 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -15.385 -1.479 13.169 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -19.465 -1.886 12.503 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -18.337 -1.964 11.146 1.00 0.00 H new ATOM 1841 N TYR B 6 -14.106 0.919 12.974 1.00 0.00 N ATOM 1842 CA TYR B 6 -13.485 1.860 13.943 1.00 0.00 C ATOM 1843 C TYR B 6 -13.073 3.146 13.218 1.00 0.00 C ATOM 1844 O TYR B 6 -12.899 4.183 13.827 1.00 0.00 O ATOM 1845 CB TYR B 6 -12.251 1.188 14.544 1.00 0.00 C ATOM 1846 CG TYR B 6 -11.401 2.209 15.258 1.00 0.00 C ATOM 1847 CD1 TYR B 6 -11.883 2.851 16.405 1.00 0.00 C ATOM 1848 CD2 TYR B 6 -10.127 2.512 14.769 1.00 0.00 C ATOM 1849 CE1 TYR B 6 -11.088 3.797 17.063 1.00 0.00 C ATOM 1850 CE2 TYR B 6 -9.331 3.457 15.427 1.00 0.00 C ATOM 1851 CZ TYR B 6 -9.811 4.100 16.574 1.00 0.00 C ATOM 1852 OH TYR B 6 -9.027 5.033 17.221 1.00 0.00 O ATOM 0 H TYR B 6 -13.468 0.236 12.566 1.00 0.00 H new ATOM 0 HA TYR B 6 -14.195 2.112 14.731 1.00 0.00 H new ATOM 0 HB2 TYR B 6 -12.556 0.406 15.240 1.00 0.00 H new ATOM 0 HB3 TYR B 6 -11.670 0.706 13.757 1.00 0.00 H new ATOM 0 HD1 TYR B 6 -12.868 2.617 16.782 1.00 0.00 H new ATOM 0 HD2 TYR B 6 -9.757 2.017 13.883 1.00 0.00 H new ATOM 0 HE1 TYR B 6 -11.459 4.293 17.948 1.00 0.00 H new ATOM 0 HE2 TYR B 6 -8.346 3.690 15.050 1.00 0.00 H new ATOM 0 HH TYR B 6 -8.195 4.610 17.520 1.00 0.00 H new ATOM 1862 N CYS B 7 -12.917 3.086 11.924 1.00 0.00 N ATOM 1863 CA CYS B 7 -12.515 4.303 11.165 1.00 0.00 C ATOM 1864 C CYS B 7 -13.705 5.256 11.033 1.00 0.00 C ATOM 1865 O CYS B 7 -13.543 6.427 10.751 1.00 0.00 O ATOM 1866 CB CYS B 7 -12.030 3.898 9.772 1.00 0.00 C ATOM 1867 SG CYS B 7 -10.240 3.629 9.815 1.00 0.00 S ATOM 0 H CYS B 7 -13.051 2.247 11.360 1.00 0.00 H new ATOM 0 HA CYS B 7 -11.711 4.808 11.701 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -12.538 2.990 9.448 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -12.275 4.676 9.049 1.00 0.00 H new ATOM 1872 N PHE B 8 -14.898 4.772 11.236 1.00 0.00 N ATOM 1873 CA PHE B 8 -16.088 5.661 11.120 1.00 0.00 C ATOM 1874 C PHE B 8 -16.341 6.351 12.463 1.00 0.00 C ATOM 1875 O PHE B 8 -17.466 6.476 12.905 1.00 0.00 O ATOM 1876 CB PHE B 8 -17.312 4.829 10.731 1.00 0.00 C ATOM 1877 CG PHE B 8 -17.440 4.772 9.223 1.00 0.00 C ATOM 1878 CD1 PHE B 8 -16.353 5.117 8.405 1.00 0.00 C ATOM 1879 CD2 PHE B 8 -18.650 4.374 8.642 1.00 0.00 C ATOM 1880 CE1 PHE B 8 -16.481 5.064 7.010 1.00 0.00 C ATOM 1881 CE2 PHE B 8 -18.776 4.321 7.249 1.00 0.00 C ATOM 1882 CZ PHE B 8 -17.692 4.665 6.433 1.00 0.00 C ATOM 0 H PHE B 8 -15.101 3.802 11.477 1.00 0.00 H new ATOM 0 HA PHE B 8 -15.906 6.415 10.354 1.00 0.00 H new ATOM 0 HB2 PHE B 8 -17.220 3.821 11.135 1.00 0.00 H new ATOM 0 HB3 PHE B 8 -18.212 5.266 11.165 1.00 0.00 H new ATOM 0 HD1 PHE B 8 -15.418 5.423 8.850 1.00 0.00 H new ATOM 0 HD2 PHE B 8 -19.488 4.107 9.270 1.00 0.00 H new ATOM 0 HE1 PHE B 8 -15.645 5.331 6.381 1.00 0.00 H new ATOM 0 HE2 PHE B 8 -19.711 4.014 6.803 1.00 0.00 H new ATOM 0 HZ PHE B 8 -17.790 4.623 5.358 1.00 0.00 H new ATOM 1892 N SER B 9 -15.303 6.802 13.115 1.00 0.00 N ATOM 1893 CA SER B 9 -15.485 7.485 14.426 1.00 0.00 C ATOM 1894 C SER B 9 -15.214 8.985 14.263 1.00 0.00 C ATOM 1895 O SER B 9 -16.071 9.733 13.837 1.00 0.00 O ATOM 1896 CB SER B 9 -14.517 6.891 15.450 1.00 0.00 C ATOM 1897 OG SER B 9 -15.003 5.625 15.877 1.00 0.00 O ATOM 0 H SER B 9 -14.337 6.726 12.795 1.00 0.00 H new ATOM 0 HA SER B 9 -16.508 7.341 14.774 1.00 0.00 H new ATOM 0 HB2 SER B 9 -13.525 6.783 15.010 1.00 0.00 H new ATOM 0 HB3 SER B 9 -14.416 7.561 16.304 1.00 0.00 H new ATOM 0 HG SER B 9 -14.505 4.913 15.423 1.00 0.00 H new ATOM 1903 N SER B 10 -14.032 9.435 14.595 1.00 0.00 N ATOM 1904 CA SER B 10 -13.726 10.888 14.450 1.00 0.00 C ATOM 1905 C SER B 10 -12.220 11.121 14.549 1.00 0.00 C ATOM 1906 O SER B 10 -11.668 11.982 13.893 1.00 0.00 O ATOM 1907 CB SER B 10 -14.437 11.672 15.554 1.00 0.00 C ATOM 1908 OG SER B 10 -15.536 12.378 14.993 1.00 0.00 O ATOM 0 H SER B 10 -13.270 8.863 14.958 1.00 0.00 H new ATOM 0 HA SER B 10 -14.075 11.229 13.475 1.00 0.00 H new ATOM 0 HB2 SER B 10 -14.785 10.993 16.332 1.00 0.00 H new ATOM 0 HB3 SER B 10 -13.744 12.369 16.025 1.00 0.00 H new ATOM 0 HG SER B 10 -16.058 11.773 14.426 1.00 0.00 H new ATOM 1914 N THR B 11 -11.558 10.366 15.369 1.00 0.00 N ATOM 1915 CA THR B 11 -10.084 10.539 15.527 1.00 0.00 C ATOM 1916 C THR B 11 -9.345 9.546 14.628 1.00 0.00 C ATOM 1917 O THR B 11 -9.903 8.995 13.701 1.00 0.00 O ATOM 1918 CB THR B 11 -9.697 10.288 16.985 1.00 0.00 C ATOM 1919 OG1 THR B 11 -10.838 9.852 17.709 1.00 0.00 O ATOM 1920 CG2 THR B 11 -9.161 11.579 17.603 1.00 0.00 C ATOM 0 H THR B 11 -11.971 9.631 15.943 1.00 0.00 H new ATOM 0 HA THR B 11 -9.809 11.555 15.243 1.00 0.00 H new ATOM 0 HB THR B 11 -8.925 9.520 17.028 1.00 0.00 H new ATOM 0 HG1 THR B 11 -10.590 9.689 18.643 1.00 0.00 H new ATOM 0 HG21 THR B 11 -8.886 11.398 18.642 1.00 0.00 H new ATOM 0 HG22 THR B 11 -8.284 11.911 17.048 1.00 0.00 H new ATOM 0 HG23 THR B 11 -9.931 12.350 17.560 1.00 0.00 H new ATOM 1928 N GLU B 12 -8.087 9.316 14.900 1.00 0.00 N ATOM 1929 CA GLU B 12 -7.299 8.360 14.070 1.00 0.00 C ATOM 1930 C GLU B 12 -6.884 9.035 12.761 1.00 0.00 C ATOM 1931 O GLU B 12 -7.712 9.430 11.964 1.00 0.00 O ATOM 1932 CB GLU B 12 -8.148 7.126 13.763 1.00 0.00 C ATOM 1933 CG GLU B 12 -7.315 5.865 13.999 1.00 0.00 C ATOM 1934 CD GLU B 12 -6.843 5.832 15.454 1.00 0.00 C ATOM 1935 OE1 GLU B 12 -7.203 6.732 16.194 1.00 0.00 O ATOM 1936 OE2 GLU B 12 -6.129 4.907 15.804 1.00 0.00 O ATOM 0 H GLU B 12 -7.570 9.751 15.664 1.00 0.00 H new ATOM 0 HA GLU B 12 -6.407 8.058 14.619 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -9.034 7.114 14.397 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -8.495 7.158 12.730 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -7.908 4.978 13.777 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -6.457 5.851 13.327 1.00 0.00 H new ATOM 1943 N LYS B 13 -5.604 9.168 12.532 1.00 0.00 N ATOM 1944 CA LYS B 13 -5.133 9.816 11.276 1.00 0.00 C ATOM 1945 C LYS B 13 -4.110 8.911 10.582 1.00 0.00 C ATOM 1946 O LYS B 13 -3.648 9.202 9.496 1.00 0.00 O ATOM 1947 CB LYS B 13 -4.481 11.159 11.610 1.00 0.00 C ATOM 1948 CG LYS B 13 -4.737 12.150 10.472 1.00 0.00 C ATOM 1949 CD LYS B 13 -5.430 13.398 11.025 1.00 0.00 C ATOM 1950 CE LYS B 13 -6.823 13.024 11.538 1.00 0.00 C ATOM 1951 NZ LYS B 13 -6.983 13.511 12.937 1.00 0.00 N ATOM 0 H LYS B 13 -4.865 8.855 13.162 1.00 0.00 H new ATOM 0 HA LYS B 13 -5.982 9.977 10.612 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -4.886 11.549 12.544 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -3.409 11.028 11.758 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -3.795 12.425 9.997 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -5.358 11.687 9.705 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -4.837 13.829 11.832 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -5.509 14.158 10.247 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -7.588 13.464 10.898 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -6.958 11.943 11.500 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -7.929 13.258 13.287 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -6.261 13.071 13.542 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -6.871 14.545 12.960 1.00 0.00 H new ATOM 1965 N ASN B 14 -3.754 7.815 11.197 1.00 0.00 N ATOM 1966 CA ASN B 14 -2.763 6.894 10.568 1.00 0.00 C ATOM 1967 C ASN B 14 -3.476 6.000 9.552 1.00 0.00 C ATOM 1968 O ASN B 14 -4.560 6.308 9.099 1.00 0.00 O ATOM 1969 CB ASN B 14 -2.120 6.024 11.652 1.00 0.00 C ATOM 1970 CG ASN B 14 -1.520 6.918 12.739 1.00 0.00 C ATOM 1971 OD1 ASN B 14 -1.808 6.749 13.907 1.00 0.00 O ATOM 1972 ND2 ASN B 14 -0.692 7.868 12.404 1.00 0.00 N ATOM 0 H ASN B 14 -4.106 7.518 12.107 1.00 0.00 H new ATOM 0 HA ASN B 14 -1.992 7.475 10.063 1.00 0.00 H new ATOM 0 HB2 ASN B 14 -2.865 5.357 12.086 1.00 0.00 H new ATOM 0 HB3 ASN B 14 -1.344 5.395 11.215 1.00 0.00 H new ATOM 0 HD21 ASN B 14 -0.287 8.468 13.122 1.00 0.00 H new ATOM 0 HD22 ASN B 14 -0.449 8.011 11.424 1.00 0.00 H new ATOM 1979 N CYS B 15 -2.880 4.892 9.191 1.00 0.00 N ATOM 1980 CA CYS B 15 -3.536 3.982 8.208 1.00 0.00 C ATOM 1981 C CYS B 15 -4.944 3.656 8.705 1.00 0.00 C ATOM 1982 O CYS B 15 -5.156 2.706 9.433 1.00 0.00 O ATOM 1983 CB CYS B 15 -2.710 2.695 8.075 1.00 0.00 C ATOM 1984 SG CYS B 15 -3.697 1.378 7.308 1.00 0.00 S ATOM 0 H CYS B 15 -1.971 4.580 9.534 1.00 0.00 H new ATOM 0 HA CYS B 15 -3.598 4.462 7.232 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -1.821 2.887 7.474 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -2.367 2.374 9.058 1.00 0.00 H new ATOM 1989 N CYS B 16 -5.904 4.446 8.321 1.00 0.00 N ATOM 1990 CA CYS B 16 -7.299 4.201 8.770 1.00 0.00 C ATOM 1991 C CYS B 16 -8.224 4.258 7.554 1.00 0.00 C ATOM 1992 O CYS B 16 -8.268 5.243 6.840 1.00 0.00 O ATOM 1993 CB CYS B 16 -7.682 5.277 9.801 1.00 0.00 C ATOM 1994 SG CYS B 16 -9.482 5.499 9.878 1.00 0.00 S ATOM 0 H CYS B 16 -5.781 5.255 7.712 1.00 0.00 H new ATOM 0 HA CYS B 16 -7.391 3.220 9.235 1.00 0.00 H new ATOM 0 HB2 CYS B 16 -7.305 4.994 10.784 1.00 0.00 H new ATOM 0 HB3 CYS B 16 -7.207 6.222 9.538 1.00 0.00 H new ATOM 1999 N VAL B 17 -8.961 3.212 7.312 1.00 0.00 N ATOM 2000 CA VAL B 17 -9.883 3.211 6.145 1.00 0.00 C ATOM 2001 C VAL B 17 -10.851 4.389 6.285 1.00 0.00 C ATOM 2002 O VAL B 17 -11.073 4.888 7.368 1.00 0.00 O ATOM 2003 CB VAL B 17 -10.662 1.891 6.119 1.00 0.00 C ATOM 2004 CG1 VAL B 17 -11.734 1.906 7.197 1.00 0.00 C ATOM 2005 CG2 VAL B 17 -11.334 1.708 4.762 1.00 0.00 C ATOM 0 H VAL B 17 -8.965 2.359 7.871 1.00 0.00 H new ATOM 0 HA VAL B 17 -9.321 3.309 5.217 1.00 0.00 H new ATOM 0 HB VAL B 17 -9.966 1.071 6.298 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -12.285 0.966 7.175 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.266 2.030 8.174 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -12.420 2.733 7.016 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.885 0.768 4.753 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -12.022 2.534 4.583 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -10.575 1.692 3.980 1.00 0.00 H new ATOM 2015 N ARG B 18 -11.432 4.839 5.209 1.00 0.00 N ATOM 2016 CA ARG B 18 -12.383 5.980 5.311 1.00 0.00 C ATOM 2017 C ARG B 18 -13.566 5.740 4.384 1.00 0.00 C ATOM 2018 O ARG B 18 -13.779 4.650 3.888 1.00 0.00 O ATOM 2019 CB ARG B 18 -11.696 7.282 4.900 1.00 0.00 C ATOM 2020 CG ARG B 18 -10.281 7.325 5.469 1.00 0.00 C ATOM 2021 CD ARG B 18 -10.324 7.826 6.913 1.00 0.00 C ATOM 2022 NE ARG B 18 -9.135 8.687 7.174 1.00 0.00 N ATOM 2023 CZ ARG B 18 -9.040 9.858 6.605 1.00 0.00 C ATOM 2024 NH1 ARG B 18 -10.068 10.660 6.588 1.00 0.00 N ATOM 2025 NH2 ARG B 18 -7.915 10.225 6.053 1.00 0.00 N ATOM 0 H ARG B 18 -11.291 4.469 4.269 1.00 0.00 H new ATOM 0 HA ARG B 18 -12.722 6.059 6.344 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -11.663 7.358 3.813 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -12.269 8.136 5.262 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -9.833 6.332 5.431 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -9.655 7.981 4.864 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -11.240 8.390 7.087 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -10.334 6.982 7.602 1.00 0.00 H new ATOM 0 HE ARG B 18 -8.396 8.361 7.797 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -10.946 10.372 7.019 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -9.994 11.575 6.143 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -7.111 9.597 6.067 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -7.840 11.140 5.608 1.00 0.00 H new ATOM 2039 N GLN B 19 -14.328 6.764 4.140 1.00 0.00 N ATOM 2040 CA GLN B 19 -15.503 6.623 3.237 1.00 0.00 C ATOM 2041 C GLN B 19 -15.085 6.989 1.816 1.00 0.00 C ATOM 2042 O GLN B 19 -14.352 7.933 1.598 1.00 0.00 O ATOM 2043 CB GLN B 19 -16.624 7.556 3.702 1.00 0.00 C ATOM 2044 CG GLN B 19 -16.168 9.011 3.568 1.00 0.00 C ATOM 2045 CD GLN B 19 -17.090 9.748 2.595 1.00 0.00 C ATOM 2046 OE1 GLN B 19 -17.474 9.207 1.577 1.00 0.00 O ATOM 2047 NE2 GLN B 19 -17.462 10.969 2.867 1.00 0.00 N ATOM 0 H GLN B 19 -14.189 7.697 4.528 1.00 0.00 H new ATOM 0 HA GLN B 19 -15.864 5.595 3.260 1.00 0.00 H new ATOM 0 HB2 GLN B 19 -17.521 7.389 3.106 1.00 0.00 H new ATOM 0 HB3 GLN B 19 -16.885 7.340 4.738 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -16.185 9.500 4.542 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -15.139 9.049 3.210 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -17.139 11.422 3.722 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -18.076 11.470 2.225 1.00 0.00 H new ATOM 2056 N LEU B 20 -15.536 6.246 0.846 1.00 0.00 N ATOM 2057 CA LEU B 20 -15.151 6.553 -0.557 1.00 0.00 C ATOM 2058 C LEU B 20 -16.293 6.186 -1.496 1.00 0.00 C ATOM 2059 O LEU B 20 -16.081 5.589 -2.532 1.00 0.00 O ATOM 2060 CB LEU B 20 -13.916 5.733 -0.931 1.00 0.00 C ATOM 2061 CG LEU B 20 -13.365 6.210 -2.276 1.00 0.00 C ATOM 2062 CD1 LEU B 20 -13.011 7.694 -2.189 1.00 0.00 C ATOM 2063 CD2 LEU B 20 -12.108 5.410 -2.621 1.00 0.00 C ATOM 0 H LEU B 20 -16.153 5.442 0.964 1.00 0.00 H new ATOM 0 HA LEU B 20 -14.934 7.617 -0.646 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -13.153 5.834 -0.159 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -14.174 4.675 -0.988 1.00 0.00 H new ATOM 0 HG LEU B 20 -14.119 6.062 -3.049 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -12.619 8.031 -3.148 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -13.904 8.267 -1.940 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -12.257 7.844 -1.416 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -11.713 5.748 -3.579 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -11.357 5.560 -1.846 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -12.357 4.351 -2.684 1.00 0.00 H new ATOM 2075 N TYR B 21 -17.501 6.534 -1.160 1.00 0.00 N ATOM 2076 CA TYR B 21 -18.615 6.186 -2.073 1.00 0.00 C ATOM 2077 C TYR B 21 -18.243 6.641 -3.477 1.00 0.00 C ATOM 2078 O TYR B 21 -17.810 7.758 -3.684 1.00 0.00 O ATOM 2079 CB TYR B 21 -19.907 6.881 -1.652 1.00 0.00 C ATOM 2080 CG TYR B 21 -20.975 6.558 -2.670 1.00 0.00 C ATOM 2081 CD1 TYR B 21 -20.955 7.179 -3.927 1.00 0.00 C ATOM 2082 CD2 TYR B 21 -21.976 5.632 -2.363 1.00 0.00 C ATOM 2083 CE1 TYR B 21 -21.939 6.874 -4.876 1.00 0.00 C ATOM 2084 CE2 TYR B 21 -22.960 5.325 -3.311 1.00 0.00 C ATOM 2085 CZ TYR B 21 -22.942 5.947 -4.568 1.00 0.00 C ATOM 2086 OH TYR B 21 -23.912 5.646 -5.501 1.00 0.00 O ATOM 0 H TYR B 21 -17.760 7.034 -0.310 1.00 0.00 H new ATOM 0 HA TYR B 21 -18.778 5.109 -2.040 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -20.213 6.545 -0.661 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -19.755 7.959 -1.590 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -20.180 7.893 -4.164 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -21.991 5.153 -1.395 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -21.924 7.353 -5.844 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -23.733 4.609 -3.074 1.00 0.00 H new ATOM 0 HH TYR B 21 -24.531 4.984 -5.128 1.00 0.00 H new ATOM 2096 N ILE B 22 -18.404 5.792 -4.444 1.00 0.00 N ATOM 2097 CA ILE B 22 -18.053 6.186 -5.830 1.00 0.00 C ATOM 2098 C ILE B 22 -19.281 6.049 -6.723 1.00 0.00 C ATOM 2099 O ILE B 22 -19.800 4.968 -6.918 1.00 0.00 O ATOM 2100 CB ILE B 22 -16.940 5.278 -6.353 1.00 0.00 C ATOM 2101 CG1 ILE B 22 -15.734 5.355 -5.415 1.00 0.00 C ATOM 2102 CG2 ILE B 22 -16.523 5.734 -7.753 1.00 0.00 C ATOM 2103 CD1 ILE B 22 -14.528 4.683 -6.073 1.00 0.00 C ATOM 0 H ILE B 22 -18.763 4.843 -4.336 1.00 0.00 H new ATOM 0 HA ILE B 22 -17.711 7.221 -5.837 1.00 0.00 H new ATOM 0 HB ILE B 22 -17.303 4.251 -6.397 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -15.504 6.396 -5.187 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -15.965 4.865 -4.469 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -15.729 5.086 -8.125 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -17.380 5.680 -8.424 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -16.162 6.761 -7.708 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -13.670 4.739 -5.403 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -14.761 3.638 -6.278 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -14.293 5.192 -7.007 1.00 0.00 H new ATOM 2115 N ASP B 23 -19.740 7.130 -7.284 1.00 0.00 N ATOM 2116 CA ASP B 23 -20.919 7.045 -8.179 1.00 0.00 C ATOM 2117 C ASP B 23 -20.415 6.632 -9.554 1.00 0.00 C ATOM 2118 O ASP B 23 -20.047 7.454 -10.359 1.00 0.00 O ATOM 2119 CB ASP B 23 -21.619 8.404 -8.251 1.00 0.00 C ATOM 2120 CG ASP B 23 -22.672 8.383 -9.362 1.00 0.00 C ATOM 2121 OD1 ASP B 23 -22.844 7.340 -9.971 1.00 0.00 O ATOM 2122 OD2 ASP B 23 -23.291 9.410 -9.584 1.00 0.00 O ATOM 0 H ASP B 23 -19.350 8.064 -7.161 1.00 0.00 H new ATOM 0 HA ASP B 23 -21.640 6.318 -7.805 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -22.090 8.633 -7.295 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -20.889 9.190 -8.443 1.00 0.00 H new ATOM 2127 N PHE B 24 -20.374 5.346 -9.787 1.00 0.00 N ATOM 2128 CA PHE B 24 -19.874 4.777 -11.079 1.00 0.00 C ATOM 2129 C PHE B 24 -19.703 5.850 -12.162 1.00 0.00 C ATOM 2130 O PHE B 24 -18.635 6.017 -12.710 1.00 0.00 O ATOM 2131 CB PHE B 24 -20.863 3.720 -11.572 1.00 0.00 C ATOM 2132 CG PHE B 24 -20.593 2.415 -10.864 1.00 0.00 C ATOM 2133 CD1 PHE B 24 -19.474 1.649 -11.213 1.00 0.00 C ATOM 2134 CD2 PHE B 24 -21.457 1.971 -9.855 1.00 0.00 C ATOM 2135 CE1 PHE B 24 -19.219 0.441 -10.552 1.00 0.00 C ATOM 2136 CE2 PHE B 24 -21.202 0.762 -9.197 1.00 0.00 C ATOM 2137 CZ PHE B 24 -20.083 -0.002 -9.545 1.00 0.00 C ATOM 0 H PHE B 24 -20.676 4.642 -9.113 1.00 0.00 H new ATOM 0 HA PHE B 24 -18.893 4.339 -10.892 1.00 0.00 H new ATOM 0 HB2 PHE B 24 -21.886 4.045 -11.381 1.00 0.00 H new ATOM 0 HB3 PHE B 24 -20.766 3.589 -12.650 1.00 0.00 H new ATOM 0 HD1 PHE B 24 -18.808 1.990 -11.992 1.00 0.00 H new ATOM 0 HD2 PHE B 24 -22.320 2.561 -9.585 1.00 0.00 H new ATOM 0 HE1 PHE B 24 -18.355 -0.149 -10.820 1.00 0.00 H new ATOM 0 HE2 PHE B 24 -21.869 0.419 -8.420 1.00 0.00 H new ATOM 0 HZ PHE B 24 -19.886 -0.934 -9.036 1.00 0.00 H new ATOM 2147 N ARG B 25 -20.745 6.562 -12.488 1.00 0.00 N ATOM 2148 CA ARG B 25 -20.636 7.596 -13.560 1.00 0.00 C ATOM 2149 C ARG B 25 -20.029 8.904 -13.029 1.00 0.00 C ATOM 2150 O ARG B 25 -19.216 9.524 -13.685 1.00 0.00 O ATOM 2151 CB ARG B 25 -22.031 7.883 -14.119 1.00 0.00 C ATOM 2152 CG ARG B 25 -21.930 8.924 -15.236 1.00 0.00 C ATOM 2153 CD ARG B 25 -23.052 8.697 -16.250 1.00 0.00 C ATOM 2154 NE ARG B 25 -23.552 10.009 -16.744 1.00 0.00 N ATOM 2155 CZ ARG B 25 -22.901 10.649 -17.678 1.00 0.00 C ATOM 2156 NH1 ARG B 25 -21.615 10.845 -17.562 1.00 0.00 N ATOM 2157 NH2 ARG B 25 -23.536 11.099 -18.726 1.00 0.00 N ATOM 0 H ARG B 25 -21.667 6.475 -12.061 1.00 0.00 H new ATOM 0 HA ARG B 25 -19.978 7.210 -14.339 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -22.477 6.965 -14.502 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -22.684 8.247 -13.326 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -22.001 9.928 -14.819 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -20.960 8.851 -15.729 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -22.686 8.098 -17.084 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -23.865 8.137 -15.788 1.00 0.00 H new ATOM 0 HE ARG B 25 -24.405 10.409 -16.352 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -21.118 10.498 -16.741 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -21.107 11.345 -18.292 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -24.541 10.951 -18.816 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -23.027 11.599 -19.455 1.00 0.00 H new ATOM 2171 N LYS B 26 -20.435 9.351 -11.875 1.00 0.00 N ATOM 2172 CA LYS B 26 -19.896 10.641 -11.345 1.00 0.00 C ATOM 2173 C LYS B 26 -18.387 10.553 -11.106 1.00 0.00 C ATOM 2174 O LYS B 26 -17.636 11.435 -11.474 1.00 0.00 O ATOM 2175 CB LYS B 26 -20.572 10.958 -10.015 1.00 0.00 C ATOM 2176 CG LYS B 26 -20.692 12.474 -9.846 1.00 0.00 C ATOM 2177 CD LYS B 26 -21.842 12.995 -10.711 1.00 0.00 C ATOM 2178 CE LYS B 26 -22.761 13.876 -9.864 1.00 0.00 C ATOM 2179 NZ LYS B 26 -23.738 14.569 -10.751 1.00 0.00 N ATOM 0 H LYS B 26 -21.114 8.884 -11.275 1.00 0.00 H new ATOM 0 HA LYS B 26 -20.095 11.420 -12.081 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -21.560 10.499 -9.980 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -19.995 10.535 -9.193 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -20.870 12.721 -8.799 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -19.759 12.958 -10.134 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -21.448 13.565 -11.552 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -22.405 12.160 -11.128 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -23.288 13.269 -9.128 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -22.173 14.608 -9.311 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -24.364 15.169 -10.176 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -23.226 15.160 -11.437 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -24.307 13.862 -11.260 1.00 0.00 H new ATOM 2193 N ASP B 27 -17.945 9.522 -10.448 1.00 0.00 N ATOM 2194 CA ASP B 27 -16.498 9.398 -10.128 1.00 0.00 C ATOM 2195 C ASP B 27 -15.723 8.679 -11.241 1.00 0.00 C ATOM 2196 O ASP B 27 -14.829 9.243 -11.840 1.00 0.00 O ATOM 2197 CB ASP B 27 -16.368 8.611 -8.830 1.00 0.00 C ATOM 2198 CG ASP B 27 -16.369 9.576 -7.645 1.00 0.00 C ATOM 2199 OD1 ASP B 27 -15.476 10.406 -7.582 1.00 0.00 O ATOM 2200 OD2 ASP B 27 -17.262 9.470 -6.820 1.00 0.00 O ATOM 0 H ASP B 27 -18.528 8.754 -10.115 1.00 0.00 H new ATOM 0 HA ASP B 27 -16.074 10.397 -10.030 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -17.192 7.904 -8.737 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -15.447 8.028 -8.837 1.00 0.00 H new ATOM 2205 N LEU B 28 -16.026 7.438 -11.501 1.00 0.00 N ATOM 2206 CA LEU B 28 -15.262 6.697 -12.552 1.00 0.00 C ATOM 2207 C LEU B 28 -15.895 6.905 -13.928 1.00 0.00 C ATOM 2208 O LEU B 28 -15.321 6.552 -14.939 1.00 0.00 O ATOM 2209 CB LEU B 28 -15.276 5.202 -12.231 1.00 0.00 C ATOM 2210 CG LEU B 28 -14.812 4.974 -10.794 1.00 0.00 C ATOM 2211 CD1 LEU B 28 -14.973 3.498 -10.439 1.00 0.00 C ATOM 2212 CD2 LEU B 28 -13.340 5.365 -10.665 1.00 0.00 C ATOM 0 H LEU B 28 -16.762 6.906 -11.038 1.00 0.00 H new ATOM 0 HA LEU B 28 -14.240 7.076 -12.566 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -16.281 4.802 -12.366 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -14.625 4.667 -12.922 1.00 0.00 H new ATOM 0 HG LEU B 28 -15.412 5.583 -10.118 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -14.642 3.332 -9.414 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -16.021 3.213 -10.533 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.371 2.893 -11.117 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -13.009 5.202 -9.639 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -12.741 4.755 -11.341 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.219 6.417 -10.923 1.00 0.00 H new ATOM 2224 N GLY B 29 -17.073 7.459 -13.988 1.00 0.00 N ATOM 2225 CA GLY B 29 -17.719 7.661 -15.315 1.00 0.00 C ATOM 2226 C GLY B 29 -17.944 6.296 -15.975 1.00 0.00 C ATOM 2227 O GLY B 29 -18.253 6.204 -17.147 1.00 0.00 O ATOM 0 H GLY B 29 -17.613 7.778 -13.184 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -18.669 8.182 -15.196 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -17.090 8.286 -15.949 1.00 0.00 H new ATOM 2231 N TRP B 30 -17.785 5.234 -15.228 1.00 0.00 N ATOM 2232 CA TRP B 30 -17.981 3.874 -15.799 1.00 0.00 C ATOM 2233 C TRP B 30 -19.251 3.846 -16.645 1.00 0.00 C ATOM 2234 O TRP B 30 -20.327 4.175 -16.184 1.00 0.00 O ATOM 2235 CB TRP B 30 -18.104 2.861 -14.659 1.00 0.00 C ATOM 2236 CG TRP B 30 -16.742 2.374 -14.283 1.00 0.00 C ATOM 2237 CD1 TRP B 30 -15.581 2.953 -14.663 1.00 0.00 C ATOM 2238 CD2 TRP B 30 -16.379 1.224 -13.467 1.00 0.00 C ATOM 2239 NE1 TRP B 30 -14.528 2.230 -14.133 1.00 0.00 N ATOM 2240 CE2 TRP B 30 -14.968 1.154 -13.389 1.00 0.00 C ATOM 2241 CE3 TRP B 30 -17.128 0.243 -12.794 1.00 0.00 C ATOM 2242 CZ2 TRP B 30 -14.324 0.147 -12.671 1.00 0.00 C ATOM 2243 CZ3 TRP B 30 -16.482 -0.774 -12.071 1.00 0.00 C ATOM 2244 CH2 TRP B 30 -15.083 -0.821 -12.009 1.00 0.00 C ATOM 0 H TRP B 30 -17.526 5.254 -14.242 1.00 0.00 H new ATOM 0 HA TRP B 30 -17.127 3.619 -16.427 1.00 0.00 H new ATOM 0 HB2 TRP B 30 -18.589 3.322 -13.798 1.00 0.00 H new ATOM 0 HB3 TRP B 30 -18.730 2.024 -14.967 1.00 0.00 H new ATOM 0 HD1 TRP B 30 -15.491 3.835 -15.279 1.00 0.00 H new ATOM 0 HE1 TRP B 30 -13.545 2.464 -14.275 1.00 0.00 H new ATOM 0 HE3 TRP B 30 -18.207 0.271 -12.833 1.00 0.00 H new ATOM 0 HZ2 TRP B 30 -13.245 0.116 -12.627 1.00 0.00 H new ATOM 0 HZ3 TRP B 30 -17.067 -1.524 -11.560 1.00 0.00 H new ATOM 0 HH2 TRP B 30 -14.592 -1.604 -11.450 1.00 0.00 H new ATOM 2255 N LYS B 31 -19.133 3.459 -17.884 1.00 0.00 N ATOM 2256 CA LYS B 31 -20.316 3.410 -18.770 1.00 0.00 C ATOM 2257 C LYS B 31 -20.748 1.957 -18.966 1.00 0.00 C ATOM 2258 O LYS B 31 -21.805 1.682 -19.499 1.00 0.00 O ATOM 2259 CB LYS B 31 -19.927 4.007 -20.115 1.00 0.00 C ATOM 2260 CG LYS B 31 -20.216 5.511 -20.113 1.00 0.00 C ATOM 2261 CD LYS B 31 -20.071 6.062 -21.533 1.00 0.00 C ATOM 2262 CE LYS B 31 -18.897 7.042 -21.581 1.00 0.00 C ATOM 2263 NZ LYS B 31 -18.794 7.626 -22.948 1.00 0.00 N ATOM 0 H LYS B 31 -18.256 3.173 -18.320 1.00 0.00 H new ATOM 0 HA LYS B 31 -21.141 3.970 -18.330 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -18.869 3.830 -20.310 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -20.485 3.520 -20.915 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -21.223 5.698 -19.740 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -19.527 6.023 -19.441 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -19.907 5.246 -22.236 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -20.990 6.564 -21.836 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -19.040 7.834 -20.845 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -17.971 6.529 -21.322 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -17.996 8.292 -22.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -18.639 6.865 -23.640 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -19.675 8.129 -23.178 1.00 0.00 H new ATOM 2277 N TRP B 32 -19.937 1.022 -18.550 1.00 0.00 N ATOM 2278 CA TRP B 32 -20.310 -0.408 -18.731 1.00 0.00 C ATOM 2279 C TRP B 32 -21.177 -0.872 -17.563 1.00 0.00 C ATOM 2280 O TRP B 32 -21.642 -1.990 -17.538 1.00 0.00 O ATOM 2281 CB TRP B 32 -19.047 -1.270 -18.811 1.00 0.00 C ATOM 2282 CG TRP B 32 -18.446 -1.440 -17.450 1.00 0.00 C ATOM 2283 CD1 TRP B 32 -17.689 -0.518 -16.817 1.00 0.00 C ATOM 2284 CD2 TRP B 32 -18.534 -2.583 -16.549 1.00 0.00 C ATOM 2285 NE1 TRP B 32 -17.294 -1.024 -15.595 1.00 0.00 N ATOM 2286 CE2 TRP B 32 -17.791 -2.294 -15.382 1.00 0.00 C ATOM 2287 CE3 TRP B 32 -19.177 -3.830 -16.631 1.00 0.00 C ATOM 2288 CZ2 TRP B 32 -17.686 -3.209 -14.335 1.00 0.00 C ATOM 2289 CZ3 TRP B 32 -19.078 -4.754 -15.579 1.00 0.00 C ATOM 2290 CH2 TRP B 32 -18.330 -4.444 -14.432 1.00 0.00 C ATOM 0 H TRP B 32 -19.039 1.186 -18.096 1.00 0.00 H new ATOM 0 HA TRP B 32 -20.874 -0.512 -19.658 1.00 0.00 H new ATOM 0 HB2 TRP B 32 -19.290 -2.245 -19.233 1.00 0.00 H new ATOM 0 HB3 TRP B 32 -18.323 -0.805 -19.480 1.00 0.00 H new ATOM 0 HD1 TRP B 32 -17.434 0.457 -17.204 1.00 0.00 H new ATOM 0 HE1 TRP B 32 -16.706 -0.521 -14.930 1.00 0.00 H new ATOM 0 HE3 TRP B 32 -19.752 -4.079 -17.511 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 -17.110 -2.964 -13.455 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 -19.579 -5.708 -15.652 1.00 0.00 H new ATOM 0 HH2 TRP B 32 -18.253 -5.159 -13.626 1.00 0.00 H new ATOM 2301 N ILE B 33 -21.399 -0.024 -16.598 1.00 0.00 N ATOM 2302 CA ILE B 33 -22.238 -0.429 -15.436 1.00 0.00 C ATOM 2303 C ILE B 33 -23.409 0.549 -15.293 1.00 0.00 C ATOM 2304 O ILE B 33 -23.232 1.749 -15.260 1.00 0.00 O ATOM 2305 CB ILE B 33 -21.377 -0.432 -14.166 1.00 0.00 C ATOM 2306 CG1 ILE B 33 -20.631 -1.762 -14.084 1.00 0.00 C ATOM 2307 CG2 ILE B 33 -22.255 -0.271 -12.920 1.00 0.00 C ATOM 2308 CD1 ILE B 33 -19.648 -1.733 -12.916 1.00 0.00 C ATOM 0 H ILE B 33 -21.037 0.929 -16.563 1.00 0.00 H new ATOM 0 HA ILE B 33 -22.636 -1.432 -15.592 1.00 0.00 H new ATOM 0 HB ILE B 33 -20.674 0.400 -14.208 1.00 0.00 H new ATOM 0 HG12 ILE B 33 -21.340 -2.580 -13.954 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -20.097 -1.948 -15.016 1.00 0.00 H new ATOM 0 HG21 ILE B 33 -21.627 -0.275 -12.029 1.00 0.00 H new ATOM 0 HG22 ILE B 33 -22.798 0.673 -12.977 1.00 0.00 H new ATOM 0 HG23 ILE B 33 -22.966 -1.096 -12.867 1.00 0.00 H new ATOM 0 HD11 ILE B 33 -19.119 -2.684 -12.862 1.00 0.00 H new ATOM 0 HD12 ILE B 33 -18.930 -0.926 -13.064 1.00 0.00 H new ATOM 0 HD13 ILE B 33 -20.192 -1.568 -11.986 1.00 0.00 H new ATOM 2320 N HIS B 34 -24.605 0.035 -15.211 1.00 0.00 N ATOM 2321 CA HIS B 34 -25.796 0.919 -15.077 1.00 0.00 C ATOM 2322 C HIS B 34 -26.156 1.073 -13.594 1.00 0.00 C ATOM 2323 O HIS B 34 -26.274 2.170 -13.086 1.00 0.00 O ATOM 2324 CB HIS B 34 -26.973 0.294 -15.840 1.00 0.00 C ATOM 2325 CG HIS B 34 -28.275 0.884 -15.366 1.00 0.00 C ATOM 2326 ND1 HIS B 34 -28.597 2.217 -15.564 1.00 0.00 N ATOM 2327 CD2 HIS B 34 -29.343 0.334 -14.702 1.00 0.00 C ATOM 2328 CE1 HIS B 34 -29.816 2.424 -15.029 1.00 0.00 C ATOM 2329 NE2 HIS B 34 -30.315 1.307 -14.490 1.00 0.00 N ATOM 0 H HIS B 34 -24.809 -0.964 -15.231 1.00 0.00 H new ATOM 0 HA HIS B 34 -25.576 1.903 -15.492 1.00 0.00 H new ATOM 0 HB2 HIS B 34 -26.855 0.468 -16.910 1.00 0.00 H new ATOM 0 HB3 HIS B 34 -26.980 -0.786 -15.691 1.00 0.00 H new ATOM 0 HD1 HIS B 34 -28.017 2.915 -16.030 1.00 0.00 H new ATOM 0 HD2 HIS B 34 -29.418 -0.698 -14.391 1.00 0.00 H new ATOM 0 HE1 HIS B 34 -30.327 3.375 -15.035 1.00 0.00 H new ATOM 2337 N GLU B 35 -26.337 -0.016 -12.900 1.00 0.00 N ATOM 2338 CA GLU B 35 -26.696 0.076 -11.456 1.00 0.00 C ATOM 2339 C GLU B 35 -25.734 -0.779 -10.627 1.00 0.00 C ATOM 2340 O GLU B 35 -25.150 -1.717 -11.132 1.00 0.00 O ATOM 2341 CB GLU B 35 -28.128 -0.426 -11.255 1.00 0.00 C ATOM 2342 CG GLU B 35 -29.111 0.715 -11.522 1.00 0.00 C ATOM 2343 CD GLU B 35 -30.493 0.136 -11.829 1.00 0.00 C ATOM 2344 OE1 GLU B 35 -30.555 -0.856 -12.536 1.00 0.00 O ATOM 2345 OE2 GLU B 35 -31.468 0.695 -11.353 1.00 0.00 O ATOM 0 H GLU B 35 -26.252 -0.963 -13.268 1.00 0.00 H new ATOM 0 HA GLU B 35 -26.623 1.114 -11.132 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -28.330 -1.259 -11.928 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -28.255 -0.799 -10.239 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -29.165 1.373 -10.655 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -28.764 1.320 -12.360 1.00 0.00 H new ATOM 2352 N PRO B 36 -25.603 -0.428 -9.374 1.00 0.00 N ATOM 2353 CA PRO B 36 -26.320 0.714 -8.777 1.00 0.00 C ATOM 2354 C PRO B 36 -25.647 2.033 -9.169 1.00 0.00 C ATOM 2355 O PRO B 36 -24.590 2.048 -9.767 1.00 0.00 O ATOM 2356 CB PRO B 36 -26.197 0.467 -7.270 1.00 0.00 C ATOM 2357 CG PRO B 36 -24.968 -0.453 -7.079 1.00 0.00 C ATOM 2358 CD PRO B 36 -24.721 -1.145 -8.433 1.00 0.00 C ATOM 0 HA PRO B 36 -27.355 0.791 -9.109 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -26.067 1.406 -6.732 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -27.099 -0.003 -6.878 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -24.095 0.125 -6.774 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -25.153 -1.189 -6.296 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -23.676 -1.071 -8.733 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -24.966 -2.206 -8.388 1.00 0.00 H new ATOM 2366 N LYS B 37 -26.248 3.140 -8.828 1.00 0.00 N ATOM 2367 CA LYS B 37 -25.649 4.450 -9.168 1.00 0.00 C ATOM 2368 C LYS B 37 -24.200 4.482 -8.687 1.00 0.00 C ATOM 2369 O LYS B 37 -23.331 5.042 -9.325 1.00 0.00 O ATOM 2370 CB LYS B 37 -26.445 5.539 -8.458 1.00 0.00 C ATOM 2371 CG LYS B 37 -27.574 6.030 -9.365 1.00 0.00 C ATOM 2372 CD LYS B 37 -27.767 7.536 -9.172 1.00 0.00 C ATOM 2373 CE LYS B 37 -26.487 8.269 -9.572 1.00 0.00 C ATOM 2374 NZ LYS B 37 -26.837 9.491 -10.351 1.00 0.00 N ATOM 0 H LYS B 37 -27.134 3.188 -8.325 1.00 0.00 H new ATOM 0 HA LYS B 37 -25.672 4.610 -10.246 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -26.857 5.152 -7.526 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -25.789 6.369 -8.196 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -27.338 5.814 -10.407 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -28.498 5.501 -9.131 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -28.604 7.887 -9.776 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -28.013 7.752 -8.132 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -25.919 8.542 -8.683 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -25.851 7.614 -10.168 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -25.966 9.990 -10.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -27.362 9.219 -11.206 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -27.427 10.118 -9.767 1.00 0.00 H new ATOM 2388 N GLY B 38 -23.937 3.882 -7.562 1.00 0.00 N ATOM 2389 CA GLY B 38 -22.548 3.870 -7.024 1.00 0.00 C ATOM 2390 C GLY B 38 -22.437 2.810 -5.929 1.00 0.00 C ATOM 2391 O GLY B 38 -23.083 1.782 -5.980 1.00 0.00 O ATOM 0 H GLY B 38 -24.627 3.397 -6.988 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -21.838 3.658 -7.824 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -22.293 4.851 -6.623 1.00 0.00 H new ATOM 2395 N TYR B 39 -21.624 3.050 -4.937 1.00 0.00 N ATOM 2396 CA TYR B 39 -21.473 2.055 -3.839 1.00 0.00 C ATOM 2397 C TYR B 39 -20.451 2.570 -2.824 1.00 0.00 C ATOM 2398 O TYR B 39 -19.835 3.597 -3.020 1.00 0.00 O ATOM 2399 CB TYR B 39 -20.998 0.723 -4.424 1.00 0.00 C ATOM 2400 CG TYR B 39 -19.544 0.826 -4.815 1.00 0.00 C ATOM 2401 CD1 TYR B 39 -19.144 1.716 -5.820 1.00 0.00 C ATOM 2402 CD2 TYR B 39 -18.599 0.025 -4.175 1.00 0.00 C ATOM 2403 CE1 TYR B 39 -17.795 1.802 -6.181 1.00 0.00 C ATOM 2404 CE2 TYR B 39 -17.249 0.111 -4.535 1.00 0.00 C ATOM 2405 CZ TYR B 39 -16.847 1.000 -5.538 1.00 0.00 C ATOM 2406 OH TYR B 39 -15.516 1.085 -5.893 1.00 0.00 O ATOM 0 H TYR B 39 -21.058 3.893 -4.840 1.00 0.00 H new ATOM 0 HA TYR B 39 -22.431 1.908 -3.341 1.00 0.00 H new ATOM 0 HB2 TYR B 39 -21.132 -0.074 -3.693 1.00 0.00 H new ATOM 0 HB3 TYR B 39 -21.600 0.462 -5.294 1.00 0.00 H new ATOM 0 HD1 TYR B 39 -19.877 2.336 -6.316 1.00 0.00 H new ATOM 0 HD2 TYR B 39 -18.909 -0.662 -3.401 1.00 0.00 H new ATOM 0 HE1 TYR B 39 -17.486 2.488 -6.956 1.00 0.00 H new ATOM 0 HE2 TYR B 39 -16.517 -0.509 -4.038 1.00 0.00 H new ATOM 0 HH TYR B 39 -15.219 0.225 -6.257 1.00 0.00 H new ATOM 2416 N HIS B 40 -20.262 1.867 -1.740 1.00 0.00 N ATOM 2417 CA HIS B 40 -19.277 2.327 -0.723 1.00 0.00 C ATOM 2418 C HIS B 40 -17.907 1.725 -1.042 1.00 0.00 C ATOM 2419 O HIS B 40 -17.479 0.766 -0.430 1.00 0.00 O ATOM 2420 CB HIS B 40 -19.725 1.870 0.666 1.00 0.00 C ATOM 2421 CG HIS B 40 -21.086 2.435 0.965 1.00 0.00 C ATOM 2422 ND1 HIS B 40 -22.234 1.966 0.344 1.00 0.00 N ATOM 2423 CD2 HIS B 40 -21.500 3.430 1.815 1.00 0.00 C ATOM 2424 CE1 HIS B 40 -23.273 2.672 0.827 1.00 0.00 C ATOM 2425 NE2 HIS B 40 -22.882 3.577 1.727 1.00 0.00 N ATOM 0 H HIS B 40 -20.746 0.997 -1.516 1.00 0.00 H new ATOM 0 HA HIS B 40 -19.213 3.415 -0.741 1.00 0.00 H new ATOM 0 HB2 HIS B 40 -19.754 0.781 0.711 1.00 0.00 H new ATOM 0 HB3 HIS B 40 -19.009 2.201 1.418 1.00 0.00 H new ATOM 0 HD2 HIS B 40 -20.852 4.011 2.455 1.00 0.00 H new ATOM 0 HE1 HIS B 40 -24.299 2.524 0.523 1.00 0.00 H new ATOM 0 HE2 HIS B 40 -23.469 4.235 2.240 1.00 0.00 H new ATOM 2433 N ALA B 41 -17.219 2.276 -2.005 1.00 0.00 N ATOM 2434 CA ALA B 41 -15.881 1.733 -2.374 1.00 0.00 C ATOM 2435 C ALA B 41 -14.942 1.781 -1.166 1.00 0.00 C ATOM 2436 O ALA B 41 -14.102 0.921 -0.991 1.00 0.00 O ATOM 2437 CB ALA B 41 -15.296 2.565 -3.518 1.00 0.00 C ATOM 0 H ALA B 41 -17.526 3.080 -2.553 1.00 0.00 H new ATOM 0 HA ALA B 41 -15.989 0.696 -2.693 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -14.317 2.171 -3.791 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -15.960 2.515 -4.381 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -15.193 3.602 -3.198 1.00 0.00 H new ATOM 2443 N ASN B 42 -15.075 2.772 -0.328 1.00 0.00 N ATOM 2444 CA ASN B 42 -14.182 2.856 0.863 1.00 0.00 C ATOM 2445 C ASN B 42 -12.723 2.804 0.412 1.00 0.00 C ATOM 2446 O ASN B 42 -12.429 2.527 -0.734 1.00 0.00 O ATOM 2447 CB ASN B 42 -14.459 1.672 1.792 1.00 0.00 C ATOM 2448 CG ASN B 42 -15.651 1.995 2.694 1.00 0.00 C ATOM 2449 OD1 ASN B 42 -16.685 2.615 2.193 1.00 0.00 O flip ATOM 2450 ND2 ASN B 42 -15.643 1.679 3.867 1.00 0.00 N flip ATOM 0 H ASN B 42 -15.759 3.524 -0.415 1.00 0.00 H new ATOM 0 HA ASN B 42 -14.371 3.791 1.390 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -14.666 0.777 1.205 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -13.579 1.459 2.398 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -14.836 1.195 4.259 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -16.444 1.898 4.460 1.00 0.00 H new ATOM 2457 N PHE B 43 -11.805 3.055 1.306 1.00 0.00 N ATOM 2458 CA PHE B 43 -10.365 3.007 0.926 1.00 0.00 C ATOM 2459 C PHE B 43 -9.510 3.358 2.140 1.00 0.00 C ATOM 2460 O PHE B 43 -9.948 3.233 3.260 1.00 0.00 O ATOM 2461 CB PHE B 43 -10.087 3.978 -0.227 1.00 0.00 C ATOM 2462 CG PHE B 43 -10.144 5.413 0.241 1.00 0.00 C ATOM 2463 CD1 PHE B 43 -11.214 5.875 1.020 1.00 0.00 C ATOM 2464 CD2 PHE B 43 -9.126 6.295 -0.136 1.00 0.00 C ATOM 2465 CE1 PHE B 43 -11.260 7.216 1.418 1.00 0.00 C ATOM 2466 CE2 PHE B 43 -9.173 7.630 0.266 1.00 0.00 C ATOM 2467 CZ PHE B 43 -10.241 8.092 1.042 1.00 0.00 C ATOM 0 H PHE B 43 -11.990 3.291 2.281 1.00 0.00 H new ATOM 0 HA PHE B 43 -10.113 2.001 0.591 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.105 3.770 -0.652 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -10.817 3.822 -1.021 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -12.002 5.197 1.313 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -8.303 5.942 -0.739 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -12.085 7.573 2.017 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -8.383 8.308 -0.022 1.00 0.00 H new ATOM 0 HZ PHE B 43 -10.277 9.126 1.350 1.00 0.00 H new ATOM 2477 N CYS B 44 -8.290 3.774 1.945 1.00 0.00 N ATOM 2478 CA CYS B 44 -7.440 4.095 3.129 1.00 0.00 C ATOM 2479 C CYS B 44 -6.570 5.321 2.840 1.00 0.00 C ATOM 2480 O CYS B 44 -6.149 5.546 1.724 1.00 0.00 O ATOM 2481 CB CYS B 44 -6.529 2.902 3.447 1.00 0.00 C ATOM 2482 SG CYS B 44 -7.323 1.351 2.941 1.00 0.00 S ATOM 0 H CYS B 44 -7.849 3.905 1.035 1.00 0.00 H new ATOM 0 HA CYS B 44 -8.090 4.305 3.979 1.00 0.00 H new ATOM 0 HB2 CYS B 44 -5.576 3.016 2.931 1.00 0.00 H new ATOM 0 HB3 CYS B 44 -6.312 2.876 4.515 1.00 0.00 H new ATOM 2487 N LEU B 45 -6.286 6.108 3.846 1.00 0.00 N ATOM 2488 CA LEU B 45 -5.431 7.311 3.636 1.00 0.00 C ATOM 2489 C LEU B 45 -4.579 7.557 4.883 1.00 0.00 C ATOM 2490 O LEU B 45 -4.939 7.175 5.979 1.00 0.00 O ATOM 2491 CB LEU B 45 -6.313 8.535 3.386 1.00 0.00 C ATOM 2492 CG LEU B 45 -6.932 8.453 1.996 1.00 0.00 C ATOM 2493 CD1 LEU B 45 -7.687 9.750 1.707 1.00 0.00 C ATOM 2494 CD2 LEU B 45 -5.833 8.259 0.949 1.00 0.00 C ATOM 0 H LEU B 45 -6.610 5.968 4.803 1.00 0.00 H new ATOM 0 HA LEU B 45 -4.785 7.143 2.774 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.098 8.589 4.140 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -5.721 9.446 3.477 1.00 0.00 H new ATOM 0 HG LEU B 45 -7.619 7.608 1.954 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -8.133 9.698 0.714 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -8.472 9.887 2.450 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -6.995 10.591 1.751 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -6.281 8.201 -0.043 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.142 9.101 0.986 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -5.291 7.336 1.157 1.00 0.00 H new ATOM 2506 N GLY B 46 -3.454 8.200 4.726 1.00 0.00 N ATOM 2507 CA GLY B 46 -2.582 8.480 5.903 1.00 0.00 C ATOM 2508 C GLY B 46 -1.612 7.315 6.121 1.00 0.00 C ATOM 2509 O GLY B 46 -1.947 6.174 5.870 1.00 0.00 O ATOM 0 H GLY B 46 -3.101 8.544 3.833 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -2.025 9.403 5.743 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -3.194 8.627 6.793 1.00 0.00 H new ATOM 2513 N PRO B 47 -0.431 7.642 6.587 1.00 0.00 N ATOM 2514 CA PRO B 47 0.623 6.648 6.859 1.00 0.00 C ATOM 2515 C PRO B 47 0.358 5.950 8.196 1.00 0.00 C ATOM 2516 O PRO B 47 -0.698 6.090 8.779 1.00 0.00 O ATOM 2517 CB PRO B 47 1.898 7.491 6.930 1.00 0.00 C ATOM 2518 CG PRO B 47 1.451 8.933 7.269 1.00 0.00 C ATOM 2519 CD PRO B 47 -0.037 9.035 6.884 1.00 0.00 C ATOM 0 HA PRO B 47 0.679 5.861 6.107 1.00 0.00 H new ATOM 0 HB2 PRO B 47 2.576 7.106 7.691 1.00 0.00 H new ATOM 0 HB3 PRO B 47 2.435 7.464 5.982 1.00 0.00 H new ATOM 0 HG2 PRO B 47 1.592 9.143 8.329 1.00 0.00 H new ATOM 0 HG3 PRO B 47 2.045 9.662 6.718 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -0.631 9.452 7.697 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -0.181 9.683 6.019 1.00 0.00 H new ATOM 2527 N CYS B 48 1.310 5.205 8.694 1.00 0.00 N ATOM 2528 CA CYS B 48 1.100 4.513 9.998 1.00 0.00 C ATOM 2529 C CYS B 48 2.414 4.471 10.785 1.00 0.00 C ATOM 2530 O CYS B 48 3.483 4.430 10.210 1.00 0.00 O ATOM 2531 CB CYS B 48 0.605 3.080 9.763 1.00 0.00 C ATOM 2532 SG CYS B 48 1.326 2.405 8.245 1.00 0.00 S ATOM 0 H CYS B 48 2.218 5.047 8.257 1.00 0.00 H new ATOM 0 HA CYS B 48 0.351 5.064 10.567 1.00 0.00 H new ATOM 0 HB2 CYS B 48 0.874 2.452 10.612 1.00 0.00 H new ATOM 0 HB3 CYS B 48 -0.483 3.071 9.692 1.00 0.00 H new ATOM 2537 N PRO B 49 2.284 4.469 12.089 1.00 0.00 N ATOM 2538 CA PRO B 49 3.439 4.419 13.008 1.00 0.00 C ATOM 2539 C PRO B 49 4.094 3.031 12.982 1.00 0.00 C ATOM 2540 O PRO B 49 4.001 2.312 12.007 1.00 0.00 O ATOM 2541 CB PRO B 49 2.823 4.736 14.377 1.00 0.00 C ATOM 2542 CG PRO B 49 1.317 4.411 14.262 1.00 0.00 C ATOM 2543 CD PRO B 49 0.971 4.515 12.767 1.00 0.00 C ATOM 0 HA PRO B 49 4.234 5.116 12.742 1.00 0.00 H new ATOM 0 HB2 PRO B 49 3.290 4.140 15.161 1.00 0.00 H new ATOM 0 HB3 PRO B 49 2.976 5.783 14.639 1.00 0.00 H new ATOM 0 HG2 PRO B 49 1.104 3.412 14.643 1.00 0.00 H new ATOM 0 HG3 PRO B 49 0.722 5.110 14.849 1.00 0.00 H new ATOM 0 HD2 PRO B 49 0.329 3.694 12.448 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.440 5.440 12.544 1.00 0.00 H new ATOM 2551 N TYR B 50 4.771 2.653 14.035 1.00 0.00 N ATOM 2552 CA TYR B 50 5.443 1.317 14.050 1.00 0.00 C ATOM 2553 C TYR B 50 4.605 0.311 14.845 1.00 0.00 C ATOM 2554 O TYR B 50 5.117 -0.665 15.357 1.00 0.00 O ATOM 2555 CB TYR B 50 6.842 1.418 14.686 1.00 0.00 C ATOM 2556 CG TYR B 50 6.992 2.724 15.431 1.00 0.00 C ATOM 2557 CD1 TYR B 50 7.044 3.927 14.720 1.00 0.00 C ATOM 2558 CD2 TYR B 50 7.074 2.730 16.828 1.00 0.00 C ATOM 2559 CE1 TYR B 50 7.177 5.140 15.405 1.00 0.00 C ATOM 2560 CE2 TYR B 50 7.209 3.943 17.515 1.00 0.00 C ATOM 2561 CZ TYR B 50 7.260 5.148 16.803 1.00 0.00 C ATOM 2562 OH TYR B 50 7.391 6.344 17.479 1.00 0.00 O ATOM 0 H TYR B 50 4.888 3.208 14.883 1.00 0.00 H new ATOM 0 HA TYR B 50 5.541 0.979 13.018 1.00 0.00 H new ATOM 0 HB2 TYR B 50 6.999 0.583 15.369 1.00 0.00 H new ATOM 0 HB3 TYR B 50 7.606 1.344 13.912 1.00 0.00 H new ATOM 0 HD1 TYR B 50 6.981 3.920 13.642 1.00 0.00 H new ATOM 0 HD2 TYR B 50 7.033 1.800 17.376 1.00 0.00 H new ATOM 0 HE1 TYR B 50 7.216 6.069 14.856 1.00 0.00 H new ATOM 0 HE2 TYR B 50 7.274 3.949 18.593 1.00 0.00 H new ATOM 0 HH TYR B 50 7.433 6.172 18.443 1.00 0.00 H new ATOM 2572 N ILE B 51 3.326 0.534 14.953 1.00 0.00 N ATOM 2573 CA ILE B 51 2.468 -0.419 15.716 1.00 0.00 C ATOM 2574 C ILE B 51 1.080 -0.469 15.080 1.00 0.00 C ATOM 2575 O ILE B 51 0.110 -0.859 15.700 1.00 0.00 O ATOM 2576 CB ILE B 51 2.344 0.055 17.162 1.00 0.00 C ATOM 2577 CG1 ILE B 51 2.108 1.568 17.178 1.00 0.00 C ATOM 2578 CG2 ILE B 51 3.632 -0.269 17.921 1.00 0.00 C ATOM 2579 CD1 ILE B 51 1.275 1.942 18.404 1.00 0.00 C ATOM 0 H ILE B 51 2.837 1.332 14.548 1.00 0.00 H new ATOM 0 HA ILE B 51 2.917 -1.412 15.695 1.00 0.00 H new ATOM 0 HB ILE B 51 1.507 -0.452 17.642 1.00 0.00 H new ATOM 0 HG12 ILE B 51 3.062 2.095 17.199 1.00 0.00 H new ATOM 0 HG13 ILE B 51 1.593 1.876 16.268 1.00 0.00 H new ATOM 0 HG21 ILE B 51 3.541 0.070 18.953 1.00 0.00 H new ATOM 0 HG22 ILE B 51 3.802 -1.346 17.906 1.00 0.00 H new ATOM 0 HG23 ILE B 51 4.472 0.237 17.445 1.00 0.00 H new ATOM 0 HD11 ILE B 51 1.107 3.019 18.415 1.00 0.00 H new ATOM 0 HD12 ILE B 51 0.316 1.426 18.364 1.00 0.00 H new ATOM 0 HD13 ILE B 51 1.807 1.648 19.309 1.00 0.00 H new ATOM 2591 N TRP B 52 0.981 -0.064 13.849 1.00 0.00 N ATOM 2592 CA TRP B 52 -0.338 -0.067 13.157 1.00 0.00 C ATOM 2593 C TRP B 52 -0.410 -1.237 12.175 1.00 0.00 C ATOM 2594 O TRP B 52 -0.271 -1.069 10.980 1.00 0.00 O ATOM 2595 CB TRP B 52 -0.492 1.249 12.404 1.00 0.00 C ATOM 2596 CG TRP B 52 -1.820 1.856 12.716 1.00 0.00 C ATOM 2597 CD1 TRP B 52 -2.571 2.544 11.832 1.00 0.00 C ATOM 2598 CD2 TRP B 52 -2.570 1.848 13.971 1.00 0.00 C ATOM 2599 NE1 TRP B 52 -3.734 2.956 12.451 1.00 0.00 N ATOM 2600 CE2 TRP B 52 -3.783 2.551 13.770 1.00 0.00 C ATOM 2601 CE3 TRP B 52 -2.324 1.306 15.247 1.00 0.00 C ATOM 2602 CZ2 TRP B 52 -4.718 2.708 14.795 1.00 0.00 C ATOM 2603 CZ3 TRP B 52 -3.262 1.465 16.280 1.00 0.00 C ATOM 2604 CH2 TRP B 52 -4.457 2.162 16.054 1.00 0.00 C ATOM 0 H TRP B 52 1.762 0.272 13.286 1.00 0.00 H new ATOM 0 HA TRP B 52 -1.140 -0.176 13.887 1.00 0.00 H new ATOM 0 HB2 TRP B 52 0.307 1.935 12.685 1.00 0.00 H new ATOM 0 HB3 TRP B 52 -0.403 1.078 11.331 1.00 0.00 H new ATOM 0 HD1 TRP B 52 -2.305 2.741 10.804 1.00 0.00 H new ATOM 0 HE1 TRP B 52 -4.468 3.494 11.990 1.00 0.00 H new ATOM 0 HE3 TRP B 52 -1.408 0.765 15.433 1.00 0.00 H new ATOM 0 HZ2 TRP B 52 -5.636 3.248 14.616 1.00 0.00 H new ATOM 0 HZ3 TRP B 52 -3.061 1.047 17.255 1.00 0.00 H new ATOM 0 HH2 TRP B 52 -5.175 2.277 16.852 1.00 0.00 H new ATOM 2615 N SER B 53 -0.634 -2.423 12.675 1.00 0.00 N ATOM 2616 CA SER B 53 -0.725 -3.611 11.778 1.00 0.00 C ATOM 2617 C SER B 53 0.366 -3.540 10.710 1.00 0.00 C ATOM 2618 O SER B 53 0.101 -3.270 9.555 1.00 0.00 O ATOM 2619 CB SER B 53 -2.097 -3.635 11.104 1.00 0.00 C ATOM 2620 OG SER B 53 -3.111 -3.591 12.100 1.00 0.00 O ATOM 0 H SER B 53 -0.758 -2.620 13.668 1.00 0.00 H new ATOM 0 HA SER B 53 -0.591 -4.518 12.368 1.00 0.00 H new ATOM 0 HB2 SER B 53 -2.198 -2.786 10.428 1.00 0.00 H new ATOM 0 HB3 SER B 53 -2.203 -4.537 10.501 1.00 0.00 H new ATOM 0 HG SER B 53 -3.992 -3.605 11.671 1.00 0.00 H new ATOM 2626 N LEU B 54 1.592 -3.789 11.082 1.00 0.00 N ATOM 2627 CA LEU B 54 2.696 -3.743 10.083 1.00 0.00 C ATOM 2628 C LEU B 54 2.814 -5.111 9.407 1.00 0.00 C ATOM 2629 O LEU B 54 2.847 -6.136 10.060 1.00 0.00 O ATOM 2630 CB LEU B 54 4.010 -3.399 10.786 1.00 0.00 C ATOM 2631 CG LEU B 54 3.914 -1.992 11.378 1.00 0.00 C ATOM 2632 CD1 LEU B 54 4.995 -1.807 12.442 1.00 0.00 C ATOM 2633 CD2 LEU B 54 4.112 -0.958 10.266 1.00 0.00 C ATOM 0 H LEU B 54 1.876 -4.022 12.034 1.00 0.00 H new ATOM 0 HA LEU B 54 2.484 -2.981 9.333 1.00 0.00 H new ATOM 0 HB2 LEU B 54 4.215 -4.124 11.574 1.00 0.00 H new ATOM 0 HB3 LEU B 54 4.838 -3.453 10.080 1.00 0.00 H new ATOM 0 HG LEU B 54 2.933 -1.857 11.833 1.00 0.00 H new ATOM 0 HD11 LEU B 54 4.924 -0.804 12.862 1.00 0.00 H new ATOM 0 HD12 LEU B 54 4.856 -2.543 13.234 1.00 0.00 H new ATOM 0 HD13 LEU B 54 5.978 -1.943 11.990 1.00 0.00 H new ATOM 0 HD21 LEU B 54 4.044 0.046 10.686 1.00 0.00 H new ATOM 0 HD22 LEU B 54 5.093 -1.095 9.812 1.00 0.00 H new ATOM 0 HD23 LEU B 54 3.340 -1.087 9.508 1.00 0.00 H new ATOM 2645 N ASP B 55 2.865 -5.138 8.103 1.00 0.00 N ATOM 2646 CA ASP B 55 2.967 -6.444 7.390 1.00 0.00 C ATOM 2647 C ASP B 55 4.434 -6.767 7.098 1.00 0.00 C ATOM 2648 O ASP B 55 4.891 -7.871 7.323 1.00 0.00 O ATOM 2649 CB ASP B 55 2.194 -6.363 6.072 1.00 0.00 C ATOM 2650 CG ASP B 55 0.906 -7.180 6.184 1.00 0.00 C ATOM 2651 OD1 ASP B 55 0.871 -8.084 7.003 1.00 0.00 O ATOM 2652 OD2 ASP B 55 -0.023 -6.890 5.448 1.00 0.00 O ATOM 0 H ASP B 55 2.841 -4.315 7.501 1.00 0.00 H new ATOM 0 HA ASP B 55 2.546 -7.229 8.018 1.00 0.00 H new ATOM 0 HB2 ASP B 55 1.959 -5.324 5.839 1.00 0.00 H new ATOM 0 HB3 ASP B 55 2.807 -6.742 5.255 1.00 0.00 H new ATOM 2657 N THR B 56 5.176 -5.820 6.592 1.00 0.00 N ATOM 2658 CA THR B 56 6.608 -6.089 6.280 1.00 0.00 C ATOM 2659 C THR B 56 7.504 -5.439 7.335 1.00 0.00 C ATOM 2660 O THR B 56 7.039 -4.759 8.229 1.00 0.00 O ATOM 2661 CB THR B 56 6.946 -5.510 4.904 1.00 0.00 C ATOM 2662 OG1 THR B 56 7.347 -4.154 5.049 1.00 0.00 O ATOM 2663 CG2 THR B 56 5.717 -5.586 3.996 1.00 0.00 C ATOM 0 H THR B 56 4.854 -4.875 6.382 1.00 0.00 H new ATOM 0 HA THR B 56 6.777 -7.166 6.280 1.00 0.00 H new ATOM 0 HB THR B 56 7.758 -6.085 4.458 1.00 0.00 H new ATOM 0 HG1 THR B 56 6.621 -3.640 5.461 1.00 0.00 H new ATOM 0 HG21 THR B 56 5.962 -5.173 3.017 1.00 0.00 H new ATOM 0 HG22 THR B 56 5.411 -6.626 3.885 1.00 0.00 H new ATOM 0 HG23 THR B 56 4.902 -5.013 4.438 1.00 0.00 H new ATOM 2671 N GLN B 57 8.790 -5.643 7.236 1.00 0.00 N ATOM 2672 CA GLN B 57 9.723 -5.040 8.229 1.00 0.00 C ATOM 2673 C GLN B 57 10.030 -3.597 7.826 1.00 0.00 C ATOM 2674 O GLN B 57 10.226 -2.737 8.662 1.00 0.00 O ATOM 2675 CB GLN B 57 11.023 -5.848 8.263 1.00 0.00 C ATOM 2676 CG GLN B 57 11.472 -6.031 9.714 1.00 0.00 C ATOM 2677 CD GLN B 57 13.000 -6.021 9.783 1.00 0.00 C ATOM 2678 OE1 GLN B 57 13.651 -5.360 8.997 1.00 0.00 O ATOM 2679 NE2 GLN B 57 13.604 -6.733 10.695 1.00 0.00 N ATOM 0 H GLN B 57 9.235 -6.203 6.508 1.00 0.00 H new ATOM 0 HA GLN B 57 9.262 -5.052 9.217 1.00 0.00 H new ATOM 0 HB2 GLN B 57 10.872 -6.820 7.792 1.00 0.00 H new ATOM 0 HB3 GLN B 57 11.798 -5.335 7.693 1.00 0.00 H new ATOM 0 HG2 GLN B 57 11.065 -5.233 10.335 1.00 0.00 H new ATOM 0 HG3 GLN B 57 11.086 -6.971 10.109 1.00 0.00 H new ATOM 0 HE21 GLN B 57 13.057 -7.287 11.354 1.00 0.00 H new ATOM 0 HE22 GLN B 57 14.623 -6.735 10.749 1.00 0.00 H new ATOM 2688 N TYR B 58 10.072 -3.321 6.550 1.00 0.00 N ATOM 2689 CA TYR B 58 10.362 -1.930 6.101 1.00 0.00 C ATOM 2690 C TYR B 58 9.198 -1.021 6.517 1.00 0.00 C ATOM 2691 O TYR B 58 9.292 0.189 6.458 1.00 0.00 O ATOM 2692 CB TYR B 58 10.544 -1.916 4.569 1.00 0.00 C ATOM 2693 CG TYR B 58 10.141 -0.573 4.001 1.00 0.00 C ATOM 2694 CD1 TYR B 58 11.053 0.489 3.988 1.00 0.00 C ATOM 2695 CD2 TYR B 58 8.850 -0.392 3.495 1.00 0.00 C ATOM 2696 CE1 TYR B 58 10.670 1.730 3.466 1.00 0.00 C ATOM 2697 CE2 TYR B 58 8.469 0.850 2.977 1.00 0.00 C ATOM 2698 CZ TYR B 58 9.380 1.910 2.963 1.00 0.00 C ATOM 2699 OH TYR B 58 9.003 3.136 2.456 1.00 0.00 O ATOM 0 H TYR B 58 9.918 -3.997 5.802 1.00 0.00 H new ATOM 0 HA TYR B 58 11.279 -1.565 6.563 1.00 0.00 H new ATOM 0 HB2 TYR B 58 11.584 -2.127 4.318 1.00 0.00 H new ATOM 0 HB3 TYR B 58 9.941 -2.704 4.118 1.00 0.00 H new ATOM 0 HD1 TYR B 58 12.050 0.351 4.380 1.00 0.00 H new ATOM 0 HD2 TYR B 58 8.147 -1.212 3.504 1.00 0.00 H new ATOM 0 HE1 TYR B 58 11.373 2.549 3.452 1.00 0.00 H new ATOM 0 HE2 TYR B 58 7.471 0.990 2.588 1.00 0.00 H new ATOM 0 HH TYR B 58 8.065 3.100 2.176 1.00 0.00 H new ATOM 2709 N SER B 59 8.103 -1.594 6.936 1.00 0.00 N ATOM 2710 CA SER B 59 6.941 -0.761 7.354 1.00 0.00 C ATOM 2711 C SER B 59 7.216 -0.157 8.732 1.00 0.00 C ATOM 2712 O SER B 59 6.628 0.835 9.116 1.00 0.00 O ATOM 2713 CB SER B 59 5.685 -1.633 7.419 1.00 0.00 C ATOM 2714 OG SER B 59 5.543 -2.345 6.197 1.00 0.00 O ATOM 0 H SER B 59 7.963 -2.602 7.007 1.00 0.00 H new ATOM 0 HA SER B 59 6.789 0.040 6.631 1.00 0.00 H new ATOM 0 HB2 SER B 59 5.756 -2.331 8.253 1.00 0.00 H new ATOM 0 HB3 SER B 59 4.806 -1.013 7.596 1.00 0.00 H new ATOM 0 HG SER B 59 4.596 -2.382 5.948 1.00 0.00 H new ATOM 2720 N LYS B 60 8.109 -0.746 9.480 1.00 0.00 N ATOM 2721 CA LYS B 60 8.424 -0.203 10.831 1.00 0.00 C ATOM 2722 C LYS B 60 9.523 0.853 10.710 1.00 0.00 C ATOM 2723 O LYS B 60 9.438 1.922 11.282 1.00 0.00 O ATOM 2724 CB LYS B 60 8.906 -1.338 11.737 1.00 0.00 C ATOM 2725 CG LYS B 60 9.497 -0.750 13.019 1.00 0.00 C ATOM 2726 CD LYS B 60 9.998 -1.882 13.918 1.00 0.00 C ATOM 2727 CE LYS B 60 11.514 -2.022 13.764 1.00 0.00 C ATOM 2728 NZ LYS B 60 12.072 -2.709 14.962 1.00 0.00 N ATOM 0 H LYS B 60 8.634 -1.579 9.214 1.00 0.00 H new ATOM 0 HA LYS B 60 7.529 0.249 11.259 1.00 0.00 H new ATOM 0 HB2 LYS B 60 8.076 -2.003 11.978 1.00 0.00 H new ATOM 0 HB3 LYS B 60 9.655 -1.937 11.220 1.00 0.00 H new ATOM 0 HG2 LYS B 60 10.317 -0.074 12.777 1.00 0.00 H new ATOM 0 HG3 LYS B 60 8.743 -0.162 13.543 1.00 0.00 H new ATOM 0 HD2 LYS B 60 9.745 -1.674 14.958 1.00 0.00 H new ATOM 0 HD3 LYS B 60 9.507 -2.818 13.651 1.00 0.00 H new ATOM 0 HE2 LYS B 60 11.748 -2.590 12.864 1.00 0.00 H new ATOM 0 HE3 LYS B 60 11.971 -1.039 13.649 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 13.102 -2.805 14.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 11.860 -2.150 15.813 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 11.644 -3.653 15.052 1.00 0.00 H new ATOM 2742 N VAL B 61 10.555 0.562 9.967 1.00 0.00 N ATOM 2743 CA VAL B 61 11.660 1.543 9.804 1.00 0.00 C ATOM 2744 C VAL B 61 11.119 2.812 9.141 1.00 0.00 C ATOM 2745 O VAL B 61 11.145 3.881 9.713 1.00 0.00 O ATOM 2746 CB VAL B 61 12.749 0.921 8.928 1.00 0.00 C ATOM 2747 CG1 VAL B 61 13.717 2.004 8.454 1.00 0.00 C ATOM 2748 CG2 VAL B 61 13.516 -0.124 9.741 1.00 0.00 C ATOM 0 H VAL B 61 10.679 -0.317 9.465 1.00 0.00 H new ATOM 0 HA VAL B 61 12.078 1.801 10.777 1.00 0.00 H new ATOM 0 HB VAL B 61 12.287 0.449 8.061 1.00 0.00 H new ATOM 0 HG11 VAL B 61 14.490 1.554 7.831 1.00 0.00 H new ATOM 0 HG12 VAL B 61 13.173 2.750 7.875 1.00 0.00 H new ATOM 0 HG13 VAL B 61 14.180 2.482 9.318 1.00 0.00 H new ATOM 0 HG21 VAL B 61 14.293 -0.570 9.120 1.00 0.00 H new ATOM 0 HG22 VAL B 61 13.973 0.353 10.608 1.00 0.00 H new ATOM 0 HG23 VAL B 61 12.829 -0.901 10.075 1.00 0.00 H new ATOM 2758 N LEU B 62 10.630 2.700 7.938 1.00 0.00 N ATOM 2759 CA LEU B 62 10.088 3.898 7.239 1.00 0.00 C ATOM 2760 C LEU B 62 9.037 4.572 8.125 1.00 0.00 C ATOM 2761 O LEU B 62 8.937 5.782 8.171 1.00 0.00 O ATOM 2762 CB LEU B 62 9.457 3.458 5.917 1.00 0.00 C ATOM 2763 CG LEU B 62 8.707 4.622 5.266 1.00 0.00 C ATOM 2764 CD1 LEU B 62 9.642 5.392 4.328 1.00 0.00 C ATOM 2765 CD2 LEU B 62 7.536 4.062 4.463 1.00 0.00 C ATOM 0 H LEU B 62 10.582 1.830 7.408 1.00 0.00 H new ATOM 0 HA LEU B 62 10.890 4.609 7.039 1.00 0.00 H new ATOM 0 HB2 LEU B 62 10.231 3.094 5.242 1.00 0.00 H new ATOM 0 HB3 LEU B 62 8.771 2.629 6.093 1.00 0.00 H new ATOM 0 HG LEU B 62 8.346 5.300 6.039 1.00 0.00 H new ATOM 0 HD11 LEU B 62 9.098 6.218 3.870 1.00 0.00 H new ATOM 0 HD12 LEU B 62 10.486 5.784 4.896 1.00 0.00 H new ATOM 0 HD13 LEU B 62 10.008 4.723 3.549 1.00 0.00 H new ATOM 0 HD21 LEU B 62 6.992 4.881 3.993 1.00 0.00 H new ATOM 0 HD22 LEU B 62 7.912 3.388 3.694 1.00 0.00 H new ATOM 0 HD23 LEU B 62 6.867 3.516 5.128 1.00 0.00 H new ATOM 2777 N ALA B 63 8.254 3.803 8.836 1.00 0.00 N ATOM 2778 CA ALA B 63 7.221 4.414 9.720 1.00 0.00 C ATOM 2779 C ALA B 63 7.873 5.524 10.550 1.00 0.00 C ATOM 2780 O ALA B 63 7.314 6.585 10.735 1.00 0.00 O ATOM 2781 CB ALA B 63 6.637 3.344 10.649 1.00 0.00 C ATOM 0 H ALA B 63 8.286 2.784 8.842 1.00 0.00 H new ATOM 0 HA ALA B 63 6.417 4.832 9.115 1.00 0.00 H new ATOM 0 HB1 ALA B 63 5.882 3.794 11.294 1.00 0.00 H new ATOM 0 HB2 ALA B 63 6.180 2.554 10.053 1.00 0.00 H new ATOM 0 HB3 ALA B 63 7.433 2.921 11.262 1.00 0.00 H new ATOM 2787 N LEU B 64 9.060 5.286 11.040 1.00 0.00 N ATOM 2788 CA LEU B 64 9.764 6.325 11.846 1.00 0.00 C ATOM 2789 C LEU B 64 10.364 7.363 10.901 1.00 0.00 C ATOM 2790 O LEU B 64 10.347 8.546 11.164 1.00 0.00 O ATOM 2791 CB LEU B 64 10.896 5.667 12.638 1.00 0.00 C ATOM 2792 CG LEU B 64 10.306 4.808 13.751 1.00 0.00 C ATOM 2793 CD1 LEU B 64 11.362 3.819 14.242 1.00 0.00 C ATOM 2794 CD2 LEU B 64 9.871 5.704 14.911 1.00 0.00 C ATOM 0 H LEU B 64 9.574 4.414 10.916 1.00 0.00 H new ATOM 0 HA LEU B 64 9.060 6.801 12.529 1.00 0.00 H new ATOM 0 HB2 LEU B 64 11.508 5.054 11.977 1.00 0.00 H new ATOM 0 HB3 LEU B 64 11.550 6.430 13.061 1.00 0.00 H new ATOM 0 HG LEU B 64 9.443 4.262 13.370 1.00 0.00 H new ATOM 0 HD11 LEU B 64 10.942 3.204 15.038 1.00 0.00 H new ATOM 0 HD12 LEU B 64 11.674 3.180 13.416 1.00 0.00 H new ATOM 0 HD13 LEU B 64 12.224 4.367 14.623 1.00 0.00 H new ATOM 0 HD21 LEU B 64 9.449 5.090 15.707 1.00 0.00 H new ATOM 0 HD22 LEU B 64 10.734 6.250 15.293 1.00 0.00 H new ATOM 0 HD23 LEU B 64 9.119 6.412 14.562 1.00 0.00 H new ATOM 2806 N TYR B 65 10.898 6.919 9.801 1.00 0.00 N ATOM 2807 CA TYR B 65 11.507 7.864 8.823 1.00 0.00 C ATOM 2808 C TYR B 65 10.555 9.039 8.584 1.00 0.00 C ATOM 2809 O TYR B 65 10.974 10.149 8.327 1.00 0.00 O ATOM 2810 CB TYR B 65 11.752 7.120 7.509 1.00 0.00 C ATOM 2811 CG TYR B 65 12.275 8.076 6.466 1.00 0.00 C ATOM 2812 CD1 TYR B 65 11.379 8.762 5.638 1.00 0.00 C ATOM 2813 CD2 TYR B 65 13.655 8.266 6.318 1.00 0.00 C ATOM 2814 CE1 TYR B 65 11.861 9.638 4.660 1.00 0.00 C ATOM 2815 CE2 TYR B 65 14.136 9.145 5.339 1.00 0.00 C ATOM 2816 CZ TYR B 65 13.239 9.831 4.510 1.00 0.00 C ATOM 2817 OH TYR B 65 13.713 10.694 3.544 1.00 0.00 O ATOM 0 H TYR B 65 10.940 5.936 9.534 1.00 0.00 H new ATOM 0 HA TYR B 65 12.451 8.247 9.212 1.00 0.00 H new ATOM 0 HB2 TYR B 65 12.468 6.313 7.666 1.00 0.00 H new ATOM 0 HB3 TYR B 65 10.826 6.662 7.163 1.00 0.00 H new ATOM 0 HD1 TYR B 65 10.315 8.615 5.754 1.00 0.00 H new ATOM 0 HD2 TYR B 65 14.346 7.736 6.957 1.00 0.00 H new ATOM 0 HE1 TYR B 65 11.169 10.166 4.020 1.00 0.00 H new ATOM 0 HE2 TYR B 65 15.199 9.294 5.223 1.00 0.00 H new ATOM 0 HH TYR B 65 14.692 10.713 3.575 1.00 0.00 H new ATOM 2827 N ASN B 66 9.275 8.801 8.670 1.00 0.00 N ATOM 2828 CA ASN B 66 8.288 9.896 8.452 1.00 0.00 C ATOM 2829 C ASN B 66 7.869 10.471 9.802 1.00 0.00 C ATOM 2830 O ASN B 66 7.874 11.666 10.016 1.00 0.00 O ATOM 2831 CB ASN B 66 7.056 9.318 7.773 1.00 0.00 C ATOM 2832 CG ASN B 66 6.403 10.384 6.893 1.00 0.00 C ATOM 2833 OD1 ASN B 66 7.078 11.097 6.178 1.00 0.00 O ATOM 2834 ND2 ASN B 66 5.105 10.526 6.915 1.00 0.00 N ATOM 0 H ASN B 66 8.868 7.890 8.883 1.00 0.00 H new ATOM 0 HA ASN B 66 8.734 10.676 7.835 1.00 0.00 H new ATOM 0 HB2 ASN B 66 7.334 8.454 7.169 1.00 0.00 H new ATOM 0 HB3 ASN B 66 6.347 8.968 8.523 1.00 0.00 H new ATOM 0 HD21 ASN B 66 4.660 11.235 6.332 1.00 0.00 H new ATOM 0 HD22 ASN B 66 4.537 9.928 7.515 1.00 0.00 H new ATOM 2841 N GLN B 67 7.504 9.612 10.714 1.00 0.00 N ATOM 2842 CA GLN B 67 7.076 10.071 12.066 1.00 0.00 C ATOM 2843 C GLN B 67 8.139 10.985 12.675 1.00 0.00 C ATOM 2844 O GLN B 67 7.891 11.694 13.631 1.00 0.00 O ATOM 2845 CB GLN B 67 6.876 8.849 12.965 1.00 0.00 C ATOM 2846 CG GLN B 67 5.423 8.376 12.873 1.00 0.00 C ATOM 2847 CD GLN B 67 4.991 8.315 11.406 1.00 0.00 C ATOM 2848 OE1 GLN B 67 4.511 9.387 10.835 1.00 0.00 O flip ATOM 2849 NE2 GLN B 67 5.088 7.283 10.773 1.00 0.00 N flip ATOM 0 H GLN B 67 7.484 8.601 10.579 1.00 0.00 H new ATOM 0 HA GLN B 67 6.143 10.628 11.980 1.00 0.00 H new ATOM 0 HB2 GLN B 67 7.550 8.048 12.662 1.00 0.00 H new ATOM 0 HB3 GLN B 67 7.123 9.100 13.997 1.00 0.00 H new ATOM 0 HG2 GLN B 67 5.321 7.393 13.333 1.00 0.00 H new ATOM 0 HG3 GLN B 67 4.774 9.056 13.425 1.00 0.00 H new ATOM 0 HE21 GLN B 67 5.463 6.445 11.218 1.00 0.00 H new ATOM 0 HE22 GLN B 67 4.795 7.254 9.796 1.00 0.00 H new ATOM 2858 N HIS B 68 9.316 10.975 12.129 1.00 0.00 N ATOM 2859 CA HIS B 68 10.400 11.845 12.670 1.00 0.00 C ATOM 2860 C HIS B 68 10.364 13.203 11.969 1.00 0.00 C ATOM 2861 O HIS B 68 10.538 14.236 12.586 1.00 0.00 O ATOM 2862 CB HIS B 68 11.760 11.184 12.433 1.00 0.00 C ATOM 2863 CG HIS B 68 12.122 10.335 13.619 1.00 0.00 C ATOM 2864 ND1 HIS B 68 11.747 9.005 13.725 1.00 0.00 N ATOM 2865 CD2 HIS B 68 12.832 10.617 14.759 1.00 0.00 C ATOM 2866 CE1 HIS B 68 12.230 8.541 14.893 1.00 0.00 C ATOM 2867 NE2 HIS B 68 12.899 9.483 15.562 1.00 0.00 N ATOM 0 H HIS B 68 9.580 10.401 11.328 1.00 0.00 H new ATOM 0 HA HIS B 68 10.248 11.984 13.740 1.00 0.00 H new ATOM 0 HB2 HIS B 68 11.726 10.572 11.532 1.00 0.00 H new ATOM 0 HB3 HIS B 68 12.523 11.946 12.272 1.00 0.00 H new ATOM 0 HD1 HIS B 68 11.204 8.475 13.043 1.00 0.00 H new ATOM 0 HD2 HIS B 68 13.272 11.574 14.997 1.00 0.00 H new ATOM 0 HE1 HIS B 68 12.093 7.530 15.246 1.00 0.00 H new ATOM 2875 N ASN B 69 10.144 13.213 10.684 1.00 0.00 N ATOM 2876 CA ASN B 69 10.100 14.506 9.947 1.00 0.00 C ATOM 2877 C ASN B 69 8.639 14.910 9.711 1.00 0.00 C ATOM 2878 O ASN B 69 7.894 14.176 9.094 1.00 0.00 O ATOM 2879 CB ASN B 69 10.803 14.344 8.598 1.00 0.00 C ATOM 2880 CG ASN B 69 12.313 14.231 8.818 1.00 0.00 C ATOM 2881 OD1 ASN B 69 13.014 15.223 8.818 1.00 0.00 O ATOM 2882 ND2 ASN B 69 12.847 13.055 9.005 1.00 0.00 N ATOM 0 H ASN B 69 9.993 12.382 10.113 1.00 0.00 H new ATOM 0 HA ASN B 69 10.602 15.276 10.533 1.00 0.00 H new ATOM 0 HB2 ASN B 69 10.432 13.455 8.087 1.00 0.00 H new ATOM 0 HB3 ASN B 69 10.581 15.197 7.956 1.00 0.00 H new ATOM 0 HD21 ASN B 69 13.853 12.969 9.151 1.00 0.00 H new ATOM 0 HD22 ASN B 69 12.259 12.222 9.005 1.00 0.00 H new ATOM 2889 N PRO B 70 8.270 16.067 10.206 1.00 0.00 N ATOM 2890 CA PRO B 70 6.900 16.587 10.055 1.00 0.00 C ATOM 2891 C PRO B 70 6.707 17.156 8.648 1.00 0.00 C ATOM 2892 O PRO B 70 6.968 18.316 8.394 1.00 0.00 O ATOM 2893 CB PRO B 70 6.816 17.692 11.111 1.00 0.00 C ATOM 2894 CG PRO B 70 8.272 18.124 11.407 1.00 0.00 C ATOM 2895 CD PRO B 70 9.175 16.962 10.957 1.00 0.00 C ATOM 0 HA PRO B 70 6.131 15.826 10.186 1.00 0.00 H new ATOM 0 HB2 PRO B 70 6.228 18.534 10.746 1.00 0.00 H new ATOM 0 HB3 PRO B 70 6.327 17.329 12.015 1.00 0.00 H new ATOM 0 HG2 PRO B 70 8.521 19.039 10.870 1.00 0.00 H new ATOM 0 HG3 PRO B 70 8.407 18.331 12.469 1.00 0.00 H new ATOM 0 HD2 PRO B 70 9.995 17.315 10.332 1.00 0.00 H new ATOM 0 HD3 PRO B 70 9.622 16.452 11.810 1.00 0.00 H new ATOM 2903 N GLY B 71 6.257 16.347 7.729 1.00 0.00 N ATOM 2904 CA GLY B 71 6.053 16.840 6.337 1.00 0.00 C ATOM 2905 C GLY B 71 6.921 16.024 5.378 1.00 0.00 C ATOM 2906 O GLY B 71 7.361 16.510 4.355 1.00 0.00 O ATOM 0 H GLY B 71 6.022 15.366 7.881 1.00 0.00 H new ATOM 0 HA2 GLY B 71 5.003 16.753 6.059 1.00 0.00 H new ATOM 0 HA3 GLY B 71 6.313 17.896 6.272 1.00 0.00 H new ATOM 2910 N ALA B 72 7.170 14.783 5.700 1.00 0.00 N ATOM 2911 CA ALA B 72 8.004 13.933 4.812 1.00 0.00 C ATOM 2912 C ALA B 72 7.093 13.170 3.857 1.00 0.00 C ATOM 2913 O ALA B 72 6.186 12.471 4.264 1.00 0.00 O ATOM 2914 CB ALA B 72 8.809 12.942 5.650 1.00 0.00 C ATOM 0 H ALA B 72 6.829 14.323 6.544 1.00 0.00 H new ATOM 0 HA ALA B 72 8.692 14.561 4.246 1.00 0.00 H new ATOM 0 HB1 ALA B 72 9.419 12.321 4.993 1.00 0.00 H new ATOM 0 HB2 ALA B 72 9.456 13.488 6.337 1.00 0.00 H new ATOM 0 HB3 ALA B 72 8.128 12.309 6.218 1.00 0.00 H new ATOM 2920 N SER B 73 7.329 13.309 2.590 1.00 0.00 N ATOM 2921 CA SER B 73 6.482 12.605 1.587 1.00 0.00 C ATOM 2922 C SER B 73 7.022 11.194 1.345 1.00 0.00 C ATOM 2923 O SER B 73 6.742 10.582 0.333 1.00 0.00 O ATOM 2924 CB SER B 73 6.499 13.387 0.272 1.00 0.00 C ATOM 2925 OG SER B 73 5.684 14.545 0.403 1.00 0.00 O ATOM 0 H SER B 73 8.076 13.883 2.198 1.00 0.00 H new ATOM 0 HA SER B 73 5.461 12.538 1.964 1.00 0.00 H new ATOM 0 HB2 SER B 73 7.520 13.673 0.019 1.00 0.00 H new ATOM 0 HB3 SER B 73 6.133 12.761 -0.542 1.00 0.00 H new ATOM 0 HG SER B 73 5.694 15.049 -0.437 1.00 0.00 H new ATOM 2931 N ALA B 74 7.788 10.664 2.260 1.00 0.00 N ATOM 2932 CA ALA B 74 8.329 9.290 2.065 1.00 0.00 C ATOM 2933 C ALA B 74 7.826 8.376 3.183 1.00 0.00 C ATOM 2934 O ALA B 74 8.584 7.669 3.814 1.00 0.00 O ATOM 2935 CB ALA B 74 9.857 9.326 2.075 1.00 0.00 C ATOM 0 H ALA B 74 8.061 11.121 3.130 1.00 0.00 H new ATOM 0 HA ALA B 74 7.989 8.905 1.104 1.00 0.00 H new ATOM 0 HB1 ALA B 74 10.246 8.318 1.932 1.00 0.00 H new ATOM 0 HB2 ALA B 74 10.211 9.969 1.269 1.00 0.00 H new ATOM 0 HB3 ALA B 74 10.205 9.717 3.031 1.00 0.00 H new ATOM 2941 N ALA B 75 6.546 8.386 3.420 1.00 0.00 N ATOM 2942 CA ALA B 75 5.964 7.520 4.485 1.00 0.00 C ATOM 2943 C ALA B 75 5.572 6.170 3.866 1.00 0.00 C ATOM 2944 O ALA B 75 5.847 5.934 2.706 1.00 0.00 O ATOM 2945 CB ALA B 75 4.728 8.213 5.060 1.00 0.00 C ATOM 0 H ALA B 75 5.870 8.962 2.918 1.00 0.00 H new ATOM 0 HA ALA B 75 6.688 7.353 5.282 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.292 7.590 5.841 1.00 0.00 H new ATOM 0 HB2 ALA B 75 5.014 9.176 5.482 1.00 0.00 H new ATOM 0 HB3 ALA B 75 3.996 8.367 4.268 1.00 0.00 H new ATOM 2951 N PRO B 76 4.940 5.321 4.642 1.00 0.00 N ATOM 2952 CA PRO B 76 4.508 3.997 4.161 1.00 0.00 C ATOM 2953 C PRO B 76 3.269 4.150 3.285 1.00 0.00 C ATOM 2954 O PRO B 76 2.985 5.219 2.785 1.00 0.00 O ATOM 2955 CB PRO B 76 4.194 3.225 5.442 1.00 0.00 C ATOM 2956 CG PRO B 76 3.915 4.287 6.528 1.00 0.00 C ATOM 2957 CD PRO B 76 4.592 5.589 6.056 1.00 0.00 C ATOM 0 HA PRO B 76 5.255 3.488 3.552 1.00 0.00 H new ATOM 0 HB2 PRO B 76 3.330 2.575 5.303 1.00 0.00 H new ATOM 0 HB3 PRO B 76 5.031 2.587 5.727 1.00 0.00 H new ATOM 0 HG2 PRO B 76 2.843 4.434 6.660 1.00 0.00 H new ATOM 0 HG3 PRO B 76 4.314 3.970 7.491 1.00 0.00 H new ATOM 0 HD2 PRO B 76 3.921 6.443 6.147 1.00 0.00 H new ATOM 0 HD3 PRO B 76 5.478 5.816 6.649 1.00 0.00 H new ATOM 2965 N CYS B 77 2.529 3.097 3.083 1.00 0.00 N ATOM 2966 CA CYS B 77 1.324 3.225 2.223 1.00 0.00 C ATOM 2967 C CYS B 77 0.190 2.329 2.731 1.00 0.00 C ATOM 2968 O CYS B 77 0.105 1.164 2.394 1.00 0.00 O ATOM 2969 CB CYS B 77 1.683 2.838 0.791 1.00 0.00 C ATOM 2970 SG CYS B 77 0.994 4.070 -0.336 1.00 0.00 S ATOM 0 H CYS B 77 2.702 2.169 3.469 1.00 0.00 H new ATOM 0 HA CYS B 77 0.982 4.259 2.254 1.00 0.00 H new ATOM 0 HB2 CYS B 77 2.765 2.784 0.675 1.00 0.00 H new ATOM 0 HB3 CYS B 77 1.288 1.850 0.557 1.00 0.00 H new ATOM 2975 N CYS B 78 -0.696 2.877 3.519 1.00 0.00 N ATOM 2976 CA CYS B 78 -1.844 2.073 4.026 1.00 0.00 C ATOM 2977 C CYS B 78 -2.623 1.533 2.816 1.00 0.00 C ATOM 2978 O CYS B 78 -2.751 2.204 1.812 1.00 0.00 O ATOM 2979 CB CYS B 78 -2.741 2.974 4.882 1.00 0.00 C ATOM 2980 SG CYS B 78 -4.185 2.049 5.462 1.00 0.00 S ATOM 0 H CYS B 78 -0.674 3.847 3.833 1.00 0.00 H new ATOM 0 HA CYS B 78 -1.498 1.239 4.637 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -2.178 3.356 5.734 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -3.063 3.837 4.300 1.00 0.00 H new ATOM 2985 N VAL B 79 -3.120 0.321 2.880 1.00 0.00 N ATOM 2986 CA VAL B 79 -3.848 -0.237 1.703 1.00 0.00 C ATOM 2987 C VAL B 79 -5.028 -1.116 2.148 1.00 0.00 C ATOM 2988 O VAL B 79 -5.109 -1.508 3.290 1.00 0.00 O ATOM 2989 CB VAL B 79 -2.859 -1.064 0.874 1.00 0.00 C ATOM 2990 CG1 VAL B 79 -1.508 -0.358 0.868 1.00 0.00 C ATOM 2991 CG2 VAL B 79 -2.683 -2.453 1.493 1.00 0.00 C ATOM 0 H VAL B 79 -3.053 -0.298 3.688 1.00 0.00 H new ATOM 0 HA VAL B 79 -4.253 0.581 1.107 1.00 0.00 H new ATOM 0 HB VAL B 79 -3.243 -1.167 -0.141 1.00 0.00 H new ATOM 0 HG11 VAL B 79 -0.797 -0.939 0.281 1.00 0.00 H new ATOM 0 HG12 VAL B 79 -1.618 0.634 0.429 1.00 0.00 H new ATOM 0 HG13 VAL B 79 -1.142 -0.263 1.890 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -1.978 -3.031 0.895 1.00 0.00 H new ATOM 0 HG22 VAL B 79 -2.301 -2.353 2.509 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -3.645 -2.965 1.516 1.00 0.00 H new ATOM 3001 N PRO B 80 -5.910 -1.402 1.219 1.00 0.00 N ATOM 3002 CA PRO B 80 -7.101 -2.235 1.476 1.00 0.00 C ATOM 3003 C PRO B 80 -6.725 -3.718 1.529 1.00 0.00 C ATOM 3004 O PRO B 80 -6.674 -4.391 0.518 1.00 0.00 O ATOM 3005 CB PRO B 80 -8.009 -1.950 0.277 1.00 0.00 C ATOM 3006 CG PRO B 80 -7.089 -1.431 -0.852 1.00 0.00 C ATOM 3007 CD PRO B 80 -5.800 -0.926 -0.176 1.00 0.00 C ATOM 0 HA PRO B 80 -7.576 -2.009 2.431 1.00 0.00 H new ATOM 0 HB2 PRO B 80 -8.536 -2.852 -0.035 1.00 0.00 H new ATOM 0 HB3 PRO B 80 -8.768 -1.210 0.531 1.00 0.00 H new ATOM 0 HG2 PRO B 80 -6.866 -2.225 -1.565 1.00 0.00 H new ATOM 0 HG3 PRO B 80 -7.574 -0.629 -1.408 1.00 0.00 H new ATOM 0 HD2 PRO B 80 -4.911 -1.326 -0.664 1.00 0.00 H new ATOM 0 HD3 PRO B 80 -5.726 0.161 -0.221 1.00 0.00 H new ATOM 3015 N GLN B 81 -6.471 -4.235 2.699 1.00 0.00 N ATOM 3016 CA GLN B 81 -6.111 -5.672 2.814 1.00 0.00 C ATOM 3017 C GLN B 81 -7.325 -6.521 2.431 1.00 0.00 C ATOM 3018 O GLN B 81 -7.324 -7.204 1.425 1.00 0.00 O ATOM 3019 CB GLN B 81 -5.702 -5.972 4.258 1.00 0.00 C ATOM 3020 CG GLN B 81 -5.524 -7.479 4.446 1.00 0.00 C ATOM 3021 CD GLN B 81 -4.051 -7.848 4.265 1.00 0.00 C ATOM 3022 OE1 GLN B 81 -3.310 -7.146 3.452 1.00 0.00 O flip ATOM 3023 NE2 GLN B 81 -3.569 -8.786 4.870 1.00 0.00 N flip ATOM 0 H GLN B 81 -6.498 -3.722 3.580 1.00 0.00 H new ATOM 0 HA GLN B 81 -5.280 -5.906 2.148 1.00 0.00 H new ATOM 0 HB2 GLN B 81 -4.773 -5.455 4.497 1.00 0.00 H new ATOM 0 HB3 GLN B 81 -6.461 -5.598 4.945 1.00 0.00 H new ATOM 0 HG2 GLN B 81 -5.864 -7.775 5.439 1.00 0.00 H new ATOM 0 HG3 GLN B 81 -6.136 -8.021 3.725 1.00 0.00 H new ATOM 0 HE21 GLN B 81 -4.148 -9.335 5.506 1.00 0.00 H new ATOM 0 HE22 GLN B 81 -2.585 -9.024 4.742 1.00 0.00 H new ATOM 3032 N ALA B 82 -8.361 -6.479 3.221 1.00 0.00 N ATOM 3033 CA ALA B 82 -9.576 -7.277 2.900 1.00 0.00 C ATOM 3034 C ALA B 82 -10.486 -6.458 1.984 1.00 0.00 C ATOM 3035 O ALA B 82 -10.437 -5.244 1.972 1.00 0.00 O ATOM 3036 CB ALA B 82 -10.322 -7.619 4.191 1.00 0.00 C ATOM 0 H ALA B 82 -8.419 -5.926 4.076 1.00 0.00 H new ATOM 0 HA ALA B 82 -9.286 -8.200 2.399 1.00 0.00 H new ATOM 0 HB1 ALA B 82 -11.211 -8.203 3.954 1.00 0.00 H new ATOM 0 HB2 ALA B 82 -9.671 -8.199 4.845 1.00 0.00 H new ATOM 0 HB3 ALA B 82 -10.617 -6.699 4.696 1.00 0.00 H new ATOM 3042 N LEU B 83 -11.314 -7.109 1.215 1.00 0.00 N ATOM 3043 CA LEU B 83 -12.219 -6.360 0.301 1.00 0.00 C ATOM 3044 C LEU B 83 -13.595 -7.012 0.289 1.00 0.00 C ATOM 3045 O LEU B 83 -13.913 -7.856 1.104 1.00 0.00 O ATOM 3046 CB LEU B 83 -11.652 -6.387 -1.119 1.00 0.00 C ATOM 3047 CG LEU B 83 -10.314 -5.660 -1.141 1.00 0.00 C ATOM 3048 CD1 LEU B 83 -9.411 -6.282 -2.205 1.00 0.00 C ATOM 3049 CD2 LEU B 83 -10.547 -4.186 -1.474 1.00 0.00 C ATOM 0 H LEU B 83 -11.403 -8.125 1.180 1.00 0.00 H new ATOM 0 HA LEU B 83 -12.300 -5.331 0.651 1.00 0.00 H new ATOM 0 HB2 LEU B 83 -11.525 -7.417 -1.452 1.00 0.00 H new ATOM 0 HB3 LEU B 83 -12.348 -5.912 -1.810 1.00 0.00 H new ATOM 0 HG LEU B 83 -9.837 -5.746 -0.165 1.00 0.00 H new ATOM 0 HD11 LEU B 83 -8.454 -5.761 -2.220 1.00 0.00 H new ATOM 0 HD12 LEU B 83 -9.248 -7.335 -1.973 1.00 0.00 H new ATOM 0 HD13 LEU B 83 -9.887 -6.195 -3.182 1.00 0.00 H new ATOM 0 HD21 LEU B 83 -9.592 -3.661 -1.491 1.00 0.00 H new ATOM 0 HD22 LEU B 83 -11.023 -4.105 -2.451 1.00 0.00 H new ATOM 0 HD23 LEU B 83 -11.193 -3.740 -0.718 1.00 0.00 H new ATOM 3061 N GLU B 84 -14.404 -6.625 -0.646 1.00 0.00 N ATOM 3062 CA GLU B 84 -15.766 -7.205 -0.758 1.00 0.00 C ATOM 3063 C GLU B 84 -16.202 -7.128 -2.221 1.00 0.00 C ATOM 3064 O GLU B 84 -15.665 -6.349 -2.983 1.00 0.00 O ATOM 3065 CB GLU B 84 -16.739 -6.407 0.113 1.00 0.00 C ATOM 3066 CG GLU B 84 -16.762 -6.998 1.524 1.00 0.00 C ATOM 3067 CD GLU B 84 -17.222 -8.456 1.461 1.00 0.00 C ATOM 3068 OE1 GLU B 84 -16.377 -9.315 1.266 1.00 0.00 O ATOM 3069 OE2 GLU B 84 -18.411 -8.689 1.606 1.00 0.00 O ATOM 0 H GLU B 84 -14.178 -5.921 -1.349 1.00 0.00 H new ATOM 0 HA GLU B 84 -15.762 -8.242 -0.421 1.00 0.00 H new ATOM 0 HB2 GLU B 84 -16.436 -5.361 0.150 1.00 0.00 H new ATOM 0 HB3 GLU B 84 -17.739 -6.434 -0.321 1.00 0.00 H new ATOM 0 HG2 GLU B 84 -15.770 -6.938 1.971 1.00 0.00 H new ATOM 0 HG3 GLU B 84 -17.433 -6.421 2.160 1.00 0.00 H new ATOM 3076 N PRO B 85 -17.159 -7.940 -2.574 1.00 0.00 N ATOM 3077 CA PRO B 85 -17.680 -7.984 -3.946 1.00 0.00 C ATOM 3078 C PRO B 85 -18.562 -6.764 -4.225 1.00 0.00 C ATOM 3079 O PRO B 85 -18.484 -5.763 -3.542 1.00 0.00 O ATOM 3080 CB PRO B 85 -18.473 -9.291 -3.992 1.00 0.00 C ATOM 3081 CG PRO B 85 -18.816 -9.643 -2.527 1.00 0.00 C ATOM 3082 CD PRO B 85 -17.813 -8.879 -1.643 1.00 0.00 C ATOM 0 HA PRO B 85 -16.900 -7.955 -4.707 1.00 0.00 H new ATOM 0 HB2 PRO B 85 -19.379 -9.175 -4.586 1.00 0.00 H new ATOM 0 HB3 PRO B 85 -17.887 -10.085 -4.456 1.00 0.00 H new ATOM 0 HG2 PRO B 85 -19.840 -9.355 -2.289 1.00 0.00 H new ATOM 0 HG3 PRO B 85 -18.740 -10.717 -2.359 1.00 0.00 H new ATOM 0 HD2 PRO B 85 -18.316 -8.352 -0.833 1.00 0.00 H new ATOM 0 HD3 PRO B 85 -17.091 -9.554 -1.184 1.00 0.00 H new ATOM 3090 N LEU B 86 -19.377 -6.827 -5.239 1.00 0.00 N ATOM 3091 CA LEU B 86 -20.234 -5.657 -5.579 1.00 0.00 C ATOM 3092 C LEU B 86 -21.345 -6.093 -6.550 1.00 0.00 C ATOM 3093 O LEU B 86 -21.079 -6.391 -7.693 1.00 0.00 O ATOM 3094 CB LEU B 86 -19.322 -4.580 -6.203 1.00 0.00 C ATOM 3095 CG LEU B 86 -20.043 -3.784 -7.299 1.00 0.00 C ATOM 3096 CD1 LEU B 86 -21.176 -2.952 -6.708 1.00 0.00 C ATOM 3097 CD2 LEU B 86 -19.045 -2.849 -7.983 1.00 0.00 C ATOM 0 H LEU B 86 -19.487 -7.638 -5.848 1.00 0.00 H new ATOM 0 HA LEU B 86 -20.722 -5.250 -4.693 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -18.980 -3.898 -5.424 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -18.435 -5.054 -6.623 1.00 0.00 H new ATOM 0 HG LEU B 86 -20.461 -4.487 -8.020 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -21.673 -2.396 -7.503 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -21.896 -3.611 -6.222 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -20.771 -2.253 -5.976 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -19.553 -2.282 -8.763 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -18.628 -2.161 -7.247 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -18.242 -3.437 -8.427 1.00 0.00 H new ATOM 3109 N PRO B 87 -22.563 -6.112 -6.062 1.00 0.00 N ATOM 3110 CA PRO B 87 -23.732 -6.501 -6.872 1.00 0.00 C ATOM 3111 C PRO B 87 -24.098 -5.355 -7.812 1.00 0.00 C ATOM 3112 O PRO B 87 -24.491 -4.288 -7.383 1.00 0.00 O ATOM 3113 CB PRO B 87 -24.830 -6.743 -5.833 1.00 0.00 C ATOM 3114 CG PRO B 87 -24.414 -5.957 -4.569 1.00 0.00 C ATOM 3115 CD PRO B 87 -22.891 -5.744 -4.669 1.00 0.00 C ATOM 0 HA PRO B 87 -23.564 -7.377 -7.498 1.00 0.00 H new ATOM 0 HB2 PRO B 87 -25.797 -6.401 -6.203 1.00 0.00 H new ATOM 0 HB3 PRO B 87 -24.930 -7.806 -5.614 1.00 0.00 H new ATOM 0 HG2 PRO B 87 -24.937 -5.002 -4.516 1.00 0.00 H new ATOM 0 HG3 PRO B 87 -24.670 -6.511 -3.666 1.00 0.00 H new ATOM 0 HD2 PRO B 87 -22.619 -4.710 -4.456 1.00 0.00 H new ATOM 0 HD3 PRO B 87 -22.354 -6.369 -3.955 1.00 0.00 H new ATOM 3123 N ILE B 88 -23.949 -5.556 -9.091 1.00 0.00 N ATOM 3124 CA ILE B 88 -24.264 -4.463 -10.048 1.00 0.00 C ATOM 3125 C ILE B 88 -25.241 -4.943 -11.111 1.00 0.00 C ATOM 3126 O ILE B 88 -25.904 -5.950 -10.971 1.00 0.00 O ATOM 3127 CB ILE B 88 -22.974 -4.015 -10.742 1.00 0.00 C ATOM 3128 CG1 ILE B 88 -22.598 -5.025 -11.832 1.00 0.00 C ATOM 3129 CG2 ILE B 88 -21.846 -3.951 -9.720 1.00 0.00 C ATOM 3130 CD1 ILE B 88 -21.192 -4.732 -12.336 1.00 0.00 C ATOM 0 H ILE B 88 -23.624 -6.426 -9.513 1.00 0.00 H new ATOM 0 HA ILE B 88 -24.712 -3.638 -9.495 1.00 0.00 H new ATOM 0 HB ILE B 88 -23.129 -3.033 -11.188 1.00 0.00 H new ATOM 0 HG12 ILE B 88 -22.649 -6.039 -11.436 1.00 0.00 H new ATOM 0 HG13 ILE B 88 -23.310 -4.968 -12.656 1.00 0.00 H new ATOM 0 HG21 ILE B 88 -20.927 -3.632 -10.212 1.00 0.00 H new ATOM 0 HG22 ILE B 88 -22.104 -3.238 -8.937 1.00 0.00 H new ATOM 0 HG23 ILE B 88 -21.698 -4.937 -9.279 1.00 0.00 H new ATOM 0 HD11 ILE B 88 -20.926 -5.451 -13.111 1.00 0.00 H new ATOM 0 HD12 ILE B 88 -21.156 -3.724 -12.749 1.00 0.00 H new ATOM 0 HD13 ILE B 88 -20.485 -4.811 -11.510 1.00 0.00 H new ATOM 3142 N VAL B 89 -25.287 -4.220 -12.190 1.00 0.00 N ATOM 3143 CA VAL B 89 -26.168 -4.577 -13.328 1.00 0.00 C ATOM 3144 C VAL B 89 -25.701 -3.793 -14.549 1.00 0.00 C ATOM 3145 O VAL B 89 -25.827 -2.587 -14.604 1.00 0.00 O ATOM 3146 CB VAL B 89 -27.620 -4.197 -13.031 1.00 0.00 C ATOM 3147 CG1 VAL B 89 -28.523 -4.810 -14.100 1.00 0.00 C ATOM 3148 CG2 VAL B 89 -28.034 -4.717 -11.653 1.00 0.00 C ATOM 0 H VAL B 89 -24.735 -3.374 -12.333 1.00 0.00 H new ATOM 0 HA VAL B 89 -26.116 -5.652 -13.500 1.00 0.00 H new ATOM 0 HB VAL B 89 -27.716 -3.111 -13.039 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -29.560 -4.544 -13.896 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -28.237 -4.429 -15.080 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -28.417 -5.895 -14.087 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -29.069 -4.439 -11.455 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -27.939 -5.803 -11.630 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -27.389 -4.280 -10.890 1.00 0.00 H new ATOM 3158 N TYR B 90 -25.159 -4.455 -15.526 1.00 0.00 N ATOM 3159 CA TYR B 90 -24.684 -3.722 -16.728 1.00 0.00 C ATOM 3160 C TYR B 90 -25.438 -4.207 -17.961 1.00 0.00 C ATOM 3161 O TYR B 90 -26.396 -4.946 -17.865 1.00 0.00 O ATOM 3162 CB TYR B 90 -23.184 -3.946 -16.906 1.00 0.00 C ATOM 3163 CG TYR B 90 -22.816 -5.356 -16.514 1.00 0.00 C ATOM 3164 CD1 TYR B 90 -22.625 -5.677 -15.166 1.00 0.00 C ATOM 3165 CD2 TYR B 90 -22.654 -6.337 -17.498 1.00 0.00 C ATOM 3166 CE1 TYR B 90 -22.273 -6.980 -14.798 1.00 0.00 C ATOM 3167 CE2 TYR B 90 -22.302 -7.641 -17.130 1.00 0.00 C ATOM 3168 CZ TYR B 90 -22.111 -7.963 -15.781 1.00 0.00 C ATOM 3169 OH TYR B 90 -21.763 -9.249 -15.421 1.00 0.00 O ATOM 0 H TYR B 90 -25.024 -5.466 -15.546 1.00 0.00 H new ATOM 0 HA TYR B 90 -24.871 -2.656 -16.599 1.00 0.00 H new ATOM 0 HB2 TYR B 90 -22.903 -3.764 -17.943 1.00 0.00 H new ATOM 0 HB3 TYR B 90 -22.628 -3.234 -16.296 1.00 0.00 H new ATOM 0 HD1 TYR B 90 -22.749 -4.918 -14.408 1.00 0.00 H new ATOM 0 HD2 TYR B 90 -22.800 -6.089 -18.539 1.00 0.00 H new ATOM 0 HE1 TYR B 90 -22.126 -7.227 -13.757 1.00 0.00 H new ATOM 0 HE2 TYR B 90 -22.178 -8.400 -17.888 1.00 0.00 H new ATOM 0 HH TYR B 90 -21.693 -9.806 -16.224 1.00 0.00 H new ATOM 3179 N TYR B 91 -25.028 -3.781 -19.121 1.00 0.00 N ATOM 3180 CA TYR B 91 -25.739 -4.202 -20.355 1.00 0.00 C ATOM 3181 C TYR B 91 -24.749 -4.681 -21.414 1.00 0.00 C ATOM 3182 O TYR B 91 -23.783 -4.014 -21.727 1.00 0.00 O ATOM 3183 CB TYR B 91 -26.508 -3.010 -20.916 1.00 0.00 C ATOM 3184 CG TYR B 91 -27.907 -3.005 -20.362 1.00 0.00 C ATOM 3185 CD1 TYR B 91 -28.168 -2.384 -19.138 1.00 0.00 C ATOM 3186 CD2 TYR B 91 -28.942 -3.608 -21.080 1.00 0.00 C ATOM 3187 CE1 TYR B 91 -29.472 -2.370 -18.628 1.00 0.00 C ATOM 3188 CE2 TYR B 91 -30.245 -3.593 -20.576 1.00 0.00 C ATOM 3189 CZ TYR B 91 -30.512 -2.973 -19.348 1.00 0.00 C ATOM 3190 OH TYR B 91 -31.799 -2.956 -18.849 1.00 0.00 O ATOM 0 H TYR B 91 -24.232 -3.160 -19.267 1.00 0.00 H new ATOM 0 HA TYR B 91 -26.416 -5.018 -20.104 1.00 0.00 H new ATOM 0 HB2 TYR B 91 -26.000 -2.082 -20.656 1.00 0.00 H new ATOM 0 HB3 TYR B 91 -26.537 -3.063 -22.004 1.00 0.00 H new ATOM 0 HD1 TYR B 91 -27.366 -1.916 -18.587 1.00 0.00 H new ATOM 0 HD2 TYR B 91 -28.735 -4.086 -22.026 1.00 0.00 H new ATOM 0 HE1 TYR B 91 -29.676 -1.895 -17.680 1.00 0.00 H new ATOM 0 HE2 TYR B 91 -31.045 -4.059 -21.132 1.00 0.00 H new ATOM 0 HH TYR B 91 -32.398 -3.417 -19.473 1.00 0.00 H new ATOM 3200 N VAL B 92 -25.009 -5.816 -21.994 1.00 0.00 N ATOM 3201 CA VAL B 92 -24.119 -6.329 -23.067 1.00 0.00 C ATOM 3202 C VAL B 92 -24.847 -6.146 -24.392 1.00 0.00 C ATOM 3203 O VAL B 92 -25.624 -6.983 -24.806 1.00 0.00 O ATOM 3204 CB VAL B 92 -23.823 -7.808 -22.853 1.00 0.00 C ATOM 3205 CG1 VAL B 92 -22.437 -8.119 -23.413 1.00 0.00 C ATOM 3206 CG2 VAL B 92 -23.860 -8.129 -21.357 1.00 0.00 C ATOM 0 H VAL B 92 -25.804 -6.414 -21.769 1.00 0.00 H new ATOM 0 HA VAL B 92 -23.173 -5.788 -23.059 1.00 0.00 H new ATOM 0 HB VAL B 92 -24.572 -8.413 -23.364 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -22.214 -9.176 -23.266 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -22.415 -7.889 -24.478 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -21.692 -7.515 -22.896 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -23.648 -9.188 -21.207 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -23.110 -7.532 -20.838 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -24.848 -7.897 -20.959 1.00 0.00 H new ATOM 3216 N GLY B 93 -24.625 -5.046 -25.044 1.00 0.00 N ATOM 3217 CA GLY B 93 -25.332 -4.789 -26.326 1.00 0.00 C ATOM 3218 C GLY B 93 -26.760 -4.336 -26.009 1.00 0.00 C ATOM 3219 O GLY B 93 -27.075 -3.163 -26.057 1.00 0.00 O ATOM 0 H GLY B 93 -23.984 -4.311 -24.746 1.00 0.00 H new ATOM 0 HA2 GLY B 93 -24.810 -4.023 -26.900 1.00 0.00 H new ATOM 0 HA3 GLY B 93 -25.347 -5.691 -26.938 1.00 0.00 H new ATOM 3223 N ARG B 94 -27.629 -5.258 -25.686 1.00 0.00 N ATOM 3224 CA ARG B 94 -29.039 -4.878 -25.367 1.00 0.00 C ATOM 3225 C ARG B 94 -29.617 -5.779 -24.266 1.00 0.00 C ATOM 3226 O ARG B 94 -30.733 -5.586 -23.827 1.00 0.00 O ATOM 3227 CB ARG B 94 -29.885 -5.038 -26.623 1.00 0.00 C ATOM 3228 CG ARG B 94 -29.313 -4.162 -27.741 1.00 0.00 C ATOM 3229 CD ARG B 94 -30.314 -4.088 -28.894 1.00 0.00 C ATOM 3230 NE ARG B 94 -29.719 -3.313 -30.019 1.00 0.00 N ATOM 3231 CZ ARG B 94 -30.356 -2.288 -30.517 1.00 0.00 C ATOM 3232 NH1 ARG B 94 -31.267 -2.470 -31.433 1.00 0.00 N ATOM 3233 NH2 ARG B 94 -30.082 -1.083 -30.098 1.00 0.00 N ATOM 0 H ARG B 94 -27.425 -6.256 -25.629 1.00 0.00 H new ATOM 0 HA ARG B 94 -29.051 -3.846 -25.017 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -29.897 -6.082 -26.935 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -30.917 -4.755 -26.417 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -29.104 -3.162 -27.362 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -28.367 -4.574 -28.093 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -30.575 -5.092 -29.228 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -31.236 -3.614 -28.559 1.00 0.00 H new ATOM 0 HE ARG B 94 -28.813 -3.584 -30.401 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -31.481 -3.412 -31.759 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -31.765 -1.670 -31.823 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -29.370 -0.942 -29.381 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -30.580 -0.282 -30.487 1.00 0.00 H new ATOM 3247 N LYS B 95 -28.885 -6.759 -23.819 1.00 0.00 N ATOM 3248 CA LYS B 95 -29.419 -7.656 -22.756 1.00 0.00 C ATOM 3249 C LYS B 95 -28.884 -7.206 -21.392 1.00 0.00 C ATOM 3250 O LYS B 95 -27.698 -7.004 -21.237 1.00 0.00 O ATOM 3251 CB LYS B 95 -28.968 -9.093 -23.030 1.00 0.00 C ATOM 3252 CG LYS B 95 -29.680 -9.624 -24.277 1.00 0.00 C ATOM 3253 CD LYS B 95 -30.577 -10.801 -23.890 1.00 0.00 C ATOM 3254 CE LYS B 95 -31.625 -11.026 -24.982 1.00 0.00 C ATOM 3255 NZ LYS B 95 -32.933 -10.465 -24.538 1.00 0.00 N ATOM 0 H LYS B 95 -27.943 -6.978 -24.142 1.00 0.00 H new ATOM 0 HA LYS B 95 -30.508 -7.609 -22.753 1.00 0.00 H new ATOM 0 HB2 LYS B 95 -27.888 -9.125 -23.174 1.00 0.00 H new ATOM 0 HB3 LYS B 95 -29.194 -9.726 -22.172 1.00 0.00 H new ATOM 0 HG2 LYS B 95 -30.276 -8.833 -24.733 1.00 0.00 H new ATOM 0 HG3 LYS B 95 -28.948 -9.940 -25.020 1.00 0.00 H new ATOM 0 HD2 LYS B 95 -29.977 -11.701 -23.757 1.00 0.00 H new ATOM 0 HD3 LYS B 95 -31.067 -10.601 -22.937 1.00 0.00 H new ATOM 0 HE2 LYS B 95 -31.308 -10.548 -25.909 1.00 0.00 H new ATOM 0 HE3 LYS B 95 -31.726 -12.091 -25.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 95 -33.646 -10.618 -25.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 95 -33.236 -10.940 -23.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 95 -32.831 -9.445 -24.360 1.00 0.00 H new ATOM 3269 N PRO B 96 -29.771 -7.065 -20.438 1.00 0.00 N ATOM 3270 CA PRO B 96 -29.400 -6.640 -19.078 1.00 0.00 C ATOM 3271 C PRO B 96 -28.796 -7.817 -18.304 1.00 0.00 C ATOM 3272 O PRO B 96 -29.221 -8.946 -18.450 1.00 0.00 O ATOM 3273 CB PRO B 96 -30.732 -6.206 -18.461 1.00 0.00 C ATOM 3274 CG PRO B 96 -31.840 -6.924 -19.270 1.00 0.00 C ATOM 3275 CD PRO B 96 -31.215 -7.315 -20.622 1.00 0.00 C ATOM 0 HA PRO B 96 -28.653 -5.847 -19.062 1.00 0.00 H new ATOM 0 HB2 PRO B 96 -30.780 -6.480 -17.407 1.00 0.00 H new ATOM 0 HB3 PRO B 96 -30.851 -5.124 -18.514 1.00 0.00 H new ATOM 0 HG2 PRO B 96 -32.197 -7.806 -18.739 1.00 0.00 H new ATOM 0 HG3 PRO B 96 -32.699 -6.269 -19.415 1.00 0.00 H new ATOM 0 HD2 PRO B 96 -31.411 -8.360 -20.864 1.00 0.00 H new ATOM 0 HD3 PRO B 96 -31.622 -6.717 -21.437 1.00 0.00 H new ATOM 3283 N LYS B 97 -27.810 -7.567 -17.485 1.00 0.00 N ATOM 3284 CA LYS B 97 -27.186 -8.680 -16.712 1.00 0.00 C ATOM 3285 C LYS B 97 -26.780 -8.186 -15.321 1.00 0.00 C ATOM 3286 O LYS B 97 -26.324 -7.073 -15.155 1.00 0.00 O ATOM 3287 CB LYS B 97 -25.940 -9.177 -17.450 1.00 0.00 C ATOM 3288 CG LYS B 97 -26.350 -9.878 -18.746 1.00 0.00 C ATOM 3289 CD LYS B 97 -25.738 -11.280 -18.784 1.00 0.00 C ATOM 3290 CE LYS B 97 -24.299 -11.196 -19.294 1.00 0.00 C ATOM 3291 NZ LYS B 97 -23.588 -12.470 -18.987 1.00 0.00 N ATOM 0 H LYS B 97 -27.411 -6.643 -17.318 1.00 0.00 H new ATOM 0 HA LYS B 97 -27.907 -9.492 -16.612 1.00 0.00 H new ATOM 0 HB2 LYS B 97 -25.280 -8.339 -17.672 1.00 0.00 H new ATOM 0 HB3 LYS B 97 -25.380 -9.864 -16.816 1.00 0.00 H new ATOM 0 HG2 LYS B 97 -27.436 -9.942 -18.809 1.00 0.00 H new ATOM 0 HG3 LYS B 97 -26.014 -9.300 -19.607 1.00 0.00 H new ATOM 0 HD2 LYS B 97 -25.757 -11.723 -17.788 1.00 0.00 H new ATOM 0 HD3 LYS B 97 -26.327 -11.928 -19.433 1.00 0.00 H new ATOM 0 HE2 LYS B 97 -24.293 -11.013 -20.369 1.00 0.00 H new ATOM 0 HE3 LYS B 97 -23.784 -10.358 -18.825 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 -22.609 -12.413 -19.334 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 -23.583 -12.626 -17.959 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 -24.076 -13.261 -19.454 1.00 0.00 H new ATOM 3305 N VAL B 98 -26.929 -9.013 -14.323 1.00 0.00 N ATOM 3306 CA VAL B 98 -26.540 -8.603 -12.943 1.00 0.00 C ATOM 3307 C VAL B 98 -25.391 -9.494 -12.471 1.00 0.00 C ATOM 3308 O VAL B 98 -25.433 -10.698 -12.622 1.00 0.00 O ATOM 3309 CB VAL B 98 -27.728 -8.773 -11.997 1.00 0.00 C ATOM 3310 CG1 VAL B 98 -27.270 -8.532 -10.557 1.00 0.00 C ATOM 3311 CG2 VAL B 98 -28.819 -7.764 -12.360 1.00 0.00 C ATOM 0 H VAL B 98 -27.304 -9.958 -14.404 1.00 0.00 H new ATOM 0 HA VAL B 98 -26.231 -7.558 -12.946 1.00 0.00 H new ATOM 0 HB VAL B 98 -28.124 -9.784 -12.089 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -28.116 -8.653 -9.881 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -26.493 -9.251 -10.297 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -26.874 -7.521 -10.466 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -29.666 -7.886 -11.685 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -28.424 -6.752 -12.268 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -29.145 -7.934 -13.386 1.00 0.00 H new ATOM 3321 N GLU B 99 -24.364 -8.924 -11.904 1.00 0.00 N ATOM 3322 CA GLU B 99 -23.230 -9.765 -11.437 1.00 0.00 C ATOM 3323 C GLU B 99 -22.809 -9.340 -10.036 1.00 0.00 C ATOM 3324 O GLU B 99 -23.561 -8.736 -9.297 1.00 0.00 O ATOM 3325 CB GLU B 99 -22.045 -9.601 -12.383 1.00 0.00 C ATOM 3326 CG GLU B 99 -21.590 -10.973 -12.883 1.00 0.00 C ATOM 3327 CD GLU B 99 -20.079 -10.956 -13.119 1.00 0.00 C ATOM 3328 OE1 GLU B 99 -19.453 -9.977 -12.749 1.00 0.00 O ATOM 3329 OE2 GLU B 99 -19.574 -11.923 -13.665 1.00 0.00 O ATOM 0 H GLU B 99 -24.262 -7.922 -11.745 1.00 0.00 H new ATOM 0 HA GLU B 99 -23.548 -10.807 -11.421 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -22.326 -8.971 -13.227 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -21.224 -9.100 -11.870 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -21.846 -11.741 -12.153 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -22.110 -11.226 -13.807 1.00 0.00 H new ATOM 3336 N GLN B 100 -21.602 -9.656 -9.674 1.00 0.00 N ATOM 3337 CA GLN B 100 -21.098 -9.287 -8.328 1.00 0.00 C ATOM 3338 C GLN B 100 -19.592 -9.062 -8.415 1.00 0.00 C ATOM 3339 O GLN B 100 -18.807 -9.938 -8.112 1.00 0.00 O ATOM 3340 CB GLN B 100 -21.373 -10.427 -7.360 1.00 0.00 C ATOM 3341 CG GLN B 100 -22.858 -10.793 -7.400 1.00 0.00 C ATOM 3342 CD GLN B 100 -23.197 -11.681 -6.201 1.00 0.00 C ATOM 3343 OE1 GLN B 100 -22.453 -11.738 -5.243 1.00 0.00 O ATOM 3344 NE2 GLN B 100 -24.297 -12.383 -6.215 1.00 0.00 N ATOM 0 H GLN B 100 -20.936 -10.160 -10.260 1.00 0.00 H new ATOM 0 HA GLN B 100 -21.595 -8.382 -7.979 1.00 0.00 H new ATOM 0 HB2 GLN B 100 -20.768 -11.294 -7.624 1.00 0.00 H new ATOM 0 HB3 GLN B 100 -21.088 -10.135 -6.349 1.00 0.00 H new ATOM 0 HG2 GLN B 100 -23.467 -9.889 -7.380 1.00 0.00 H new ATOM 0 HG3 GLN B 100 -23.090 -11.314 -8.329 1.00 0.00 H new ATOM 0 HE21 GLN B 100 -24.922 -12.335 -7.020 1.00 0.00 H new ATOM 0 HE22 GLN B 100 -24.532 -12.979 -5.421 1.00 0.00 H new ATOM 3353 N LEU B 101 -19.182 -7.903 -8.836 1.00 0.00 N ATOM 3354 CA LEU B 101 -17.725 -7.633 -8.953 1.00 0.00 C ATOM 3355 C LEU B 101 -17.015 -8.156 -7.711 1.00 0.00 C ATOM 3356 O LEU B 101 -17.557 -8.161 -6.624 1.00 0.00 O ATOM 3357 CB LEU B 101 -17.481 -6.131 -9.105 1.00 0.00 C ATOM 3358 CG LEU B 101 -18.290 -5.583 -10.287 1.00 0.00 C ATOM 3359 CD1 LEU B 101 -17.663 -4.276 -10.768 1.00 0.00 C ATOM 3360 CD2 LEU B 101 -18.289 -6.593 -11.435 1.00 0.00 C ATOM 0 H LEU B 101 -19.791 -7.130 -9.104 1.00 0.00 H new ATOM 0 HA LEU B 101 -17.332 -8.140 -9.834 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -17.765 -5.614 -8.189 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -16.419 -5.941 -9.262 1.00 0.00 H new ATOM 0 HG LEU B 101 -19.316 -5.406 -9.965 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -18.237 -3.885 -11.608 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -17.668 -3.549 -9.956 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -16.636 -4.460 -11.084 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -18.866 -6.195 -12.270 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -17.264 -6.777 -11.757 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -18.736 -7.528 -11.098 1.00 0.00 H new ATOM 3372 N SER B 102 -15.815 -8.624 -7.876 1.00 0.00 N ATOM 3373 CA SER B 102 -15.065 -9.186 -6.710 1.00 0.00 C ATOM 3374 C SER B 102 -14.028 -8.189 -6.181 1.00 0.00 C ATOM 3375 O SER B 102 -13.382 -7.489 -6.935 1.00 0.00 O ATOM 3376 CB SER B 102 -14.354 -10.469 -7.143 1.00 0.00 C ATOM 3377 OG SER B 102 -15.299 -11.527 -7.219 1.00 0.00 O ATOM 0 H SER B 102 -15.315 -8.645 -8.765 1.00 0.00 H new ATOM 0 HA SER B 102 -15.777 -9.394 -5.912 1.00 0.00 H new ATOM 0 HB2 SER B 102 -13.875 -10.324 -8.111 1.00 0.00 H new ATOM 0 HB3 SER B 102 -13.567 -10.720 -6.432 1.00 0.00 H new ATOM 0 HG SER B 102 -14.847 -12.350 -7.498 1.00 0.00 H new ATOM 3383 N ASN B 103 -13.851 -8.141 -4.883 1.00 0.00 N ATOM 3384 CA ASN B 103 -12.836 -7.210 -4.295 1.00 0.00 C ATOM 3385 C ASN B 103 -13.030 -5.803 -4.849 1.00 0.00 C ATOM 3386 O ASN B 103 -12.084 -5.062 -5.032 1.00 0.00 O ATOM 3387 CB ASN B 103 -11.433 -7.698 -4.652 1.00 0.00 C ATOM 3388 CG ASN B 103 -11.026 -8.827 -3.703 1.00 0.00 C ATOM 3389 OD1 ASN B 103 -11.950 -9.534 -3.113 1.00 0.00 O flip ATOM 3390 ND2 ASN B 103 -9.853 -9.070 -3.498 1.00 0.00 N flip ATOM 0 H ASN B 103 -14.364 -8.705 -4.206 1.00 0.00 H new ATOM 0 HA ASN B 103 -12.960 -7.190 -3.212 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -11.411 -8.050 -5.683 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -10.722 -6.875 -4.581 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -9.130 -8.518 -3.959 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -9.592 -9.826 -2.865 1.00 0.00 H new ATOM 3397 N MET B 104 -14.244 -5.422 -5.105 1.00 0.00 N ATOM 3398 CA MET B 104 -14.487 -4.055 -5.634 1.00 0.00 C ATOM 3399 C MET B 104 -14.806 -3.120 -4.467 1.00 0.00 C ATOM 3400 O MET B 104 -15.217 -1.995 -4.658 1.00 0.00 O ATOM 3401 CB MET B 104 -15.667 -4.079 -6.607 1.00 0.00 C ATOM 3402 CG MET B 104 -15.911 -2.668 -7.143 1.00 0.00 C ATOM 3403 SD MET B 104 -15.847 -2.688 -8.952 1.00 0.00 S ATOM 3404 CE MET B 104 -17.004 -1.325 -9.230 1.00 0.00 C ATOM 0 H MET B 104 -15.078 -5.994 -4.972 1.00 0.00 H new ATOM 0 HA MET B 104 -13.599 -3.703 -6.159 1.00 0.00 H new ATOM 0 HB2 MET B 104 -15.460 -4.762 -7.431 1.00 0.00 H new ATOM 0 HB3 MET B 104 -16.560 -4.448 -6.104 1.00 0.00 H new ATOM 0 HG2 MET B 104 -16.882 -2.303 -6.807 1.00 0.00 H new ATOM 0 HG3 MET B 104 -15.160 -1.983 -6.750 1.00 0.00 H new ATOM 0 HE1 MET B 104 -17.790 -1.648 -9.913 1.00 0.00 H new ATOM 0 HE2 MET B 104 -17.449 -1.026 -8.281 1.00 0.00 H new ATOM 0 HE3 MET B 104 -16.472 -0.479 -9.664 1.00 0.00 H new ATOM 3414 N ILE B 105 -14.612 -3.578 -3.257 1.00 0.00 N ATOM 3415 CA ILE B 105 -14.900 -2.712 -2.080 1.00 0.00 C ATOM 3416 C ILE B 105 -13.833 -2.948 -1.011 1.00 0.00 C ATOM 3417 O ILE B 105 -13.065 -3.886 -1.086 1.00 0.00 O ATOM 3418 CB ILE B 105 -16.276 -3.057 -1.508 1.00 0.00 C ATOM 3419 CG1 ILE B 105 -17.341 -2.845 -2.585 1.00 0.00 C ATOM 3420 CG2 ILE B 105 -16.570 -2.150 -0.312 1.00 0.00 C ATOM 3421 CD1 ILE B 105 -18.731 -3.042 -1.978 1.00 0.00 C ATOM 0 H ILE B 105 -14.267 -4.512 -3.036 1.00 0.00 H new ATOM 0 HA ILE B 105 -14.891 -1.666 -2.388 1.00 0.00 H new ATOM 0 HB ILE B 105 -16.288 -4.098 -1.186 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -17.255 -1.842 -3.004 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -17.188 -3.547 -3.405 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -17.550 -2.394 0.097 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.809 -2.300 0.454 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -16.560 -1.109 -0.634 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -19.489 -2.891 -2.747 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -18.814 -4.054 -1.581 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -18.882 -2.322 -1.173 1.00 0.00 H new ATOM 3433 N VAL B 106 -13.775 -2.104 -0.020 1.00 0.00 N ATOM 3434 CA VAL B 106 -12.753 -2.279 1.043 1.00 0.00 C ATOM 3435 C VAL B 106 -13.431 -2.720 2.344 1.00 0.00 C ATOM 3436 O VAL B 106 -14.474 -2.219 2.716 1.00 0.00 O ATOM 3437 CB VAL B 106 -12.034 -0.948 1.260 1.00 0.00 C ATOM 3438 CG1 VAL B 106 -11.259 -0.995 2.572 1.00 0.00 C ATOM 3439 CG2 VAL B 106 -11.064 -0.702 0.103 1.00 0.00 C ATOM 0 H VAL B 106 -14.392 -1.301 0.098 1.00 0.00 H new ATOM 0 HA VAL B 106 -12.034 -3.042 0.743 1.00 0.00 H new ATOM 0 HB VAL B 106 -12.766 -0.141 1.301 1.00 0.00 H new ATOM 0 HG11 VAL B 106 -10.746 -0.045 2.726 1.00 0.00 H new ATOM 0 HG12 VAL B 106 -11.950 -1.173 3.396 1.00 0.00 H new ATOM 0 HG13 VAL B 106 -10.526 -1.801 2.533 1.00 0.00 H new ATOM 0 HG21 VAL B 106 -10.550 0.247 0.255 1.00 0.00 H new ATOM 0 HG22 VAL B 106 -10.333 -1.509 0.064 1.00 0.00 H new ATOM 0 HG23 VAL B 106 -11.618 -0.668 -0.835 1.00 0.00 H new ATOM 3449 N ARG B 107 -12.838 -3.652 3.042 1.00 0.00 N ATOM 3450 CA ARG B 107 -13.436 -4.123 4.323 1.00 0.00 C ATOM 3451 C ARG B 107 -12.378 -4.070 5.428 1.00 0.00 C ATOM 3452 O ARG B 107 -12.646 -4.377 6.573 1.00 0.00 O ATOM 3453 CB ARG B 107 -13.929 -5.562 4.156 1.00 0.00 C ATOM 3454 CG ARG B 107 -14.764 -5.961 5.375 1.00 0.00 C ATOM 3455 CD ARG B 107 -15.332 -7.366 5.169 1.00 0.00 C ATOM 3456 NE ARG B 107 -16.662 -7.469 5.833 1.00 0.00 N ATOM 3457 CZ ARG B 107 -17.109 -8.631 6.227 1.00 0.00 C ATOM 3458 NH1 ARG B 107 -17.794 -9.380 5.408 1.00 0.00 N ATOM 3459 NH2 ARG B 107 -16.870 -9.043 7.443 1.00 0.00 N ATOM 0 H ARG B 107 -11.964 -4.107 2.779 1.00 0.00 H new ATOM 0 HA ARG B 107 -14.275 -3.481 4.592 1.00 0.00 H new ATOM 0 HB2 ARG B 107 -14.526 -5.650 3.248 1.00 0.00 H new ATOM 0 HB3 ARG B 107 -13.081 -6.238 4.046 1.00 0.00 H new ATOM 0 HG2 ARG B 107 -14.149 -5.935 6.274 1.00 0.00 H new ATOM 0 HG3 ARG B 107 -15.575 -5.248 5.522 1.00 0.00 H new ATOM 0 HD2 ARG B 107 -15.428 -7.578 4.104 1.00 0.00 H new ATOM 0 HD3 ARG B 107 -14.650 -8.109 5.581 1.00 0.00 H new ATOM 0 HE ARG B 107 -17.224 -6.631 5.980 1.00 0.00 H new ATOM 0 HH11 ARG B 107 -17.981 -9.058 4.458 1.00 0.00 H new ATOM 0 HH12 ARG B 107 -18.142 -10.287 5.717 1.00 0.00 H new ATOM 0 HH21 ARG B 107 -16.335 -8.457 8.084 1.00 0.00 H new ATOM 0 HH22 ARG B 107 -17.219 -9.950 7.752 1.00 0.00 H new ATOM 3473 N SER B 108 -11.177 -3.679 5.095 1.00 0.00 N ATOM 3474 CA SER B 108 -10.100 -3.602 6.122 1.00 0.00 C ATOM 3475 C SER B 108 -8.800 -3.151 5.452 1.00 0.00 C ATOM 3476 O SER B 108 -8.382 -3.705 4.457 1.00 0.00 O ATOM 3477 CB SER B 108 -9.896 -4.978 6.756 1.00 0.00 C ATOM 3478 OG SER B 108 -10.826 -5.149 7.817 1.00 0.00 O ATOM 0 H SER B 108 -10.895 -3.409 4.153 1.00 0.00 H new ATOM 0 HA SER B 108 -10.383 -2.888 6.896 1.00 0.00 H new ATOM 0 HB2 SER B 108 -10.032 -5.759 6.008 1.00 0.00 H new ATOM 0 HB3 SER B 108 -8.877 -5.070 7.132 1.00 0.00 H new ATOM 0 HG SER B 108 -11.618 -4.597 7.650 1.00 0.00 H new ATOM 3484 N CYS B 109 -8.168 -2.142 5.984 1.00 0.00 N ATOM 3485 CA CYS B 109 -6.901 -1.645 5.366 1.00 0.00 C ATOM 3486 C CYS B 109 -5.683 -2.293 6.040 1.00 0.00 C ATOM 3487 O CYS B 109 -5.805 -3.228 6.806 1.00 0.00 O ATOM 3488 CB CYS B 109 -6.818 -0.127 5.529 1.00 0.00 C ATOM 3489 SG CYS B 109 -8.180 0.653 4.630 1.00 0.00 S ATOM 0 H CYS B 109 -8.471 -1.639 6.818 1.00 0.00 H new ATOM 0 HA CYS B 109 -6.901 -1.908 4.308 1.00 0.00 H new ATOM 0 HB2 CYS B 109 -6.866 0.139 6.585 1.00 0.00 H new ATOM 0 HB3 CYS B 109 -5.863 0.238 5.151 1.00 0.00 H new ATOM 3494 N LYS B 110 -4.505 -1.792 5.754 1.00 0.00 N ATOM 3495 CA LYS B 110 -3.268 -2.359 6.362 1.00 0.00 C ATOM 3496 C LYS B 110 -2.104 -1.422 6.033 1.00 0.00 C ATOM 3497 O LYS B 110 -2.311 -0.288 5.666 1.00 0.00 O ATOM 3498 CB LYS B 110 -2.997 -3.747 5.781 1.00 0.00 C ATOM 3499 CG LYS B 110 -3.306 -4.809 6.838 1.00 0.00 C ATOM 3500 CD LYS B 110 -2.616 -6.121 6.466 1.00 0.00 C ATOM 3501 CE LYS B 110 -3.280 -7.276 7.217 1.00 0.00 C ATOM 3502 NZ LYS B 110 -3.204 -7.025 8.684 1.00 0.00 N ATOM 0 H LYS B 110 -4.350 -1.008 5.120 1.00 0.00 H new ATOM 0 HA LYS B 110 -3.384 -2.451 7.442 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -3.612 -3.909 4.896 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -1.957 -3.824 5.465 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -2.965 -4.472 7.817 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -4.383 -4.961 6.911 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -2.681 -6.287 5.391 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -1.556 -6.071 6.717 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -4.321 -7.374 6.908 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -2.785 -8.215 6.972 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -3.400 -7.908 9.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -2.252 -6.686 8.929 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -3.907 -6.306 8.950 1.00 0.00 H new ATOM 3516 N CYS B 111 -0.885 -1.871 6.154 1.00 0.00 N ATOM 3517 CA CYS B 111 0.257 -0.965 5.836 1.00 0.00 C ATOM 3518 C CYS B 111 1.352 -1.732 5.093 1.00 0.00 C ATOM 3519 O CYS B 111 2.272 -2.254 5.692 1.00 0.00 O ATOM 3520 CB CYS B 111 0.828 -0.384 7.133 1.00 0.00 C ATOM 3521 SG CYS B 111 -0.082 1.121 7.568 1.00 0.00 S ATOM 0 H CYS B 111 -0.631 -2.812 6.455 1.00 0.00 H new ATOM 0 HA CYS B 111 -0.102 -0.156 5.199 1.00 0.00 H new ATOM 0 HB2 CYS B 111 0.750 -1.115 7.938 1.00 0.00 H new ATOM 0 HB3 CYS B 111 1.887 -0.159 7.009 1.00 0.00 H new ATOM 3526 N SER B 112 1.271 -1.798 3.789 1.00 0.00 N ATOM 3527 CA SER B 112 2.319 -2.521 3.019 1.00 0.00 C ATOM 3528 C SER B 112 3.475 -1.564 2.721 1.00 0.00 C ATOM 3529 O SER B 112 4.612 -1.959 2.915 1.00 0.00 O ATOM 3530 CB SER B 112 1.731 -3.031 1.703 1.00 0.00 C ATOM 3531 OG SER B 112 2.701 -3.823 1.030 1.00 0.00 O ATOM 3532 OXT SER B 112 3.202 -0.449 2.305 1.00 0.00 O ATOM 0 H SER B 112 0.526 -1.383 3.229 1.00 0.00 H new ATOM 0 HA SER B 112 2.681 -3.366 3.604 1.00 0.00 H new ATOM 0 HB2 SER B 112 0.834 -3.620 1.896 1.00 0.00 H new ATOM 0 HB3 SER B 112 1.432 -2.191 1.076 1.00 0.00 H new ATOM 0 HG SER B 112 2.299 -4.677 0.765 1.00 0.00 H new TER 3538 SER B 112