USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1139 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 149 SER OG : rot 170:sc= -0.546 USER MOD Set 1.2: A 155 THR OG1 : rot -45:sc= -0.882 USER MOD Set 2.1: A 25 GLN : amide:sc= -10.2! C(o=-11!,f=-17!) USER MOD Set 2.2: A 153 ASN :FLIP amide:sc= -1.23 F(o=-14!,f=-11) USER MOD Set 3.1: A 124 HIS :FLIP no HD1:sc= -3.03 F(o=-5.9!,f=-3) USER MOD Set 3.2: A 125 MET CE :methyl -172:sc= -0.0121 (180deg=0) USER MOD Set 4.1: A 86 SER OG : rot -174:sc= -0.437 USER MOD Set 4.2: A 92 SER OG : rot -48:sc= 1.27 USER MOD Set 5.1: A 6 SER OG : rot -33:sc= -0.277! USER MOD Set 5.2: A 55 HIS : no HD1:sc= -3.14! C(o=-3.4!,f=-17!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 145:sc= -2.56 (180deg=-4.46!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0154 USER MOD Single : A 21 SER OG : rot 180:sc= -0.0687 USER MOD Single : A 23 THR OG1 : rot 73:sc= 0.711 USER MOD Single : A 30 GLN : amide:sc= -7.67! C(o=-7.7!,f=-9.2!) USER MOD Single : A 41 ASN : amide:sc= -0.305 X(o=-0.31,f=-0.54) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.112 USER MOD Single : A 44 THR OG1 : rot 180:sc=-0.00632 USER MOD Single : A 45 LYS NZ :NH3+ -179:sc= -1.63! (180deg=-1.67!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN :FLIP amide:sc= 1.16 F(o=-0.26,f=1.2) USER MOD Single : A 52 GLN : amide:sc= -0.435 K(o=-0.43,f=-2.9!) USER MOD Single : A 54 TYR OH : rot -151:sc= -0.855! USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 1.03 K(o=1,f=-0.11) USER MOD Single : A 81 TYR OH : rot 150:sc= 0 USER MOD Single : A 85 TYR OH : rot 81:sc= 1.44 USER MOD Single : A 88 THR OG1 : rot 115:sc= -0.219 USER MOD Single : A 89 SER OG : rot 180:sc= -0.056 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.274) USER MOD Single : A 100 HIS : no HD1:sc= -4.7! C(o=-4.7!,f=-6.5!) USER MOD Single : A 102 LYS NZ :NH3+ 148:sc= -0.176 (180deg=-1.33!) USER MOD Single : A 111 GLN : amide:sc= -0.611 K(o=-0.61,f=-3.1) USER MOD Single : A 115 MET CE :methyl 177:sc= -1.79 (180deg=-1.82) USER MOD Single : A 119 ASN : amide:sc= -3.47! C(o=-3.5!,f=-7.2!) USER MOD Single : A 120 LYS NZ :NH3+ -127:sc= -2.36! (180deg=-10.2!) USER MOD Single : A 121 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00311) USER MOD Single : A 130 SER OG : rot -51:sc= -4.44! USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot -80:sc= -0.0983 USER MOD Single : A 142 ASN : amide:sc= -0.449 X(o=-0.45,f=-0.14) USER MOD Single : A 148 SER OG : rot 150:sc= -0.067 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 GLN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 169 LYS NZ :NH3+ -160:sc= -0.178 (180deg=-0.963) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 6 -13.849 -4.640 -5.907 1.00 0.00 N ATOM 2 CA SER A 6 -12.745 -4.345 -6.801 1.00 0.00 C ATOM 3 C SER A 6 -12.110 -3.009 -6.430 1.00 0.00 C ATOM 4 O SER A 6 -12.724 -1.951 -6.567 1.00 0.00 O ATOM 5 CB SER A 6 -13.245 -4.277 -8.233 1.00 0.00 C ATOM 6 OG SER A 6 -12.461 -5.135 -9.051 1.00 0.00 O ATOM 0 HA SER A 6 -12.001 -5.137 -6.709 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.293 -4.573 -8.278 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.187 -3.253 -8.601 1.00 0.00 H new ATOM 0 HG SER A 6 -11.540 -5.155 -8.716 1.00 0.00 H new ATOM 12 N ARG A 7 -10.880 -3.077 -5.953 1.00 0.00 N ATOM 13 CA ARG A 7 -10.137 -1.887 -5.546 1.00 0.00 C ATOM 14 C ARG A 7 -8.690 -2.012 -6.000 1.00 0.00 C ATOM 15 O ARG A 7 -8.085 -3.068 -5.847 1.00 0.00 O ATOM 16 CB ARG A 7 -10.188 -1.722 -4.023 1.00 0.00 C ATOM 17 CG ARG A 7 -11.229 -2.678 -3.434 1.00 0.00 C ATOM 18 CD ARG A 7 -11.320 -2.465 -1.923 1.00 0.00 C ATOM 19 NE ARG A 7 -12.670 -2.052 -1.554 1.00 0.00 N ATOM 20 CZ ARG A 7 -13.041 -1.962 -0.282 1.00 0.00 C ATOM 21 NH1 ARG A 7 -12.191 -2.244 0.668 1.00 0.00 N ATOM 22 NH2 ARG A 7 -14.255 -1.592 0.018 1.00 0.00 N ATOM 0 H ARG A 7 -10.366 -3.950 -5.835 1.00 0.00 H new ATOM 0 HA ARG A 7 -10.591 -1.011 -6.009 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -9.208 -1.927 -3.593 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -10.440 -0.693 -3.767 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -12.201 -2.504 -3.896 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -10.954 -3.710 -3.651 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -11.058 -3.386 -1.402 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -10.602 -1.707 -1.611 1.00 0.00 H new ATOM 0 HE ARG A 7 -13.342 -1.828 -2.288 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -11.242 -2.534 0.433 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -12.476 -2.175 1.645 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -14.919 -1.372 -0.724 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -14.540 -1.523 0.995 1.00 0.00 H new ATOM 36 N LYS A 8 -8.120 -0.946 -6.552 1.00 0.00 N ATOM 37 CA LYS A 8 -6.750 -1.011 -6.993 1.00 0.00 C ATOM 38 C LYS A 8 -5.901 -0.235 -6.018 1.00 0.00 C ATOM 39 O LYS A 8 -6.256 0.864 -5.633 1.00 0.00 O ATOM 40 CB LYS A 8 -6.623 -0.427 -8.399 1.00 0.00 C ATOM 41 CG LYS A 8 -7.586 -1.145 -9.348 1.00 0.00 C ATOM 42 CD LYS A 8 -8.693 -0.180 -9.778 1.00 0.00 C ATOM 43 CE LYS A 8 -9.659 -0.897 -10.724 1.00 0.00 C ATOM 44 NZ LYS A 8 -10.259 0.091 -11.664 1.00 0.00 N ATOM 0 H LYS A 8 -8.582 -0.048 -6.699 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.415 -2.048 -7.029 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.844 0.640 -8.381 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.599 -0.534 -8.756 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.047 -1.510 -10.222 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.019 -2.015 -8.854 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.230 0.187 -8.903 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.260 0.689 -10.274 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.132 -1.671 -11.281 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -10.443 -1.394 -10.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -10.916 -0.396 -12.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -10.776 0.814 -11.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.505 0.545 -12.218 1.00 0.00 H new ATOM 58 N ILE A 9 -4.804 -0.820 -5.585 1.00 0.00 N ATOM 59 CA ILE A 9 -3.955 -0.164 -4.630 1.00 0.00 C ATOM 60 C ILE A 9 -2.694 0.380 -5.324 1.00 0.00 C ATOM 61 O ILE A 9 -1.985 -0.338 -5.997 1.00 0.00 O ATOM 62 CB ILE A 9 -3.620 -1.144 -3.488 1.00 0.00 C ATOM 63 CG1 ILE A 9 -4.733 -2.231 -3.309 1.00 0.00 C ATOM 64 CG2 ILE A 9 -3.479 -0.358 -2.205 1.00 0.00 C ATOM 65 CD1 ILE A 9 -6.052 -1.656 -2.790 1.00 0.00 C ATOM 0 H ILE A 9 -4.486 -1.743 -5.881 1.00 0.00 H new ATOM 0 HA ILE A 9 -4.471 0.692 -4.195 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.691 -1.658 -3.736 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.909 -2.724 -4.265 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.379 -2.995 -2.617 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -3.242 -1.037 -1.386 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.678 0.374 -2.313 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.415 0.157 -1.989 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.783 -2.458 -2.687 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.888 -1.188 -1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.426 -0.912 -3.493 1.00 0.00 H new ATOM 77 N ALA A 10 -2.426 1.669 -5.185 1.00 0.00 N ATOM 78 CA ALA A 10 -1.265 2.260 -5.859 1.00 0.00 C ATOM 79 C ALA A 10 -0.002 2.055 -5.043 1.00 0.00 C ATOM 80 O ALA A 10 0.011 2.290 -3.844 1.00 0.00 O ATOM 81 CB ALA A 10 -1.460 3.751 -6.009 1.00 0.00 C ATOM 0 H ALA A 10 -2.978 2.319 -4.626 1.00 0.00 H new ATOM 0 HA ALA A 10 -1.169 1.775 -6.830 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.594 4.183 -6.510 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.355 3.943 -6.601 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.572 4.204 -5.024 1.00 0.00 H new ATOM 87 N ILE A 11 1.058 1.626 -5.712 1.00 0.00 N ATOM 88 CA ILE A 11 2.331 1.367 -5.042 1.00 0.00 C ATOM 89 C ILE A 11 3.275 2.546 -5.126 1.00 0.00 C ATOM 90 O ILE A 11 3.469 3.144 -6.184 1.00 0.00 O ATOM 91 CB ILE A 11 3.020 0.142 -5.646 1.00 0.00 C ATOM 92 CG1 ILE A 11 2.002 -0.988 -5.857 1.00 0.00 C ATOM 93 CG2 ILE A 11 4.117 -0.334 -4.691 1.00 0.00 C ATOM 94 CD1 ILE A 11 2.678 -2.158 -6.573 1.00 0.00 C ATOM 0 H ILE A 11 1.066 1.449 -6.717 1.00 0.00 H new ATOM 0 HA ILE A 11 2.096 1.187 -3.993 1.00 0.00 H new ATOM 0 HB ILE A 11 3.453 0.411 -6.609 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.604 -1.317 -4.897 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.158 -0.627 -6.445 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.614 -1.207 -5.114 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.846 0.464 -4.547 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.674 -0.598 -3.731 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.955 -2.960 -6.722 1.00 0.00 H new ATOM 0 HD12 ILE A 11 3.055 -1.824 -7.540 1.00 0.00 H new ATOM 0 HD13 ILE A 11 3.507 -2.525 -5.968 1.00 0.00 H new ATOM 106 N LEU A 12 3.862 2.863 -3.980 1.00 0.00 N ATOM 107 CA LEU A 12 4.800 3.967 -3.889 1.00 0.00 C ATOM 108 C LEU A 12 6.029 3.539 -3.094 1.00 0.00 C ATOM 109 O LEU A 12 5.974 3.410 -1.873 1.00 0.00 O ATOM 110 CB LEU A 12 4.109 5.144 -3.202 1.00 0.00 C ATOM 111 CG LEU A 12 4.163 6.407 -4.071 1.00 0.00 C ATOM 112 CD1 LEU A 12 5.619 6.818 -4.305 1.00 0.00 C ATOM 113 CD2 LEU A 12 3.467 6.145 -5.415 1.00 0.00 C ATOM 0 H LEU A 12 3.703 2.369 -3.102 1.00 0.00 H new ATOM 0 HA LEU A 12 5.121 4.265 -4.887 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.070 4.887 -2.994 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.587 5.340 -2.242 1.00 0.00 H new ATOM 0 HG LEU A 12 3.646 7.217 -3.556 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.649 7.715 -4.923 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.098 7.021 -3.347 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.148 6.011 -4.812 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.508 7.045 -6.028 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.972 5.330 -5.933 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.426 5.874 -5.239 1.00 0.00 H new ATOM 125 N GLY A 13 7.133 3.302 -3.797 1.00 0.00 N ATOM 126 CA GLY A 13 8.361 2.862 -3.151 1.00 0.00 C ATOM 127 C GLY A 13 9.590 3.511 -3.770 1.00 0.00 C ATOM 128 O GLY A 13 9.712 3.600 -4.991 1.00 0.00 O ATOM 0 H GLY A 13 7.200 3.407 -4.809 1.00 0.00 H new ATOM 0 HA2 GLY A 13 8.319 3.103 -2.089 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.444 1.778 -3.229 1.00 0.00 H new ATOM 132 N TYR A 14 10.498 3.958 -2.912 1.00 0.00 N ATOM 133 CA TYR A 14 11.729 4.590 -3.367 1.00 0.00 C ATOM 134 C TYR A 14 12.473 3.695 -4.344 1.00 0.00 C ATOM 135 O TYR A 14 11.897 2.813 -4.984 1.00 0.00 O ATOM 136 CB TYR A 14 12.628 4.886 -2.162 1.00 0.00 C ATOM 137 CG TYR A 14 13.280 6.234 -2.341 1.00 0.00 C ATOM 138 CD1 TYR A 14 12.488 7.385 -2.385 1.00 0.00 C ATOM 139 CD2 TYR A 14 14.672 6.334 -2.468 1.00 0.00 C ATOM 140 CE1 TYR A 14 13.088 8.640 -2.558 1.00 0.00 C ATOM 141 CE2 TYR A 14 15.270 7.587 -2.639 1.00 0.00 C ATOM 142 CZ TYR A 14 14.479 8.740 -2.684 1.00 0.00 C ATOM 143 OH TYR A 14 15.069 9.976 -2.853 1.00 0.00 O ATOM 0 H TYR A 14 10.405 3.895 -1.898 1.00 0.00 H new ATOM 0 HA TYR A 14 11.470 5.518 -3.877 1.00 0.00 H new ATOM 0 HB2 TYR A 14 12.040 4.873 -1.244 1.00 0.00 H new ATOM 0 HB3 TYR A 14 13.389 4.112 -2.064 1.00 0.00 H new ATOM 0 HD1 TYR A 14 11.415 7.307 -2.286 1.00 0.00 H new ATOM 0 HD2 TYR A 14 15.283 5.444 -2.434 1.00 0.00 H new ATOM 0 HE1 TYR A 14 12.477 9.530 -2.594 1.00 0.00 H new ATOM 0 HE2 TYR A 14 16.343 7.664 -2.736 1.00 0.00 H new ATOM 0 HH TYR A 14 16.041 9.868 -2.923 1.00 0.00 H new ATOM 153 N ARG A 15 13.759 3.952 -4.457 1.00 0.00 N ATOM 154 CA ARG A 15 14.611 3.189 -5.357 1.00 0.00 C ATOM 155 C ARG A 15 15.323 2.063 -4.609 1.00 0.00 C ATOM 156 O ARG A 15 15.902 2.277 -3.544 1.00 0.00 O ATOM 157 CB ARG A 15 15.647 4.115 -5.989 1.00 0.00 C ATOM 158 CG ARG A 15 16.077 3.556 -7.347 1.00 0.00 C ATOM 159 CD ARG A 15 17.517 3.982 -7.640 1.00 0.00 C ATOM 160 NE ARG A 15 18.419 3.439 -6.632 1.00 0.00 N ATOM 161 CZ ARG A 15 19.730 3.381 -6.843 1.00 0.00 C ATOM 162 NH1 ARG A 15 20.227 3.812 -7.971 1.00 0.00 N ATOM 163 NH2 ARG A 15 20.518 2.894 -5.925 1.00 0.00 N ATOM 0 H ARG A 15 14.242 4.685 -3.937 1.00 0.00 H new ATOM 0 HA ARG A 15 13.985 2.748 -6.133 1.00 0.00 H new ATOM 0 HB2 ARG A 15 15.229 5.114 -6.112 1.00 0.00 H new ATOM 0 HB3 ARG A 15 16.512 4.210 -5.333 1.00 0.00 H new ATOM 0 HG2 ARG A 15 16.001 2.469 -7.345 1.00 0.00 H new ATOM 0 HG3 ARG A 15 15.412 3.921 -8.130 1.00 0.00 H new ATOM 0 HD2 ARG A 15 17.813 3.632 -8.629 1.00 0.00 H new ATOM 0 HD3 ARG A 15 17.587 5.070 -7.652 1.00 0.00 H new ATOM 0 HE ARG A 15 18.038 3.098 -5.750 1.00 0.00 H new ATOM 0 HH11 ARG A 15 19.609 4.192 -8.688 1.00 0.00 H new ATOM 0 HH12 ARG A 15 21.233 3.768 -8.135 1.00 0.00 H new ATOM 0 HH21 ARG A 15 20.128 2.557 -5.045 1.00 0.00 H new ATOM 0 HH22 ARG A 15 21.524 2.850 -6.088 1.00 0.00 H new ATOM 177 N SER A 16 15.289 0.866 -5.189 1.00 0.00 N ATOM 178 CA SER A 16 15.942 -0.291 -4.599 1.00 0.00 C ATOM 179 C SER A 16 15.407 -0.605 -3.203 1.00 0.00 C ATOM 180 O SER A 16 16.054 -1.310 -2.427 1.00 0.00 O ATOM 181 CB SER A 16 17.435 -0.035 -4.529 1.00 0.00 C ATOM 182 OG SER A 16 17.882 0.495 -5.771 1.00 0.00 O ATOM 0 H SER A 16 14.813 0.675 -6.071 1.00 0.00 H new ATOM 0 HA SER A 16 15.731 -1.155 -5.230 1.00 0.00 H new ATOM 0 HB2 SER A 16 17.658 0.663 -3.722 1.00 0.00 H new ATOM 0 HB3 SER A 16 17.964 -0.961 -4.305 1.00 0.00 H new ATOM 0 HG SER A 16 18.847 0.663 -5.727 1.00 0.00 H new ATOM 188 N VAL A 17 14.224 -0.091 -2.884 1.00 0.00 N ATOM 189 CA VAL A 17 13.631 -0.345 -1.573 1.00 0.00 C ATOM 190 C VAL A 17 12.963 -1.716 -1.537 1.00 0.00 C ATOM 191 O VAL A 17 12.584 -2.201 -0.471 1.00 0.00 O ATOM 192 CB VAL A 17 12.603 0.731 -1.233 1.00 0.00 C ATOM 193 CG1 VAL A 17 11.655 0.917 -2.413 1.00 0.00 C ATOM 194 CG2 VAL A 17 11.810 0.292 -0.004 1.00 0.00 C ATOM 0 H VAL A 17 13.663 0.495 -3.503 1.00 0.00 H new ATOM 0 HA VAL A 17 14.432 -0.322 -0.834 1.00 0.00 H new ATOM 0 HB VAL A 17 13.109 1.674 -1.025 1.00 0.00 H new ATOM 0 HG11 VAL A 17 10.920 1.685 -2.172 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.223 1.222 -3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 17 11.143 -0.023 -2.620 1.00 0.00 H new ATOM 0 HG21 VAL A 17 11.073 1.056 0.245 1.00 0.00 H new ATOM 0 HG22 VAL A 17 11.301 -0.648 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.489 0.155 0.837 1.00 0.00 H new ATOM 204 N GLY A 18 12.826 -2.339 -2.703 1.00 0.00 N ATOM 205 CA GLY A 18 12.204 -3.656 -2.779 1.00 0.00 C ATOM 206 C GLY A 18 10.757 -3.545 -3.236 1.00 0.00 C ATOM 207 O GLY A 18 10.015 -4.528 -3.238 1.00 0.00 O ATOM 0 H GLY A 18 13.133 -1.959 -3.598 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.761 -4.287 -3.471 1.00 0.00 H new ATOM 0 HA3 GLY A 18 12.246 -4.140 -1.803 1.00 0.00 H new ATOM 211 N LYS A 19 10.368 -2.339 -3.630 1.00 0.00 N ATOM 212 CA LYS A 19 9.013 -2.092 -4.101 1.00 0.00 C ATOM 213 C LYS A 19 8.533 -3.252 -4.969 1.00 0.00 C ATOM 214 O LYS A 19 7.521 -3.890 -4.676 1.00 0.00 O ATOM 215 CB LYS A 19 8.997 -0.799 -4.920 1.00 0.00 C ATOM 216 CG LYS A 19 7.556 -0.404 -5.264 1.00 0.00 C ATOM 217 CD LYS A 19 7.516 0.272 -6.641 1.00 0.00 C ATOM 218 CE LYS A 19 8.288 1.595 -6.592 1.00 0.00 C ATOM 219 NZ LYS A 19 9.760 1.336 -6.640 1.00 0.00 N ATOM 0 H LYS A 19 10.972 -1.517 -3.632 1.00 0.00 H new ATOM 0 HA LYS A 19 8.347 -1.999 -3.243 1.00 0.00 H new ATOM 0 HB2 LYS A 19 9.476 0.002 -4.357 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.573 -0.934 -5.836 1.00 0.00 H new ATOM 0 HG2 LYS A 19 6.917 -1.287 -5.264 1.00 0.00 H new ATOM 0 HG3 LYS A 19 7.164 0.273 -4.505 1.00 0.00 H new ATOM 0 HD2 LYS A 19 7.952 -0.386 -7.392 1.00 0.00 H new ATOM 0 HD3 LYS A 19 6.483 0.454 -6.937 1.00 0.00 H new ATOM 0 HE2 LYS A 19 7.995 2.227 -7.431 1.00 0.00 H new ATOM 0 HE3 LYS A 19 8.036 2.138 -5.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 10.229 2.094 -7.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 10.140 1.310 -5.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.937 0.423 -7.106 1.00 0.00 H new ATOM 233 N SER A 20 9.262 -3.504 -6.048 1.00 0.00 N ATOM 234 CA SER A 20 8.908 -4.570 -6.974 1.00 0.00 C ATOM 235 C SER A 20 9.078 -5.948 -6.332 1.00 0.00 C ATOM 236 O SER A 20 8.407 -6.903 -6.718 1.00 0.00 O ATOM 237 CB SER A 20 9.783 -4.468 -8.224 1.00 0.00 C ATOM 238 OG SER A 20 10.019 -3.095 -8.520 1.00 0.00 O ATOM 0 H SER A 20 10.102 -2.985 -6.303 1.00 0.00 H new ATOM 0 HA SER A 20 7.858 -4.455 -7.244 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.729 -4.986 -8.064 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.292 -4.955 -9.067 1.00 0.00 H new ATOM 0 HG SER A 20 10.581 -3.025 -9.320 1.00 0.00 H new ATOM 244 N SER A 21 9.974 -6.055 -5.357 1.00 0.00 N ATOM 245 CA SER A 21 10.203 -7.333 -4.697 1.00 0.00 C ATOM 246 C SER A 21 8.958 -7.791 -3.945 1.00 0.00 C ATOM 247 O SER A 21 8.515 -8.933 -4.100 1.00 0.00 O ATOM 248 CB SER A 21 11.378 -7.216 -3.727 1.00 0.00 C ATOM 249 OG SER A 21 12.462 -6.575 -4.384 1.00 0.00 O ATOM 0 H SER A 21 10.545 -5.284 -5.011 1.00 0.00 H new ATOM 0 HA SER A 21 10.435 -8.074 -5.462 1.00 0.00 H new ATOM 0 HB2 SER A 21 11.083 -6.646 -2.846 1.00 0.00 H new ATOM 0 HB3 SER A 21 11.680 -8.205 -3.381 1.00 0.00 H new ATOM 0 HG SER A 21 13.218 -6.496 -3.766 1.00 0.00 H new ATOM 255 N LEU A 22 8.396 -6.911 -3.123 1.00 0.00 N ATOM 256 CA LEU A 22 7.215 -7.281 -2.361 1.00 0.00 C ATOM 257 C LEU A 22 5.969 -7.293 -3.237 1.00 0.00 C ATOM 258 O LEU A 22 5.030 -8.024 -2.948 1.00 0.00 O ATOM 259 CB LEU A 22 7.016 -6.353 -1.153 1.00 0.00 C ATOM 260 CG LEU A 22 5.725 -6.718 -0.398 1.00 0.00 C ATOM 261 CD1 LEU A 22 5.749 -8.194 0.027 1.00 0.00 C ATOM 262 CD2 LEU A 22 5.613 -5.840 0.850 1.00 0.00 C ATOM 0 H LEU A 22 8.731 -5.960 -2.971 1.00 0.00 H new ATOM 0 HA LEU A 22 7.376 -8.293 -1.989 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.871 -6.432 -0.482 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.968 -5.317 -1.487 1.00 0.00 H new ATOM 0 HG LEU A 22 4.871 -6.554 -1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.829 -8.434 0.559 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.832 -8.826 -0.857 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.603 -8.371 0.681 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.701 -6.092 1.391 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.476 -6.011 1.494 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.582 -4.791 0.555 1.00 0.00 H new ATOM 274 N THR A 23 5.950 -6.512 -4.316 1.00 0.00 N ATOM 275 CA THR A 23 4.792 -6.523 -5.182 1.00 0.00 C ATOM 276 C THR A 23 4.587 -7.941 -5.673 1.00 0.00 C ATOM 277 O THR A 23 3.495 -8.490 -5.568 1.00 0.00 O ATOM 278 CB THR A 23 4.996 -5.582 -6.372 1.00 0.00 C ATOM 279 OG1 THR A 23 5.075 -4.243 -5.907 1.00 0.00 O ATOM 280 CG2 THR A 23 3.822 -5.724 -7.338 1.00 0.00 C ATOM 0 H THR A 23 6.703 -5.884 -4.599 1.00 0.00 H new ATOM 0 HA THR A 23 3.917 -6.179 -4.631 1.00 0.00 H new ATOM 0 HB THR A 23 5.921 -5.839 -6.888 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.938 -4.101 -5.465 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.966 -5.055 -8.186 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.766 -6.753 -7.693 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.895 -5.466 -6.825 1.00 0.00 H new ATOM 288 N ILE A 24 5.663 -8.527 -6.196 1.00 0.00 N ATOM 289 CA ILE A 24 5.620 -9.893 -6.697 1.00 0.00 C ATOM 290 C ILE A 24 5.243 -10.859 -5.577 1.00 0.00 C ATOM 291 O ILE A 24 4.435 -11.757 -5.778 1.00 0.00 O ATOM 292 CB ILE A 24 6.983 -10.268 -7.295 1.00 0.00 C ATOM 293 CG1 ILE A 24 7.000 -9.918 -8.790 1.00 0.00 C ATOM 294 CG2 ILE A 24 7.235 -11.770 -7.130 1.00 0.00 C ATOM 295 CD1 ILE A 24 6.559 -8.462 -9.002 1.00 0.00 C ATOM 0 H ILE A 24 6.573 -8.075 -6.282 1.00 0.00 H new ATOM 0 HA ILE A 24 4.861 -9.962 -7.476 1.00 0.00 H new ATOM 0 HB ILE A 24 7.762 -9.712 -6.774 1.00 0.00 H new ATOM 0 HG12 ILE A 24 8.002 -10.064 -9.193 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.336 -10.589 -9.335 1.00 0.00 H new ATOM 0 HG21 ILE A 24 8.205 -12.025 -7.558 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.227 -12.026 -6.071 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.453 -12.329 -7.644 1.00 0.00 H new ATOM 0 HD11 ILE A 24 6.576 -8.228 -10.066 1.00 0.00 H new ATOM 0 HD12 ILE A 24 5.548 -8.328 -8.617 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.240 -7.795 -8.473 1.00 0.00 H new ATOM 307 N GLN A 25 5.825 -10.691 -4.397 1.00 0.00 N ATOM 308 CA GLN A 25 5.496 -11.593 -3.298 1.00 0.00 C ATOM 309 C GLN A 25 4.072 -11.365 -2.805 1.00 0.00 C ATOM 310 O GLN A 25 3.467 -12.258 -2.241 1.00 0.00 O ATOM 311 CB GLN A 25 6.455 -11.429 -2.125 1.00 0.00 C ATOM 312 CG GLN A 25 5.935 -12.276 -0.960 1.00 0.00 C ATOM 313 CD GLN A 25 7.079 -12.774 -0.094 1.00 0.00 C ATOM 314 OE1 GLN A 25 7.192 -13.976 0.149 1.00 0.00 O ATOM 315 NE2 GLN A 25 7.939 -11.931 0.394 1.00 0.00 N ATOM 0 H GLN A 25 6.506 -9.964 -4.178 1.00 0.00 H new ATOM 0 HA GLN A 25 5.588 -12.605 -3.691 1.00 0.00 H new ATOM 0 HB2 GLN A 25 7.459 -11.746 -2.407 1.00 0.00 H new ATOM 0 HB3 GLN A 25 6.522 -10.381 -1.833 1.00 0.00 H new ATOM 0 HG2 GLN A 25 5.247 -11.685 -0.355 1.00 0.00 H new ATOM 0 HG3 GLN A 25 5.371 -13.125 -1.347 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.847 -10.935 0.194 1.00 0.00 H new ATOM 0 HE22 GLN A 25 8.706 -12.265 0.977 1.00 0.00 H new ATOM 324 N PHE A 26 3.550 -10.168 -2.999 1.00 0.00 N ATOM 325 CA PHE A 26 2.197 -9.855 -2.546 1.00 0.00 C ATOM 326 C PHE A 26 1.160 -10.448 -3.489 1.00 0.00 C ATOM 327 O PHE A 26 0.215 -11.111 -3.063 1.00 0.00 O ATOM 328 CB PHE A 26 2.022 -8.342 -2.488 1.00 0.00 C ATOM 329 CG PHE A 26 0.786 -7.997 -1.692 1.00 0.00 C ATOM 330 CD1 PHE A 26 -0.465 -7.964 -2.319 1.00 0.00 C ATOM 331 CD2 PHE A 26 0.892 -7.708 -0.326 1.00 0.00 C ATOM 332 CE1 PHE A 26 -1.610 -7.641 -1.580 1.00 0.00 C ATOM 333 CE2 PHE A 26 -0.252 -7.384 0.412 1.00 0.00 C ATOM 334 CZ PHE A 26 -1.503 -7.351 -0.214 1.00 0.00 C ATOM 0 H PHE A 26 4.033 -9.399 -3.463 1.00 0.00 H new ATOM 0 HA PHE A 26 2.053 -10.287 -1.556 1.00 0.00 H new ATOM 0 HB2 PHE A 26 2.899 -7.883 -2.031 1.00 0.00 H new ATOM 0 HB3 PHE A 26 1.940 -7.938 -3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.547 -8.188 -3.372 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.857 -7.735 0.158 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -2.575 -7.616 -2.063 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -0.169 -7.159 1.465 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.386 -7.102 0.356 1.00 0.00 H new ATOM 344 N VAL A 27 1.348 -10.191 -4.773 1.00 0.00 N ATOM 345 CA VAL A 27 0.436 -10.681 -5.794 1.00 0.00 C ATOM 346 C VAL A 27 0.528 -12.201 -5.932 1.00 0.00 C ATOM 347 O VAL A 27 -0.491 -12.887 -5.990 1.00 0.00 O ATOM 348 CB VAL A 27 0.781 -10.018 -7.117 1.00 0.00 C ATOM 349 CG1 VAL A 27 2.201 -10.408 -7.510 1.00 0.00 C ATOM 350 CG2 VAL A 27 -0.195 -10.478 -8.187 1.00 0.00 C ATOM 0 H VAL A 27 2.128 -9.643 -5.135 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.586 -10.434 -5.505 1.00 0.00 H new ATOM 0 HB VAL A 27 0.713 -8.935 -7.018 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.458 -9.937 -8.459 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.896 -10.075 -6.739 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.265 -11.491 -7.613 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.054 -10.002 -9.135 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.131 -11.561 -8.297 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.209 -10.202 -7.897 1.00 0.00 H new ATOM 360 N GLU A 28 1.749 -12.727 -5.965 1.00 0.00 N ATOM 361 CA GLU A 28 1.939 -14.169 -6.074 1.00 0.00 C ATOM 362 C GLU A 28 1.783 -14.789 -4.706 1.00 0.00 C ATOM 363 O GLU A 28 1.454 -15.968 -4.571 1.00 0.00 O ATOM 364 CB GLU A 28 3.331 -14.507 -6.612 1.00 0.00 C ATOM 365 CG GLU A 28 3.204 -15.474 -7.790 1.00 0.00 C ATOM 366 CD GLU A 28 4.586 -15.939 -8.234 1.00 0.00 C ATOM 367 OE1 GLU A 28 5.050 -16.938 -7.709 1.00 0.00 O ATOM 368 OE2 GLU A 28 5.162 -15.290 -9.091 1.00 0.00 O ATOM 0 H GLU A 28 2.611 -12.184 -5.918 1.00 0.00 H new ATOM 0 HA GLU A 28 1.195 -14.562 -6.766 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.841 -13.597 -6.929 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.938 -14.954 -5.825 1.00 0.00 H new ATOM 0 HG2 GLU A 28 2.597 -16.333 -7.502 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.692 -14.985 -8.619 1.00 0.00 H new ATOM 375 N GLY A 29 2.032 -13.977 -3.690 1.00 0.00 N ATOM 376 CA GLY A 29 1.929 -14.443 -2.327 1.00 0.00 C ATOM 377 C GLY A 29 3.148 -15.270 -1.940 1.00 0.00 C ATOM 378 O GLY A 29 3.095 -16.052 -0.989 1.00 0.00 O ATOM 0 H GLY A 29 2.305 -12.999 -3.788 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.834 -13.591 -1.654 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.026 -15.043 -2.211 1.00 0.00 H new ATOM 382 N GLN A 30 4.242 -15.119 -2.687 1.00 0.00 N ATOM 383 CA GLN A 30 5.441 -15.895 -2.394 1.00 0.00 C ATOM 384 C GLN A 30 6.726 -15.141 -2.759 1.00 0.00 C ATOM 385 O GLN A 30 6.834 -14.549 -3.833 1.00 0.00 O ATOM 386 CB GLN A 30 5.356 -17.225 -3.156 1.00 0.00 C ATOM 387 CG GLN A 30 6.749 -17.784 -3.449 1.00 0.00 C ATOM 388 CD GLN A 30 7.577 -17.847 -2.169 1.00 0.00 C ATOM 389 OE1 GLN A 30 7.025 -17.830 -1.069 1.00 0.00 O ATOM 390 NE2 GLN A 30 8.876 -17.925 -2.247 1.00 0.00 N ATOM 0 H GLN A 30 4.321 -14.482 -3.480 1.00 0.00 H new ATOM 0 HA GLN A 30 5.487 -16.076 -1.320 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.787 -17.947 -2.570 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.816 -17.077 -4.091 1.00 0.00 H new ATOM 0 HG2 GLN A 30 6.664 -18.780 -3.884 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.252 -17.157 -4.185 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.332 -17.939 -3.159 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.436 -17.972 -1.396 1.00 0.00 H new ATOM 399 N PHE A 31 7.703 -15.201 -1.857 1.00 0.00 N ATOM 400 CA PHE A 31 8.999 -14.557 -2.060 1.00 0.00 C ATOM 401 C PHE A 31 9.809 -15.303 -3.119 1.00 0.00 C ATOM 402 O PHE A 31 10.517 -16.261 -2.806 1.00 0.00 O ATOM 403 CB PHE A 31 9.780 -14.550 -0.739 1.00 0.00 C ATOM 404 CG PHE A 31 11.261 -14.504 -1.022 1.00 0.00 C ATOM 405 CD1 PHE A 31 11.760 -13.583 -1.944 1.00 0.00 C ATOM 406 CD2 PHE A 31 12.134 -15.378 -0.360 1.00 0.00 C ATOM 407 CE1 PHE A 31 13.133 -13.531 -2.212 1.00 0.00 C ATOM 408 CE2 PHE A 31 13.508 -15.328 -0.626 1.00 0.00 C ATOM 409 CZ PHE A 31 14.008 -14.404 -1.553 1.00 0.00 C ATOM 0 H PHE A 31 7.620 -15.695 -0.969 1.00 0.00 H new ATOM 0 HA PHE A 31 8.831 -13.535 -2.399 1.00 0.00 H new ATOM 0 HB2 PHE A 31 9.488 -13.689 -0.138 1.00 0.00 H new ATOM 0 HB3 PHE A 31 9.539 -15.440 -0.158 1.00 0.00 H new ATOM 0 HD1 PHE A 31 11.086 -12.909 -2.452 1.00 0.00 H new ATOM 0 HD2 PHE A 31 11.747 -16.089 0.355 1.00 0.00 H new ATOM 0 HE1 PHE A 31 13.517 -12.818 -2.926 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.182 -16.001 -0.117 1.00 0.00 H new ATOM 0 HZ PHE A 31 15.067 -14.365 -1.759 1.00 0.00 H new ATOM 538 N GLU A 40 7.575 0.407 -15.082 1.00 0.00 N ATOM 539 CA GLU A 40 6.194 0.815 -14.875 1.00 0.00 C ATOM 540 C GLU A 40 5.283 -0.334 -15.258 1.00 0.00 C ATOM 541 O GLU A 40 5.375 -0.867 -16.364 1.00 0.00 O ATOM 542 CB GLU A 40 5.853 2.037 -15.724 1.00 0.00 C ATOM 543 CG GLU A 40 6.895 2.203 -16.832 1.00 0.00 C ATOM 544 CD GLU A 40 6.497 3.349 -17.755 1.00 0.00 C ATOM 545 OE1 GLU A 40 5.746 3.102 -18.684 1.00 0.00 O ATOM 546 OE2 GLU A 40 6.949 4.457 -17.520 1.00 0.00 O ATOM 0 HA GLU A 40 6.056 1.078 -13.826 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.860 1.924 -16.159 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.827 2.930 -15.099 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.874 2.400 -16.395 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.981 1.278 -17.403 1.00 0.00 H new ATOM 553 N ASN A 41 4.429 -0.745 -14.332 1.00 0.00 N ATOM 554 CA ASN A 41 3.548 -1.874 -14.604 1.00 0.00 C ATOM 555 C ASN A 41 2.364 -1.944 -13.654 1.00 0.00 C ATOM 556 O ASN A 41 2.197 -1.107 -12.768 1.00 0.00 O ATOM 557 CB ASN A 41 4.351 -3.157 -14.460 1.00 0.00 C ATOM 558 CG ASN A 41 4.756 -3.685 -15.833 1.00 0.00 C ATOM 559 OD1 ASN A 41 5.923 -3.597 -16.213 1.00 0.00 O ATOM 560 ND2 ASN A 41 3.855 -4.233 -16.602 1.00 0.00 N ATOM 0 H ASN A 41 4.327 -0.327 -13.407 1.00 0.00 H new ATOM 0 HA ASN A 41 3.155 -1.746 -15.612 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.240 -2.972 -13.857 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.760 -3.907 -13.934 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.117 -4.590 -17.521 1.00 0.00 H new ATOM 0 HD22 ASN A 41 2.888 -4.305 -16.284 1.00 0.00 H new ATOM 567 N THR A 42 1.551 -2.975 -13.861 1.00 0.00 N ATOM 568 CA THR A 42 0.379 -3.210 -13.052 1.00 0.00 C ATOM 569 C THR A 42 0.260 -4.699 -12.718 1.00 0.00 C ATOM 570 O THR A 42 0.607 -5.556 -13.530 1.00 0.00 O ATOM 571 CB THR A 42 -0.859 -2.743 -13.818 1.00 0.00 C ATOM 572 OG1 THR A 42 -0.570 -1.523 -14.486 1.00 0.00 O ATOM 573 CG2 THR A 42 -2.007 -2.534 -12.846 1.00 0.00 C ATOM 0 H THR A 42 1.694 -3.667 -14.597 1.00 0.00 H new ATOM 0 HA THR A 42 0.462 -2.652 -12.119 1.00 0.00 H new ATOM 0 HB THR A 42 -1.140 -3.499 -14.552 1.00 0.00 H new ATOM 0 HG1 THR A 42 -1.363 -1.224 -14.978 1.00 0.00 H new ATOM 0 HG21 THR A 42 -2.890 -2.201 -13.392 1.00 0.00 H new ATOM 0 HG22 THR A 42 -2.228 -3.472 -12.337 1.00 0.00 H new ATOM 0 HG23 THR A 42 -1.729 -1.779 -12.111 1.00 0.00 H new ATOM 581 N PHE A 43 -0.219 -4.995 -11.510 1.00 0.00 N ATOM 582 CA PHE A 43 -0.366 -6.377 -11.062 1.00 0.00 C ATOM 583 C PHE A 43 -1.779 -6.627 -10.563 1.00 0.00 C ATOM 584 O PHE A 43 -2.533 -5.688 -10.311 1.00 0.00 O ATOM 585 CB PHE A 43 0.649 -6.674 -9.948 1.00 0.00 C ATOM 586 CG PHE A 43 2.055 -6.542 -10.489 1.00 0.00 C ATOM 587 CD1 PHE A 43 2.554 -5.286 -10.868 1.00 0.00 C ATOM 588 CD2 PHE A 43 2.858 -7.681 -10.629 1.00 0.00 C ATOM 589 CE1 PHE A 43 3.850 -5.174 -11.383 1.00 0.00 C ATOM 590 CE2 PHE A 43 4.153 -7.566 -11.150 1.00 0.00 C ATOM 591 CZ PHE A 43 4.648 -6.313 -11.527 1.00 0.00 C ATOM 0 H PHE A 43 -0.511 -4.297 -10.826 1.00 0.00 H new ATOM 0 HA PHE A 43 -0.176 -7.041 -11.905 1.00 0.00 H new ATOM 0 HB2 PHE A 43 0.503 -5.984 -9.117 1.00 0.00 H new ATOM 0 HB3 PHE A 43 0.492 -7.680 -9.559 1.00 0.00 H new ATOM 0 HD1 PHE A 43 1.937 -4.406 -10.762 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.478 -8.648 -10.335 1.00 0.00 H new ATOM 0 HE1 PHE A 43 4.235 -4.206 -11.670 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.770 -8.445 -11.261 1.00 0.00 H new ATOM 0 HZ PHE A 43 5.646 -6.226 -11.929 1.00 0.00 H new ATOM 601 N THR A 44 -2.142 -7.901 -10.446 1.00 0.00 N ATOM 602 CA THR A 44 -3.473 -8.250 -10.009 1.00 0.00 C ATOM 603 C THR A 44 -3.496 -9.495 -9.142 1.00 0.00 C ATOM 604 O THR A 44 -2.672 -10.394 -9.291 1.00 0.00 O ATOM 605 CB THR A 44 -4.362 -8.492 -11.230 1.00 0.00 C ATOM 606 OG1 THR A 44 -3.676 -8.100 -12.408 1.00 0.00 O ATOM 607 CG2 THR A 44 -5.655 -7.712 -11.110 1.00 0.00 C ATOM 0 H THR A 44 -1.534 -8.695 -10.647 1.00 0.00 H new ATOM 0 HA THR A 44 -3.841 -7.417 -9.410 1.00 0.00 H new ATOM 0 HB THR A 44 -4.598 -9.555 -11.283 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.248 -8.258 -13.188 1.00 0.00 H new ATOM 0 HG21 THR A 44 -6.274 -7.897 -11.988 1.00 0.00 H new ATOM 0 HG22 THR A 44 -6.190 -8.030 -10.215 1.00 0.00 H new ATOM 0 HG23 THR A 44 -5.432 -6.647 -11.041 1.00 0.00 H new ATOM 615 N LYS A 45 -4.478 -9.539 -8.246 1.00 0.00 N ATOM 616 CA LYS A 45 -4.639 -10.676 -7.357 1.00 0.00 C ATOM 617 C LYS A 45 -6.058 -10.728 -6.796 1.00 0.00 C ATOM 618 O LYS A 45 -6.502 -9.809 -6.109 1.00 0.00 O ATOM 619 CB LYS A 45 -3.635 -10.591 -6.205 1.00 0.00 C ATOM 620 CG LYS A 45 -3.140 -11.995 -5.845 1.00 0.00 C ATOM 621 CD LYS A 45 -4.322 -12.860 -5.400 1.00 0.00 C ATOM 622 CE LYS A 45 -3.803 -14.093 -4.656 1.00 0.00 C ATOM 623 NZ LYS A 45 -2.378 -14.331 -5.022 1.00 0.00 N ATOM 0 H LYS A 45 -5.170 -8.801 -8.120 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.455 -11.584 -7.931 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -2.793 -9.960 -6.490 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.102 -10.126 -5.337 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -2.648 -12.449 -6.705 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.399 -11.937 -5.048 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -4.984 -12.284 -4.753 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.909 -13.165 -6.266 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -3.893 -13.946 -3.580 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.405 -14.965 -4.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -2.030 -15.179 -4.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -2.302 -14.472 -6.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -1.806 -13.509 -4.742 1.00 0.00 H new ATOM 637 N LEU A 46 -6.757 -11.813 -7.101 1.00 0.00 N ATOM 638 CA LEU A 46 -8.122 -11.998 -6.638 1.00 0.00 C ATOM 639 C LEU A 46 -8.148 -13.034 -5.517 1.00 0.00 C ATOM 640 O LEU A 46 -7.586 -14.121 -5.653 1.00 0.00 O ATOM 641 CB LEU A 46 -9.002 -12.484 -7.793 1.00 0.00 C ATOM 642 CG LEU A 46 -9.222 -11.352 -8.803 1.00 0.00 C ATOM 643 CD1 LEU A 46 -8.011 -11.220 -9.726 1.00 0.00 C ATOM 644 CD2 LEU A 46 -10.466 -11.657 -9.636 1.00 0.00 C ATOM 0 H LEU A 46 -6.398 -12.580 -7.669 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.503 -11.046 -6.267 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.531 -13.335 -8.286 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.961 -12.830 -7.408 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.356 -10.414 -8.263 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.182 -10.412 -10.438 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.124 -10.999 -9.133 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.862 -12.155 -10.267 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -10.627 -10.855 -10.356 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.327 -12.599 -10.167 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -11.333 -11.735 -8.980 1.00 0.00 H new ATOM 656 N ILE A 47 -8.785 -12.686 -4.404 1.00 0.00 N ATOM 657 CA ILE A 47 -8.855 -13.592 -3.261 1.00 0.00 C ATOM 658 C ILE A 47 -10.165 -13.408 -2.504 1.00 0.00 C ATOM 659 O ILE A 47 -10.878 -12.430 -2.712 1.00 0.00 O ATOM 660 CB ILE A 47 -7.678 -13.332 -2.318 1.00 0.00 C ATOM 661 CG1 ILE A 47 -7.217 -11.877 -2.465 1.00 0.00 C ATOM 662 CG2 ILE A 47 -6.524 -14.273 -2.671 1.00 0.00 C ATOM 663 CD1 ILE A 47 -6.126 -11.576 -1.438 1.00 0.00 C ATOM 0 H ILE A 47 -9.257 -11.792 -4.268 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.807 -14.616 -3.632 1.00 0.00 H new ATOM 0 HB ILE A 47 -7.990 -13.511 -1.289 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.839 -11.705 -3.473 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.061 -11.202 -2.322 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -5.685 -14.088 -2.000 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -6.852 -15.307 -2.565 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.211 -14.095 -3.700 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.801 -10.541 -1.545 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -6.520 -11.730 -0.433 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -5.278 -12.242 -1.602 1.00 0.00 H new ATOM 675 N THR A 48 -10.477 -14.363 -1.629 1.00 0.00 N ATOM 676 CA THR A 48 -11.710 -14.307 -0.848 1.00 0.00 C ATOM 677 C THR A 48 -11.413 -14.176 0.644 1.00 0.00 C ATOM 678 O THR A 48 -10.676 -14.983 1.212 1.00 0.00 O ATOM 679 CB THR A 48 -12.530 -15.571 -1.092 1.00 0.00 C ATOM 680 OG1 THR A 48 -12.506 -15.888 -2.476 1.00 0.00 O ATOM 681 CG2 THR A 48 -13.974 -15.344 -0.642 1.00 0.00 C ATOM 0 H THR A 48 -9.896 -15.181 -1.444 1.00 0.00 H new ATOM 0 HA THR A 48 -12.274 -13.430 -1.166 1.00 0.00 H new ATOM 0 HB THR A 48 -12.103 -16.396 -0.522 1.00 0.00 H new ATOM 0 HG1 THR A 48 -13.031 -16.700 -2.635 1.00 0.00 H new ATOM 0 HG21 THR A 48 -14.556 -16.248 -0.818 1.00 0.00 H new ATOM 0 HG22 THR A 48 -13.990 -15.103 0.421 1.00 0.00 H new ATOM 0 HG23 THR A 48 -14.406 -14.519 -1.208 1.00 0.00 H new ATOM 689 N VAL A 49 -12.004 -13.161 1.272 1.00 0.00 N ATOM 690 CA VAL A 49 -11.815 -12.930 2.702 1.00 0.00 C ATOM 691 C VAL A 49 -13.161 -12.967 3.417 1.00 0.00 C ATOM 692 O VAL A 49 -14.050 -12.166 3.126 1.00 0.00 O ATOM 693 CB VAL A 49 -11.148 -11.573 2.935 1.00 0.00 C ATOM 694 CG1 VAL A 49 -12.008 -10.465 2.322 1.00 0.00 C ATOM 695 CG2 VAL A 49 -11.004 -11.329 4.439 1.00 0.00 C ATOM 0 H VAL A 49 -12.617 -12.487 0.813 1.00 0.00 H new ATOM 0 HA VAL A 49 -11.173 -13.715 3.101 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.164 -11.569 2.467 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.531 -9.499 2.489 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.114 -10.637 1.251 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -12.993 -10.469 2.789 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.529 -10.362 4.607 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.990 -11.335 4.905 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -10.391 -12.116 4.878 1.00 0.00 H new ATOM 705 N ASN A 50 -13.310 -13.904 4.347 1.00 0.00 N ATOM 706 CA ASN A 50 -14.560 -14.035 5.086 1.00 0.00 C ATOM 707 C ASN A 50 -15.652 -14.588 4.176 1.00 0.00 C ATOM 708 O ASN A 50 -16.840 -14.476 4.476 1.00 0.00 O ATOM 709 CB ASN A 50 -14.992 -12.672 5.631 1.00 0.00 C ATOM 710 CG ASN A 50 -15.792 -12.855 6.917 1.00 0.00 C ATOM 711 OD1 ASN A 50 -15.304 -12.419 8.045 1.00 0.00 O flip ATOM 712 ND2 ASN A 50 -16.890 -13.409 6.891 1.00 0.00 N flip ATOM 0 H ASN A 50 -12.589 -14.578 4.605 1.00 0.00 H new ATOM 0 HA ASN A 50 -14.403 -14.722 5.917 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -14.115 -12.053 5.823 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -15.595 -12.149 4.889 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -17.269 -13.749 6.007 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -17.422 -13.528 7.753 1.00 0.00 H new ATOM 719 N GLY A 51 -15.236 -15.173 3.058 1.00 0.00 N ATOM 720 CA GLY A 51 -16.182 -15.731 2.100 1.00 0.00 C ATOM 721 C GLY A 51 -16.574 -14.682 1.069 1.00 0.00 C ATOM 722 O GLY A 51 -17.179 -14.997 0.044 1.00 0.00 O ATOM 0 H GLY A 51 -14.256 -15.273 2.794 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.738 -16.593 1.601 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.070 -16.087 2.622 1.00 0.00 H new ATOM 726 N GLN A 52 -16.207 -13.435 1.342 1.00 0.00 N ATOM 727 CA GLN A 52 -16.505 -12.344 0.428 1.00 0.00 C ATOM 728 C GLN A 52 -15.367 -12.200 -0.569 1.00 0.00 C ATOM 729 O GLN A 52 -14.196 -12.232 -0.189 1.00 0.00 O ATOM 730 CB GLN A 52 -16.689 -11.043 1.210 1.00 0.00 C ATOM 731 CG GLN A 52 -17.162 -9.929 0.272 1.00 0.00 C ATOM 732 CD GLN A 52 -18.560 -10.242 -0.252 1.00 0.00 C ATOM 733 OE1 GLN A 52 -18.706 -10.954 -1.246 1.00 0.00 O ATOM 734 NE2 GLN A 52 -19.603 -9.749 0.359 1.00 0.00 N ATOM 0 H GLN A 52 -15.705 -13.157 2.185 1.00 0.00 H new ATOM 0 HA GLN A 52 -17.429 -12.561 -0.108 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -17.416 -11.189 2.009 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -15.749 -10.757 1.682 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -17.169 -8.976 0.801 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -16.467 -9.826 -0.562 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -19.480 -9.159 1.182 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -20.541 -9.953 0.013 1.00 0.00 H new ATOM 743 N GLU A 53 -15.701 -12.065 -1.846 1.00 0.00 N ATOM 744 CA GLU A 53 -14.683 -11.946 -2.866 1.00 0.00 C ATOM 745 C GLU A 53 -14.053 -10.565 -2.853 1.00 0.00 C ATOM 746 O GLU A 53 -14.711 -9.558 -2.593 1.00 0.00 O ATOM 747 CB GLU A 53 -15.292 -12.221 -4.226 1.00 0.00 C ATOM 748 CG GLU A 53 -14.750 -13.541 -4.769 1.00 0.00 C ATOM 749 CD GLU A 53 -15.417 -13.873 -6.099 1.00 0.00 C ATOM 750 OE1 GLU A 53 -16.628 -13.753 -6.178 1.00 0.00 O ATOM 751 OE2 GLU A 53 -14.706 -14.243 -7.019 1.00 0.00 O ATOM 0 H GLU A 53 -16.660 -12.036 -2.192 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.901 -12.677 -2.658 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -16.378 -12.266 -4.147 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.056 -11.408 -4.913 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.670 -13.473 -4.902 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.933 -14.341 -4.052 1.00 0.00 H new ATOM 758 N TYR A 54 -12.764 -10.548 -3.129 1.00 0.00 N ATOM 759 CA TYR A 54 -11.992 -9.314 -3.152 1.00 0.00 C ATOM 760 C TYR A 54 -11.071 -9.307 -4.369 1.00 0.00 C ATOM 761 O TYR A 54 -10.318 -10.256 -4.588 1.00 0.00 O ATOM 762 CB TYR A 54 -11.141 -9.203 -1.880 1.00 0.00 C ATOM 763 CG TYR A 54 -11.887 -8.440 -0.811 1.00 0.00 C ATOM 764 CD1 TYR A 54 -12.980 -9.028 -0.181 1.00 0.00 C ATOM 765 CD2 TYR A 54 -11.481 -7.147 -0.447 1.00 0.00 C ATOM 766 CE1 TYR A 54 -13.678 -8.334 0.814 1.00 0.00 C ATOM 767 CE2 TYR A 54 -12.178 -6.451 0.549 1.00 0.00 C ATOM 768 CZ TYR A 54 -13.277 -7.044 1.179 1.00 0.00 C ATOM 769 OH TYR A 54 -13.965 -6.358 2.159 1.00 0.00 O ATOM 0 H TYR A 54 -12.221 -11.384 -3.343 1.00 0.00 H new ATOM 0 HA TYR A 54 -12.680 -8.470 -3.204 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -10.889 -10.199 -1.516 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -10.201 -8.699 -2.106 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -13.291 -10.024 -0.461 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -10.633 -6.689 -0.934 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -14.526 -8.794 1.300 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -11.867 -5.456 0.831 1.00 0.00 H new ATOM 0 HH TYR A 54 -13.899 -5.395 1.992 1.00 0.00 H new ATOM 779 N HIS A 55 -11.134 -8.237 -5.152 1.00 0.00 N ATOM 780 CA HIS A 55 -10.301 -8.118 -6.343 1.00 0.00 C ATOM 781 C HIS A 55 -9.363 -6.935 -6.193 1.00 0.00 C ATOM 782 O HIS A 55 -9.814 -5.790 -6.137 1.00 0.00 O ATOM 783 CB HIS A 55 -11.188 -7.900 -7.571 1.00 0.00 C ATOM 784 CG HIS A 55 -10.421 -7.147 -8.621 1.00 0.00 C ATOM 785 ND1 HIS A 55 -10.187 -5.783 -8.530 1.00 0.00 N ATOM 786 CD2 HIS A 55 -9.829 -7.551 -9.792 1.00 0.00 C ATOM 787 CE1 HIS A 55 -9.481 -5.419 -9.617 1.00 0.00 C ATOM 788 NE2 HIS A 55 -9.236 -6.459 -10.419 1.00 0.00 N ATOM 0 H HIS A 55 -11.751 -7.442 -4.985 1.00 0.00 H new ATOM 0 HA HIS A 55 -9.721 -9.033 -6.466 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -11.520 -8.860 -7.967 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -12.083 -7.344 -7.291 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -9.824 -8.563 -10.169 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -9.153 -4.410 -9.816 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -8.724 -6.454 -11.301 1.00 0.00 H new ATOM 797 N LEU A 56 -8.060 -7.213 -6.123 1.00 0.00 N ATOM 798 CA LEU A 56 -7.082 -6.144 -5.966 1.00 0.00 C ATOM 799 C LEU A 56 -6.128 -6.062 -7.141 1.00 0.00 C ATOM 800 O LEU A 56 -5.714 -7.068 -7.719 1.00 0.00 O ATOM 801 CB LEU A 56 -6.264 -6.325 -4.690 1.00 0.00 C ATOM 802 CG LEU A 56 -6.891 -5.530 -3.537 1.00 0.00 C ATOM 803 CD1 LEU A 56 -8.304 -6.040 -3.273 1.00 0.00 C ATOM 804 CD2 LEU A 56 -6.044 -5.702 -2.271 1.00 0.00 C ATOM 0 H LEU A 56 -7.666 -8.153 -6.172 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.655 -5.218 -5.911 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.216 -7.382 -4.428 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.240 -5.991 -4.856 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.929 -4.475 -3.808 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.748 -5.474 -2.454 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.910 -5.915 -4.171 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.266 -7.096 -3.006 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.492 -5.136 -1.454 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.003 -6.757 -2.002 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.035 -5.335 -2.456 1.00 0.00 H new ATOM 816 N GLN A 57 -5.783 -4.831 -7.458 1.00 0.00 N ATOM 817 CA GLN A 57 -4.858 -4.530 -8.546 1.00 0.00 C ATOM 818 C GLN A 57 -3.943 -3.383 -8.140 1.00 0.00 C ATOM 819 O GLN A 57 -4.416 -2.308 -7.809 1.00 0.00 O ATOM 820 CB GLN A 57 -5.642 -4.164 -9.806 1.00 0.00 C ATOM 821 CG GLN A 57 -4.798 -3.257 -10.702 1.00 0.00 C ATOM 822 CD GLN A 57 -5.348 -3.275 -12.123 1.00 0.00 C ATOM 823 OE1 GLN A 57 -5.919 -2.285 -12.580 1.00 0.00 O ATOM 824 NE2 GLN A 57 -5.210 -4.348 -12.852 1.00 0.00 N ATOM 0 H GLN A 57 -6.133 -4.006 -6.972 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.248 -5.409 -8.756 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.919 -5.069 -10.348 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.569 -3.659 -9.534 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -4.805 -2.239 -10.313 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -3.761 -3.592 -10.700 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -4.736 -5.167 -12.470 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -5.576 -4.368 -13.804 1.00 0.00 H new ATOM 833 N LEU A 58 -2.633 -3.613 -8.150 1.00 0.00 N ATOM 834 CA LEU A 58 -1.709 -2.574 -7.741 1.00 0.00 C ATOM 835 C LEU A 58 -0.814 -2.128 -8.867 1.00 0.00 C ATOM 836 O LEU A 58 -0.570 -2.861 -9.823 1.00 0.00 O ATOM 837 CB LEU A 58 -0.850 -3.026 -6.550 1.00 0.00 C ATOM 838 CG LEU A 58 -1.515 -4.170 -5.782 1.00 0.00 C ATOM 839 CD1 LEU A 58 -2.915 -3.759 -5.320 1.00 0.00 C ATOM 840 CD2 LEU A 58 -1.582 -5.449 -6.632 1.00 0.00 C ATOM 0 H LEU A 58 -2.199 -4.492 -8.431 1.00 0.00 H new ATOM 0 HA LEU A 58 -2.322 -1.725 -7.438 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.129 -3.346 -6.907 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.685 -2.183 -5.879 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.905 -4.385 -4.905 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.375 -4.583 -4.775 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.842 -2.889 -4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -3.526 -3.512 -6.188 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.060 -6.243 -6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.161 -5.256 -7.535 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.573 -5.757 -6.907 1.00 0.00 H new ATOM 852 N VAL A 59 -0.356 -0.886 -8.749 1.00 0.00 N ATOM 853 CA VAL A 59 0.489 -0.300 -9.777 1.00 0.00 C ATOM 854 C VAL A 59 1.770 0.289 -9.230 1.00 0.00 C ATOM 855 O VAL A 59 1.802 0.862 -8.148 1.00 0.00 O ATOM 856 CB VAL A 59 -0.280 0.785 -10.529 1.00 0.00 C ATOM 857 CG1 VAL A 59 0.083 2.180 -10.004 1.00 0.00 C ATOM 858 CG2 VAL A 59 0.079 0.706 -12.013 1.00 0.00 C ATOM 0 H VAL A 59 -0.555 -0.273 -7.959 1.00 0.00 H new ATOM 0 HA VAL A 59 0.766 -1.112 -10.449 1.00 0.00 H new ATOM 0 HB VAL A 59 -1.348 0.623 -10.380 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.478 2.934 -10.556 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.165 2.246 -8.945 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.151 2.352 -10.138 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -0.464 1.476 -12.560 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.151 0.861 -12.137 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -0.193 -0.275 -12.401 1.00 0.00 H new ATOM 868 N ASP A 60 2.817 0.166 -10.027 1.00 0.00 N ATOM 869 CA ASP A 60 4.110 0.715 -9.669 1.00 0.00 C ATOM 870 C ASP A 60 4.542 1.715 -10.734 1.00 0.00 C ATOM 871 O ASP A 60 4.971 1.328 -11.822 1.00 0.00 O ATOM 872 CB ASP A 60 5.145 -0.407 -9.561 1.00 0.00 C ATOM 873 CG ASP A 60 6.494 0.075 -10.081 1.00 0.00 C ATOM 874 OD1 ASP A 60 6.898 1.162 -9.703 1.00 0.00 O ATOM 875 OD2 ASP A 60 7.104 -0.650 -10.849 1.00 0.00 O ATOM 0 H ASP A 60 2.795 -0.311 -10.928 1.00 0.00 H new ATOM 0 HA ASP A 60 4.035 1.217 -8.704 1.00 0.00 H new ATOM 0 HB2 ASP A 60 5.239 -0.727 -8.523 1.00 0.00 H new ATOM 0 HB3 ASP A 60 4.814 -1.274 -10.133 1.00 0.00 H new ATOM 880 N THR A 61 4.405 3.001 -10.413 1.00 0.00 N ATOM 881 CA THR A 61 4.764 4.063 -11.326 1.00 0.00 C ATOM 882 C THR A 61 6.266 4.151 -11.495 1.00 0.00 C ATOM 883 O THR A 61 7.031 3.830 -10.585 1.00 0.00 O ATOM 884 CB THR A 61 4.246 5.391 -10.790 1.00 0.00 C ATOM 885 OG1 THR A 61 4.822 5.643 -9.516 1.00 0.00 O ATOM 886 CG2 THR A 61 2.731 5.319 -10.664 1.00 0.00 C ATOM 0 H THR A 61 4.043 3.325 -9.516 1.00 0.00 H new ATOM 0 HA THR A 61 4.315 3.846 -12.295 1.00 0.00 H new ATOM 0 HB THR A 61 4.517 6.197 -11.472 1.00 0.00 H new ATOM 0 HG1 THR A 61 4.491 6.498 -9.171 1.00 0.00 H new ATOM 0 HG21 THR A 61 2.352 6.266 -10.281 1.00 0.00 H new ATOM 0 HG22 THR A 61 2.293 5.123 -11.643 1.00 0.00 H new ATOM 0 HG23 THR A 61 2.461 4.516 -9.978 1.00 0.00 H new ATOM 1134 N ILE A 78 -8.075 4.204 -9.332 1.00 0.00 N ATOM 1135 CA ILE A 78 -7.986 3.262 -8.249 1.00 0.00 C ATOM 1136 C ILE A 78 -8.845 3.634 -7.055 1.00 0.00 C ATOM 1137 O ILE A 78 -9.626 4.584 -7.096 1.00 0.00 O ATOM 1138 CB ILE A 78 -6.552 3.214 -7.833 1.00 0.00 C ATOM 1139 CG1 ILE A 78 -6.102 4.573 -7.307 1.00 0.00 C ATOM 1140 CG2 ILE A 78 -5.687 2.824 -9.031 1.00 0.00 C ATOM 1141 CD1 ILE A 78 -4.678 4.420 -6.846 1.00 0.00 C ATOM 0 HA ILE A 78 -8.355 2.297 -8.596 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.443 2.475 -7.039 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -6.175 5.331 -8.087 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.740 4.898 -6.485 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -4.641 2.789 -8.728 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.992 1.843 -9.396 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.810 3.561 -9.824 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -4.316 5.373 -6.461 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.629 3.668 -6.058 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.056 4.108 -7.685 1.00 0.00 H new ATOM 1153 N ASN A 79 -8.676 2.864 -5.984 1.00 0.00 N ATOM 1154 CA ASN A 79 -9.425 3.101 -4.759 1.00 0.00 C ATOM 1155 C ASN A 79 -8.593 2.665 -3.565 1.00 0.00 C ATOM 1156 O ASN A 79 -9.110 2.474 -2.466 1.00 0.00 O ATOM 1157 CB ASN A 79 -10.739 2.319 -4.788 1.00 0.00 C ATOM 1158 CG ASN A 79 -11.920 3.283 -4.821 1.00 0.00 C ATOM 1159 OD1 ASN A 79 -12.880 3.116 -4.068 1.00 0.00 O ATOM 1160 ND2 ASN A 79 -11.908 4.287 -5.653 1.00 0.00 N ATOM 0 H ASN A 79 -8.030 2.076 -5.941 1.00 0.00 H new ATOM 0 HA ASN A 79 -9.650 4.164 -4.676 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.765 1.669 -5.662 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.808 1.676 -3.911 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.695 4.936 -5.681 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.112 4.424 -6.276 1.00 0.00 H new ATOM 1167 N GLY A 80 -7.298 2.495 -3.801 1.00 0.00 N ATOM 1168 CA GLY A 80 -6.390 2.059 -2.748 1.00 0.00 C ATOM 1169 C GLY A 80 -5.014 2.690 -2.875 1.00 0.00 C ATOM 1170 O GLY A 80 -4.660 3.254 -3.911 1.00 0.00 O ATOM 0 H GLY A 80 -6.855 2.651 -4.706 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.815 2.312 -1.777 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.294 0.974 -2.781 1.00 0.00 H new ATOM 1174 N TYR A 81 -4.239 2.554 -1.813 1.00 0.00 N ATOM 1175 CA TYR A 81 -2.880 3.071 -1.787 1.00 0.00 C ATOM 1176 C TYR A 81 -1.995 2.256 -0.847 1.00 0.00 C ATOM 1177 O TYR A 81 -2.285 2.148 0.345 1.00 0.00 O ATOM 1178 CB TYR A 81 -2.877 4.532 -1.346 1.00 0.00 C ATOM 1179 CG TYR A 81 -2.063 5.364 -2.311 1.00 0.00 C ATOM 1180 CD1 TYR A 81 -0.785 4.944 -2.698 1.00 0.00 C ATOM 1181 CD2 TYR A 81 -2.577 6.568 -2.803 1.00 0.00 C ATOM 1182 CE1 TYR A 81 -0.024 5.720 -3.569 1.00 0.00 C ATOM 1183 CE2 TYR A 81 -1.816 7.343 -3.684 1.00 0.00 C ATOM 1184 CZ TYR A 81 -0.538 6.920 -4.068 1.00 0.00 C ATOM 1185 OH TYR A 81 0.215 7.688 -4.930 1.00 0.00 O ATOM 0 H TYR A 81 -4.529 2.088 -0.953 1.00 0.00 H new ATOM 0 HA TYR A 81 -2.478 2.994 -2.797 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.899 4.909 -1.301 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.462 4.616 -0.342 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.387 4.014 -2.319 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -3.560 6.899 -2.503 1.00 0.00 H new ATOM 0 HE1 TYR A 81 0.964 5.394 -3.859 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -2.215 8.270 -4.069 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.380 8.183 -5.532 1.00 0.00 H new ATOM 1195 N ILE A 82 -0.914 1.710 -1.377 1.00 0.00 N ATOM 1196 CA ILE A 82 0.022 0.932 -0.574 1.00 0.00 C ATOM 1197 C ILE A 82 1.428 1.476 -0.780 1.00 0.00 C ATOM 1198 O ILE A 82 2.079 1.209 -1.785 1.00 0.00 O ATOM 1199 CB ILE A 82 -0.035 -0.532 -0.983 1.00 0.00 C ATOM 1200 CG1 ILE A 82 1.006 -1.332 -0.202 1.00 0.00 C ATOM 1201 CG2 ILE A 82 0.271 -0.628 -2.466 1.00 0.00 C ATOM 1202 CD1 ILE A 82 0.813 -2.815 -0.503 1.00 0.00 C ATOM 0 H ILE A 82 -0.660 1.790 -2.362 1.00 0.00 H new ATOM 0 HA ILE A 82 -0.248 1.011 0.479 1.00 0.00 H new ATOM 0 HB ILE A 82 -1.025 -0.936 -0.771 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.011 -1.018 -0.482 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.900 -1.147 0.867 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.235 -1.672 -2.778 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.467 -0.055 -3.028 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.266 -0.226 -2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.551 -3.397 0.049 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.189 -3.120 -0.202 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.939 -2.989 -1.572 1.00 0.00 H new ATOM 1214 N LEU A 83 1.895 2.256 0.164 1.00 0.00 N ATOM 1215 CA LEU A 83 3.212 2.840 0.028 1.00 0.00 C ATOM 1216 C LEU A 83 4.261 2.023 0.771 1.00 0.00 C ATOM 1217 O LEU A 83 4.151 1.778 1.974 1.00 0.00 O ATOM 1218 CB LEU A 83 3.193 4.280 0.527 1.00 0.00 C ATOM 1219 CG LEU A 83 1.756 4.823 0.535 1.00 0.00 C ATOM 1220 CD1 LEU A 83 0.998 4.323 1.768 1.00 0.00 C ATOM 1221 CD2 LEU A 83 1.798 6.353 0.559 1.00 0.00 C ATOM 0 H LEU A 83 1.396 2.499 1.020 1.00 0.00 H new ATOM 0 HA LEU A 83 3.484 2.834 -1.028 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.613 4.329 1.532 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.820 4.902 -0.112 1.00 0.00 H new ATOM 0 HG LEU A 83 1.243 4.472 -0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.018 4.718 1.756 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.964 3.234 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.508 4.661 2.670 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.781 6.745 0.565 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.321 6.689 1.454 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.322 6.717 -0.325 1.00 0.00 H new ATOM 1233 N VAL A 84 5.278 1.599 0.022 1.00 0.00 N ATOM 1234 CA VAL A 84 6.362 0.799 0.577 1.00 0.00 C ATOM 1235 C VAL A 84 7.546 1.697 0.928 1.00 0.00 C ATOM 1236 O VAL A 84 8.106 2.362 0.062 1.00 0.00 O ATOM 1237 CB VAL A 84 6.790 -0.270 -0.444 1.00 0.00 C ATOM 1238 CG1 VAL A 84 8.300 -0.529 -0.362 1.00 0.00 C ATOM 1239 CG2 VAL A 84 6.048 -1.578 -0.152 1.00 0.00 C ATOM 0 H VAL A 84 5.371 1.799 -0.974 1.00 0.00 H new ATOM 0 HA VAL A 84 6.017 0.305 1.485 1.00 0.00 H new ATOM 0 HB VAL A 84 6.546 0.091 -1.443 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.579 -1.288 -1.093 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.840 0.394 -0.574 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.556 -0.877 0.639 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.350 -2.337 -0.874 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.292 -1.918 0.855 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.973 -1.412 -0.228 1.00 0.00 H new ATOM 1249 N TYR A 85 7.916 1.708 2.206 1.00 0.00 N ATOM 1250 CA TYR A 85 9.032 2.528 2.667 1.00 0.00 C ATOM 1251 C TYR A 85 10.103 1.661 3.322 1.00 0.00 C ATOM 1252 O TYR A 85 9.795 0.663 3.974 1.00 0.00 O ATOM 1253 CB TYR A 85 8.539 3.586 3.655 1.00 0.00 C ATOM 1254 CG TYR A 85 7.921 2.917 4.858 1.00 0.00 C ATOM 1255 CD1 TYR A 85 8.739 2.401 5.868 1.00 0.00 C ATOM 1256 CD2 TYR A 85 6.528 2.822 4.968 1.00 0.00 C ATOM 1257 CE1 TYR A 85 8.169 1.788 6.988 1.00 0.00 C ATOM 1258 CE2 TYR A 85 5.956 2.209 6.089 1.00 0.00 C ATOM 1259 CZ TYR A 85 6.776 1.692 7.099 1.00 0.00 C ATOM 1260 OH TYR A 85 6.213 1.088 8.204 1.00 0.00 O ATOM 0 H TYR A 85 7.462 1.161 2.937 1.00 0.00 H new ATOM 0 HA TYR A 85 9.470 3.027 1.803 1.00 0.00 H new ATOM 0 HB2 TYR A 85 9.369 4.220 3.967 1.00 0.00 H new ATOM 0 HB3 TYR A 85 7.807 4.234 3.172 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.813 2.476 5.783 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.896 3.221 4.189 1.00 0.00 H new ATOM 0 HE1 TYR A 85 8.802 1.389 7.767 1.00 0.00 H new ATOM 0 HE2 TYR A 85 4.882 2.135 6.175 1.00 0.00 H new ATOM 0 HH TYR A 85 6.194 1.723 8.950 1.00 0.00 H new ATOM 1270 N SER A 86 11.360 2.046 3.132 1.00 0.00 N ATOM 1271 CA SER A 86 12.475 1.294 3.698 1.00 0.00 C ATOM 1272 C SER A 86 12.788 1.774 5.110 1.00 0.00 C ATOM 1273 O SER A 86 12.697 2.966 5.404 1.00 0.00 O ATOM 1274 CB SER A 86 13.715 1.475 2.827 1.00 0.00 C ATOM 1275 OG SER A 86 14.478 2.562 3.332 1.00 0.00 O ATOM 0 H SER A 86 11.632 2.869 2.594 1.00 0.00 H new ATOM 0 HA SER A 86 12.194 0.242 3.734 1.00 0.00 H new ATOM 0 HB2 SER A 86 14.312 0.563 2.827 1.00 0.00 H new ATOM 0 HB3 SER A 86 13.425 1.666 1.794 1.00 0.00 H new ATOM 0 HG SER A 86 15.226 2.746 2.726 1.00 0.00 H new ATOM 1281 N VAL A 87 13.158 0.841 5.980 1.00 0.00 N ATOM 1282 CA VAL A 87 13.483 1.183 7.354 1.00 0.00 C ATOM 1283 C VAL A 87 14.908 1.726 7.455 1.00 0.00 C ATOM 1284 O VAL A 87 15.514 1.691 8.526 1.00 0.00 O ATOM 1285 CB VAL A 87 13.373 -0.063 8.221 1.00 0.00 C ATOM 1286 CG1 VAL A 87 11.998 -0.699 8.055 1.00 0.00 C ATOM 1287 CG2 VAL A 87 14.437 -1.064 7.783 1.00 0.00 C ATOM 0 H VAL A 87 13.239 -0.151 5.758 1.00 0.00 H new ATOM 0 HA VAL A 87 12.786 1.949 7.694 1.00 0.00 H new ATOM 0 HB VAL A 87 13.516 0.213 9.266 1.00 0.00 H new ATOM 0 HG11 VAL A 87 11.931 -1.589 8.680 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.229 0.013 8.355 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.849 -0.976 7.011 1.00 0.00 H new ATOM 0 HG21 VAL A 87 14.367 -1.961 8.398 1.00 0.00 H new ATOM 0 HG22 VAL A 87 14.280 -1.328 6.737 1.00 0.00 H new ATOM 0 HG23 VAL A 87 15.425 -0.619 7.901 1.00 0.00 H new ATOM 1297 N THR A 88 15.452 2.192 6.329 1.00 0.00 N ATOM 1298 CA THR A 88 16.824 2.695 6.310 1.00 0.00 C ATOM 1299 C THR A 88 16.922 4.051 5.632 1.00 0.00 C ATOM 1300 O THR A 88 17.839 4.830 5.896 1.00 0.00 O ATOM 1301 CB THR A 88 17.704 1.706 5.543 1.00 0.00 C ATOM 1302 OG1 THR A 88 19.021 1.737 6.076 1.00 0.00 O ATOM 1303 CG2 THR A 88 17.742 2.086 4.055 1.00 0.00 C ATOM 0 H THR A 88 14.970 2.231 5.431 1.00 0.00 H new ATOM 0 HA THR A 88 17.155 2.803 7.343 1.00 0.00 H new ATOM 0 HB THR A 88 17.291 0.702 5.644 1.00 0.00 H new ATOM 0 HG1 THR A 88 19.230 0.870 6.481 1.00 0.00 H new ATOM 0 HG21 THR A 88 18.370 1.378 3.515 1.00 0.00 H new ATOM 0 HG22 THR A 88 16.732 2.060 3.647 1.00 0.00 H new ATOM 0 HG23 THR A 88 18.151 3.090 3.946 1.00 0.00 H new ATOM 1311 N SER A 89 16.006 4.299 4.714 1.00 0.00 N ATOM 1312 CA SER A 89 16.030 5.520 3.953 1.00 0.00 C ATOM 1313 C SER A 89 15.101 6.557 4.534 1.00 0.00 C ATOM 1314 O SER A 89 13.924 6.615 4.178 1.00 0.00 O ATOM 1315 CB SER A 89 15.626 5.226 2.507 1.00 0.00 C ATOM 1316 OG SER A 89 15.613 6.436 1.763 1.00 0.00 O ATOM 0 H SER A 89 15.239 3.667 4.482 1.00 0.00 H new ATOM 0 HA SER A 89 17.044 5.919 3.988 1.00 0.00 H new ATOM 0 HB2 SER A 89 16.325 4.519 2.060 1.00 0.00 H new ATOM 0 HB3 SER A 89 14.641 4.760 2.481 1.00 0.00 H new ATOM 0 HG SER A 89 15.356 6.247 0.836 1.00 0.00 H new ATOM 1322 N ILE A 90 15.639 7.423 5.384 1.00 0.00 N ATOM 1323 CA ILE A 90 14.828 8.488 5.927 1.00 0.00 C ATOM 1324 C ILE A 90 14.318 9.281 4.737 1.00 0.00 C ATOM 1325 O ILE A 90 13.412 10.109 4.846 1.00 0.00 O ATOM 1326 CB ILE A 90 15.657 9.372 6.869 1.00 0.00 C ATOM 1327 CG1 ILE A 90 14.858 10.618 7.279 1.00 0.00 C ATOM 1328 CG2 ILE A 90 16.941 9.809 6.160 1.00 0.00 C ATOM 1329 CD1 ILE A 90 13.509 10.204 7.878 1.00 0.00 C ATOM 0 H ILE A 90 16.608 7.406 5.702 1.00 0.00 H new ATOM 0 HA ILE A 90 14.000 8.097 6.518 1.00 0.00 H new ATOM 0 HB ILE A 90 15.901 8.797 7.763 1.00 0.00 H new ATOM 0 HG12 ILE A 90 15.424 11.200 8.006 1.00 0.00 H new ATOM 0 HG13 ILE A 90 14.699 11.259 6.412 1.00 0.00 H new ATOM 0 HG21 ILE A 90 17.530 10.437 6.828 1.00 0.00 H new ATOM 0 HG22 ILE A 90 17.521 8.929 5.883 1.00 0.00 H new ATOM 0 HG23 ILE A 90 16.687 10.373 5.262 1.00 0.00 H new ATOM 0 HD11 ILE A 90 12.950 11.094 8.166 1.00 0.00 H new ATOM 0 HD12 ILE A 90 12.940 9.641 7.138 1.00 0.00 H new ATOM 0 HD13 ILE A 90 13.677 9.581 8.757 1.00 0.00 H new ATOM 1341 N LYS A 91 14.896 8.968 3.578 1.00 0.00 N ATOM 1342 CA LYS A 91 14.497 9.600 2.338 1.00 0.00 C ATOM 1343 C LYS A 91 13.174 9.004 1.880 1.00 0.00 C ATOM 1344 O LYS A 91 12.222 9.732 1.600 1.00 0.00 O ATOM 1345 CB LYS A 91 15.564 9.392 1.276 1.00 0.00 C ATOM 1346 CG LYS A 91 16.927 9.206 1.949 1.00 0.00 C ATOM 1347 CD LYS A 91 18.036 9.348 0.905 1.00 0.00 C ATOM 1348 CE LYS A 91 18.661 10.739 1.013 1.00 0.00 C ATOM 1349 NZ LYS A 91 19.674 10.914 -0.067 1.00 0.00 N ATOM 0 H LYS A 91 15.642 8.279 3.480 1.00 0.00 H new ATOM 0 HA LYS A 91 14.377 10.672 2.497 1.00 0.00 H new ATOM 0 HB2 LYS A 91 15.324 8.518 0.670 1.00 0.00 H new ATOM 0 HB3 LYS A 91 15.593 10.248 0.602 1.00 0.00 H new ATOM 0 HG2 LYS A 91 17.059 9.946 2.738 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.981 8.225 2.421 1.00 0.00 H new ATOM 0 HD2 LYS A 91 18.796 8.583 1.060 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.630 9.196 -0.095 1.00 0.00 H new ATOM 0 HE2 LYS A 91 17.889 11.504 0.929 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.129 10.864 1.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 20.099 11.860 0.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 20.416 10.192 0.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 19.214 10.812 -0.994 1.00 0.00 H new ATOM 1363 N SER A 92 13.108 7.673 1.829 1.00 0.00 N ATOM 1364 CA SER A 92 11.880 7.011 1.430 1.00 0.00 C ATOM 1365 C SER A 92 10.753 7.377 2.392 1.00 0.00 C ATOM 1366 O SER A 92 9.591 7.443 2.003 1.00 0.00 O ATOM 1367 CB SER A 92 12.076 5.494 1.428 1.00 0.00 C ATOM 1368 OG SER A 92 12.142 5.023 2.769 1.00 0.00 O ATOM 0 H SER A 92 13.880 7.047 2.056 1.00 0.00 H new ATOM 0 HA SER A 92 11.617 7.340 0.425 1.00 0.00 H new ATOM 0 HB2 SER A 92 11.253 5.011 0.902 1.00 0.00 H new ATOM 0 HB3 SER A 92 12.991 5.235 0.895 1.00 0.00 H new ATOM 0 HG SER A 92 12.770 5.576 3.279 1.00 0.00 H new ATOM 1374 N PHE A 93 11.107 7.605 3.656 1.00 0.00 N ATOM 1375 CA PHE A 93 10.114 7.949 4.670 1.00 0.00 C ATOM 1376 C PHE A 93 9.637 9.391 4.539 1.00 0.00 C ATOM 1377 O PHE A 93 8.439 9.666 4.606 1.00 0.00 O ATOM 1378 CB PHE A 93 10.703 7.727 6.060 1.00 0.00 C ATOM 1379 CG PHE A 93 9.887 6.667 6.743 1.00 0.00 C ATOM 1380 CD1 PHE A 93 8.554 6.929 7.062 1.00 0.00 C ATOM 1381 CD2 PHE A 93 10.450 5.420 7.034 1.00 0.00 C ATOM 1382 CE1 PHE A 93 7.774 5.944 7.674 1.00 0.00 C ATOM 1383 CE2 PHE A 93 9.673 4.434 7.651 1.00 0.00 C ATOM 1384 CZ PHE A 93 8.333 4.695 7.970 1.00 0.00 C ATOM 0 H PHE A 93 12.066 7.558 4.000 1.00 0.00 H new ATOM 0 HA PHE A 93 9.250 7.301 4.520 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.746 7.418 5.988 1.00 0.00 H new ATOM 0 HB3 PHE A 93 10.684 8.653 6.635 1.00 0.00 H new ATOM 0 HD1 PHE A 93 8.125 7.894 6.836 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.481 5.219 6.783 1.00 0.00 H new ATOM 0 HE1 PHE A 93 6.742 6.146 7.918 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.105 3.472 7.882 1.00 0.00 H new ATOM 0 HZ PHE A 93 7.732 3.933 8.444 1.00 0.00 H new ATOM 1394 N GLU A 94 10.576 10.311 4.370 1.00 0.00 N ATOM 1395 CA GLU A 94 10.235 11.724 4.250 1.00 0.00 C ATOM 1396 C GLU A 94 9.444 11.996 2.972 1.00 0.00 C ATOM 1397 O GLU A 94 8.453 12.730 2.990 1.00 0.00 O ATOM 1398 CB GLU A 94 11.511 12.567 4.253 1.00 0.00 C ATOM 1399 CG GLU A 94 11.809 13.034 5.680 1.00 0.00 C ATOM 1400 CD GLU A 94 13.275 13.438 5.803 1.00 0.00 C ATOM 1401 OE1 GLU A 94 13.951 13.458 4.787 1.00 0.00 O ATOM 1402 OE2 GLU A 94 13.701 13.722 6.910 1.00 0.00 O ATOM 0 H GLU A 94 11.574 10.108 4.313 1.00 0.00 H new ATOM 0 HA GLU A 94 9.612 11.995 5.102 1.00 0.00 H new ATOM 0 HB2 GLU A 94 12.347 11.983 3.868 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.393 13.427 3.594 1.00 0.00 H new ATOM 0 HG2 GLU A 94 11.168 13.878 5.936 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.583 12.236 6.387 1.00 0.00 H new ATOM 1409 N VAL A 95 9.882 11.411 1.862 1.00 0.00 N ATOM 1410 CA VAL A 95 9.196 11.617 0.593 1.00 0.00 C ATOM 1411 C VAL A 95 7.819 10.961 0.614 1.00 0.00 C ATOM 1412 O VAL A 95 6.846 11.518 0.107 1.00 0.00 O ATOM 1413 CB VAL A 95 10.019 11.045 -0.555 1.00 0.00 C ATOM 1414 CG1 VAL A 95 11.426 11.643 -0.527 1.00 0.00 C ATOM 1415 CG2 VAL A 95 10.106 9.535 -0.392 1.00 0.00 C ATOM 0 H VAL A 95 10.697 10.799 1.815 1.00 0.00 H new ATOM 0 HA VAL A 95 9.073 12.690 0.444 1.00 0.00 H new ATOM 0 HB VAL A 95 9.546 11.290 -1.506 1.00 0.00 H new ATOM 0 HG11 VAL A 95 12.012 11.232 -1.349 1.00 0.00 H new ATOM 0 HG12 VAL A 95 11.363 12.726 -0.632 1.00 0.00 H new ATOM 0 HG13 VAL A 95 11.907 11.398 0.420 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.693 9.114 -1.208 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.584 9.299 0.558 1.00 0.00 H new ATOM 0 HG23 VAL A 95 9.103 9.109 -0.409 1.00 0.00 H new ATOM 1425 N ILE A 96 7.746 9.777 1.210 1.00 0.00 N ATOM 1426 CA ILE A 96 6.488 9.048 1.305 1.00 0.00 C ATOM 1427 C ILE A 96 5.449 9.880 2.054 1.00 0.00 C ATOM 1428 O ILE A 96 4.285 9.943 1.657 1.00 0.00 O ATOM 1429 CB ILE A 96 6.719 7.727 2.044 1.00 0.00 C ATOM 1430 CG1 ILE A 96 7.265 6.679 1.065 1.00 0.00 C ATOM 1431 CG2 ILE A 96 5.404 7.232 2.656 1.00 0.00 C ATOM 1432 CD1 ILE A 96 6.112 5.950 0.375 1.00 0.00 C ATOM 0 H ILE A 96 8.543 9.302 1.634 1.00 0.00 H new ATOM 0 HA ILE A 96 6.118 8.846 0.300 1.00 0.00 H new ATOM 0 HB ILE A 96 7.443 7.886 2.843 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.898 7.161 0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.890 5.963 1.599 1.00 0.00 H new ATOM 0 HG21 ILE A 96 5.578 6.292 3.180 1.00 0.00 H new ATOM 0 HG22 ILE A 96 5.028 7.975 3.359 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.670 7.077 1.865 1.00 0.00 H new ATOM 0 HD11 ILE A 96 6.512 5.209 -0.317 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.496 5.452 1.124 1.00 0.00 H new ATOM 0 HD13 ILE A 96 5.504 6.669 -0.175 1.00 0.00 H new ATOM 1444 N LYS A 97 5.882 10.521 3.137 1.00 0.00 N ATOM 1445 CA LYS A 97 4.982 11.346 3.934 1.00 0.00 C ATOM 1446 C LYS A 97 4.607 12.609 3.170 1.00 0.00 C ATOM 1447 O LYS A 97 3.535 13.179 3.379 1.00 0.00 O ATOM 1448 CB LYS A 97 5.650 11.726 5.257 1.00 0.00 C ATOM 1449 CG LYS A 97 4.693 12.587 6.084 1.00 0.00 C ATOM 1450 CD LYS A 97 5.156 14.044 6.052 1.00 0.00 C ATOM 1451 CE LYS A 97 4.040 14.944 6.582 1.00 0.00 C ATOM 1452 NZ LYS A 97 3.699 14.545 7.977 1.00 0.00 N ATOM 0 H LYS A 97 6.842 10.485 3.479 1.00 0.00 H new ATOM 0 HA LYS A 97 4.078 10.773 4.140 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.919 10.827 5.812 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.574 12.272 5.066 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.681 12.508 5.687 1.00 0.00 H new ATOM 0 HG3 LYS A 97 4.661 12.228 7.113 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.054 14.165 6.658 1.00 0.00 H new ATOM 0 HD3 LYS A 97 5.417 14.332 5.034 1.00 0.00 H new ATOM 0 HE2 LYS A 97 4.357 15.987 6.558 1.00 0.00 H new ATOM 0 HE3 LYS A 97 3.160 14.864 5.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 3.094 15.273 8.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 3.193 13.637 7.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.572 14.447 8.533 1.00 0.00 H new ATOM 1466 N VAL A 98 5.494 13.035 2.281 1.00 0.00 N ATOM 1467 CA VAL A 98 5.247 14.227 1.488 1.00 0.00 C ATOM 1468 C VAL A 98 4.237 13.926 0.388 1.00 0.00 C ATOM 1469 O VAL A 98 3.117 14.435 0.405 1.00 0.00 O ATOM 1470 CB VAL A 98 6.553 14.696 0.870 1.00 0.00 C ATOM 1471 CG1 VAL A 98 6.272 15.650 -0.290 1.00 0.00 C ATOM 1472 CG2 VAL A 98 7.387 15.401 1.937 1.00 0.00 C ATOM 0 H VAL A 98 6.385 12.575 2.093 1.00 0.00 H new ATOM 0 HA VAL A 98 4.843 15.009 2.131 1.00 0.00 H new ATOM 0 HB VAL A 98 7.103 13.836 0.487 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.215 15.980 -0.726 1.00 0.00 H new ATOM 0 HG12 VAL A 98 5.682 15.136 -1.049 1.00 0.00 H new ATOM 0 HG13 VAL A 98 5.719 16.515 0.076 1.00 0.00 H new ATOM 0 HG21 VAL A 98 8.326 15.740 1.500 1.00 0.00 H new ATOM 0 HG22 VAL A 98 6.835 16.259 2.322 1.00 0.00 H new ATOM 0 HG23 VAL A 98 7.596 14.708 2.752 1.00 0.00 H new ATOM 1482 N ILE A 99 4.640 13.090 -0.560 1.00 0.00 N ATOM 1483 CA ILE A 99 3.758 12.718 -1.658 1.00 0.00 C ATOM 1484 C ILE A 99 2.351 12.468 -1.135 1.00 0.00 C ATOM 1485 O ILE A 99 1.372 12.939 -1.711 1.00 0.00 O ATOM 1486 CB ILE A 99 4.277 11.450 -2.337 1.00 0.00 C ATOM 1487 CG1 ILE A 99 5.720 11.664 -2.825 1.00 0.00 C ATOM 1488 CG2 ILE A 99 3.374 11.100 -3.519 1.00 0.00 C ATOM 1489 CD1 ILE A 99 5.727 12.317 -4.211 1.00 0.00 C ATOM 0 H ILE A 99 5.564 12.660 -0.591 1.00 0.00 H new ATOM 0 HA ILE A 99 3.736 13.534 -2.380 1.00 0.00 H new ATOM 0 HB ILE A 99 4.268 10.630 -1.619 1.00 0.00 H new ATOM 0 HG12 ILE A 99 6.260 12.293 -2.117 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.242 10.708 -2.864 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.743 10.196 -4.004 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.358 10.932 -3.163 1.00 0.00 H new ATOM 0 HG23 ILE A 99 3.376 11.922 -4.235 1.00 0.00 H new ATOM 0 HD11 ILE A 99 6.756 12.461 -4.540 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.206 11.673 -4.919 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.224 13.283 -4.161 1.00 0.00 H new ATOM 1501 N HIS A 100 2.254 11.729 -0.033 1.00 0.00 N ATOM 1502 CA HIS A 100 0.955 11.438 0.554 1.00 0.00 C ATOM 1503 C HIS A 100 0.220 12.736 0.861 1.00 0.00 C ATOM 1504 O HIS A 100 -0.832 13.013 0.291 1.00 0.00 O ATOM 1505 CB HIS A 100 1.126 10.630 1.842 1.00 0.00 C ATOM 1506 CG HIS A 100 -0.205 10.503 2.532 1.00 0.00 C ATOM 1507 ND1 HIS A 100 -0.875 11.600 3.051 1.00 0.00 N ATOM 1508 CD2 HIS A 100 -1.007 9.418 2.785 1.00 0.00 C ATOM 1509 CE1 HIS A 100 -2.028 11.155 3.582 1.00 0.00 C ATOM 1510 NE2 HIS A 100 -2.158 9.833 3.448 1.00 0.00 N ATOM 0 H HIS A 100 3.049 11.327 0.464 1.00 0.00 H new ATOM 0 HA HIS A 100 0.373 10.854 -0.159 1.00 0.00 H new ATOM 0 HB2 HIS A 100 1.526 9.642 1.614 1.00 0.00 H new ATOM 0 HB3 HIS A 100 1.844 11.120 2.500 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -0.780 8.398 2.511 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -2.760 11.790 4.059 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -2.934 9.252 3.764 1.00 0.00 H new ATOM 1519 N GLY A 101 0.787 13.529 1.764 1.00 0.00 N ATOM 1520 CA GLY A 101 0.190 14.796 2.145 1.00 0.00 C ATOM 1521 C GLY A 101 -0.375 15.528 0.942 1.00 0.00 C ATOM 1522 O GLY A 101 -1.562 15.841 0.884 1.00 0.00 O ATOM 0 H GLY A 101 1.661 13.313 2.244 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.603 14.622 2.872 1.00 0.00 H new ATOM 0 HA3 GLY A 101 0.938 15.420 2.633 1.00 0.00 H new ATOM 1526 N LYS A 102 0.497 15.795 -0.008 1.00 0.00 N ATOM 1527 CA LYS A 102 0.110 16.500 -1.228 1.00 0.00 C ATOM 1528 C LYS A 102 -1.034 15.769 -1.919 1.00 0.00 C ATOM 1529 O LYS A 102 -2.143 16.294 -2.001 1.00 0.00 O ATOM 1530 CB LYS A 102 1.311 16.606 -2.171 1.00 0.00 C ATOM 1531 CG LYS A 102 0.959 17.505 -3.360 1.00 0.00 C ATOM 1532 CD LYS A 102 0.733 18.948 -2.891 1.00 0.00 C ATOM 1533 CE LYS A 102 1.353 19.918 -3.900 1.00 0.00 C ATOM 1534 NZ LYS A 102 1.033 19.467 -5.284 1.00 0.00 N ATOM 0 H LYS A 102 1.483 15.537 0.035 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.225 17.503 -0.964 1.00 0.00 H new ATOM 0 HB2 LYS A 102 2.170 17.013 -1.637 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.596 15.615 -2.524 1.00 0.00 H new ATOM 0 HG2 LYS A 102 1.763 17.477 -4.096 1.00 0.00 H new ATOM 0 HG3 LYS A 102 0.062 17.131 -3.853 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.334 19.145 -2.790 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.179 19.096 -1.908 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.969 20.925 -3.736 1.00 0.00 H new ATOM 0 HE3 LYS A 102 2.433 19.963 -3.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.945 20.295 -5.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 1.794 18.851 -5.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.136 18.940 -5.279 1.00 0.00 H new ATOM 1548 N LEU A 103 -0.765 14.559 -2.411 1.00 0.00 N ATOM 1549 CA LEU A 103 -1.803 13.777 -3.076 1.00 0.00 C ATOM 1550 C LEU A 103 -3.136 13.975 -2.352 1.00 0.00 C ATOM 1551 O LEU A 103 -4.108 14.459 -2.931 1.00 0.00 O ATOM 1552 CB LEU A 103 -1.435 12.293 -3.064 1.00 0.00 C ATOM 1553 CG LEU A 103 -2.533 11.483 -3.771 1.00 0.00 C ATOM 1554 CD1 LEU A 103 -1.943 10.775 -4.987 1.00 0.00 C ATOM 1555 CD2 LEU A 103 -3.111 10.451 -2.798 1.00 0.00 C ATOM 0 H LEU A 103 0.148 14.106 -2.362 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.892 14.114 -4.109 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.478 12.141 -3.564 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.317 11.946 -2.038 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.328 12.153 -4.099 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.723 10.201 -5.488 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.537 11.515 -5.677 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.147 10.103 -4.666 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.890 9.876 -3.298 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.319 9.779 -2.468 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.536 10.963 -1.935 1.00 0.00 H new ATOM 1567 N LEU A 104 -3.153 13.612 -1.072 1.00 0.00 N ATOM 1568 CA LEU A 104 -4.347 13.764 -0.247 1.00 0.00 C ATOM 1569 C LEU A 104 -4.945 15.150 -0.464 1.00 0.00 C ATOM 1570 O LEU A 104 -6.149 15.306 -0.660 1.00 0.00 O ATOM 1571 CB LEU A 104 -3.960 13.518 1.231 1.00 0.00 C ATOM 1572 CG LEU A 104 -4.388 14.666 2.151 1.00 0.00 C ATOM 1573 CD1 LEU A 104 -5.903 14.759 2.153 1.00 0.00 C ATOM 1574 CD2 LEU A 104 -3.903 14.375 3.573 1.00 0.00 C ATOM 0 H LEU A 104 -2.353 13.210 -0.584 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.109 13.036 -0.526 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.421 12.591 1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.881 13.383 1.303 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.959 15.604 1.798 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.217 15.574 2.806 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.257 14.949 1.140 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.325 13.821 2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.204 15.188 4.234 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.343 13.441 3.923 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.816 14.288 3.576 1.00 0.00 H new ATOM 1586 N ASP A 105 -4.084 16.140 -0.407 1.00 0.00 N ATOM 1587 CA ASP A 105 -4.480 17.524 -0.579 1.00 0.00 C ATOM 1588 C ASP A 105 -5.115 17.744 -1.945 1.00 0.00 C ATOM 1589 O ASP A 105 -5.960 18.622 -2.119 1.00 0.00 O ATOM 1590 CB ASP A 105 -3.230 18.383 -0.443 1.00 0.00 C ATOM 1591 CG ASP A 105 -2.943 19.122 -1.746 1.00 0.00 C ATOM 1592 OD1 ASP A 105 -2.735 18.460 -2.749 1.00 0.00 O ATOM 1593 OD2 ASP A 105 -2.929 20.342 -1.720 1.00 0.00 O ATOM 0 H ASP A 105 -3.086 16.011 -0.240 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.220 17.793 0.175 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -3.361 19.100 0.367 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.378 17.756 -0.179 1.00 0.00 H new ATOM 1676 N GLN A 111 -11.871 9.120 3.600 1.00 0.00 N ATOM 1677 CA GLN A 111 -10.983 8.035 3.992 1.00 0.00 C ATOM 1678 C GLN A 111 -11.050 6.889 2.995 1.00 0.00 C ATOM 1679 O GLN A 111 -12.093 6.256 2.827 1.00 0.00 O ATOM 1680 CB GLN A 111 -11.355 7.512 5.375 1.00 0.00 C ATOM 1681 CG GLN A 111 -11.544 8.684 6.341 1.00 0.00 C ATOM 1682 CD GLN A 111 -11.668 8.164 7.768 1.00 0.00 C ATOM 1683 OE1 GLN A 111 -12.051 7.013 7.980 1.00 0.00 O ATOM 1684 NE2 GLN A 111 -11.364 8.946 8.767 1.00 0.00 N ATOM 0 HA GLN A 111 -9.968 8.432 4.012 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.272 6.925 5.317 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -10.574 6.847 5.744 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.699 9.368 6.266 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.436 9.249 6.071 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.047 9.899 8.590 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -11.443 8.604 9.725 1.00 0.00 H new ATOM 1693 N ILE A 112 -9.922 6.620 2.353 1.00 0.00 N ATOM 1694 CA ILE A 112 -9.833 5.535 1.384 1.00 0.00 C ATOM 1695 C ILE A 112 -8.786 4.531 1.855 1.00 0.00 C ATOM 1696 O ILE A 112 -7.896 4.890 2.615 1.00 0.00 O ATOM 1697 CB ILE A 112 -9.437 6.085 0.011 1.00 0.00 C ATOM 1698 CG1 ILE A 112 -8.629 7.372 0.193 1.00 0.00 C ATOM 1699 CG2 ILE A 112 -10.695 6.385 -0.803 1.00 0.00 C ATOM 1700 CD1 ILE A 112 -7.813 7.647 -1.071 1.00 0.00 C ATOM 0 H ILE A 112 -9.054 7.139 2.485 1.00 0.00 H new ATOM 0 HA ILE A 112 -10.804 5.046 1.299 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.833 5.346 -0.515 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -9.298 8.208 0.395 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -7.966 7.279 1.053 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -10.411 6.776 -1.780 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -11.272 5.469 -0.932 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -11.301 7.124 -0.278 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -7.238 8.564 -0.941 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -7.133 6.815 -1.253 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -8.486 7.759 -1.921 1.00 0.00 H new ATOM 1712 N PRO A 113 -8.863 3.294 1.440 1.00 0.00 N ATOM 1713 CA PRO A 113 -7.869 2.268 1.861 1.00 0.00 C ATOM 1714 C PRO A 113 -6.427 2.765 1.726 1.00 0.00 C ATOM 1715 O PRO A 113 -5.888 2.839 0.619 1.00 0.00 O ATOM 1716 CB PRO A 113 -8.118 1.092 0.913 1.00 0.00 C ATOM 1717 CG PRO A 113 -9.502 1.267 0.374 1.00 0.00 C ATOM 1718 CD PRO A 113 -9.894 2.737 0.551 1.00 0.00 C ATOM 0 HA PRO A 113 -7.988 2.007 2.913 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -7.386 1.083 0.106 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -8.024 0.142 1.440 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -9.540 0.986 -0.679 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -10.202 0.619 0.902 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -9.916 3.259 -0.406 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -10.888 2.832 0.989 1.00 0.00 H new ATOM 1726 N ILE A 114 -5.796 3.072 2.862 1.00 0.00 N ATOM 1727 CA ILE A 114 -4.409 3.521 2.870 1.00 0.00 C ATOM 1728 C ILE A 114 -3.603 2.535 3.695 1.00 0.00 C ATOM 1729 O ILE A 114 -3.979 2.196 4.822 1.00 0.00 O ATOM 1730 CB ILE A 114 -4.275 4.937 3.454 1.00 0.00 C ATOM 1731 CG1 ILE A 114 -5.199 5.901 2.705 1.00 0.00 C ATOM 1732 CG2 ILE A 114 -2.838 5.426 3.296 1.00 0.00 C ATOM 1733 CD1 ILE A 114 -6.169 6.571 3.688 1.00 0.00 C ATOM 0 H ILE A 114 -6.226 3.017 3.785 1.00 0.00 H new ATOM 0 HA ILE A 114 -4.038 3.562 1.846 1.00 0.00 H new ATOM 0 HB ILE A 114 -4.547 4.905 4.509 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -4.608 6.659 2.192 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -5.758 5.361 1.941 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.748 6.430 3.711 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -2.164 4.752 3.825 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.575 5.446 2.238 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -6.822 7.255 3.146 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -6.772 5.808 4.181 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -5.603 7.126 4.436 1.00 0.00 H new ATOM 1745 N MET A 115 -2.517 2.056 3.115 1.00 0.00 N ATOM 1746 CA MET A 115 -1.684 1.082 3.789 1.00 0.00 C ATOM 1747 C MET A 115 -0.230 1.515 3.828 1.00 0.00 C ATOM 1748 O MET A 115 0.425 1.621 2.791 1.00 0.00 O ATOM 1749 CB MET A 115 -1.785 -0.255 3.066 1.00 0.00 C ATOM 1750 CG MET A 115 -1.245 -1.352 3.970 1.00 0.00 C ATOM 1751 SD MET A 115 -2.517 -1.808 5.160 1.00 0.00 S ATOM 1752 CE MET A 115 -1.429 -2.743 6.248 1.00 0.00 C ATOM 0 H MET A 115 -2.195 2.324 2.185 1.00 0.00 H new ATOM 0 HA MET A 115 -2.039 0.992 4.816 1.00 0.00 H new ATOM 0 HB2 MET A 115 -2.822 -0.462 2.802 1.00 0.00 H new ATOM 0 HB3 MET A 115 -1.219 -0.223 2.135 1.00 0.00 H new ATOM 0 HG2 MET A 115 -0.955 -2.220 3.377 1.00 0.00 H new ATOM 0 HG3 MET A 115 -0.351 -1.007 4.488 1.00 0.00 H new ATOM 0 HE1 MET A 115 -1.993 -3.093 7.113 1.00 0.00 H new ATOM 0 HE2 MET A 115 -1.023 -3.599 5.709 1.00 0.00 H new ATOM 0 HE3 MET A 115 -0.612 -2.104 6.582 1.00 0.00 H new ATOM 1762 N LEU A 116 0.280 1.723 5.034 1.00 0.00 N ATOM 1763 CA LEU A 116 1.657 2.095 5.199 1.00 0.00 C ATOM 1764 C LEU A 116 2.458 0.857 5.486 1.00 0.00 C ATOM 1765 O LEU A 116 2.522 0.395 6.624 1.00 0.00 O ATOM 1766 CB LEU A 116 1.792 3.020 6.371 1.00 0.00 C ATOM 1767 CG LEU A 116 1.674 4.464 5.893 1.00 0.00 C ATOM 1768 CD1 LEU A 116 1.167 5.311 7.041 1.00 0.00 C ATOM 1769 CD2 LEU A 116 3.044 4.979 5.458 1.00 0.00 C ATOM 0 H LEU A 116 -0.246 1.638 5.903 1.00 0.00 H new ATOM 0 HA LEU A 116 2.011 2.587 4.293 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.019 2.805 7.109 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.753 2.865 6.862 1.00 0.00 H new ATOM 0 HG LEU A 116 0.987 4.517 5.048 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.077 6.348 6.716 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.191 4.945 7.360 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.867 5.252 7.874 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.954 6.011 5.118 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.734 4.934 6.301 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.424 4.361 4.645 1.00 0.00 H new ATOM 1781 N VAL A 117 3.060 0.327 4.448 1.00 0.00 N ATOM 1782 CA VAL A 117 3.855 -0.864 4.587 1.00 0.00 C ATOM 1783 C VAL A 117 5.324 -0.521 4.560 1.00 0.00 C ATOM 1784 O VAL A 117 5.806 0.237 3.727 1.00 0.00 O ATOM 1785 CB VAL A 117 3.500 -1.873 3.499 1.00 0.00 C ATOM 1786 CG1 VAL A 117 4.160 -3.219 3.793 1.00 0.00 C ATOM 1787 CG2 VAL A 117 1.997 -2.065 3.517 1.00 0.00 C ATOM 0 H VAL A 117 3.013 0.703 3.501 1.00 0.00 H new ATOM 0 HA VAL A 117 3.636 -1.323 5.551 1.00 0.00 H new ATOM 0 HB VAL A 117 3.845 -1.508 2.532 1.00 0.00 H new ATOM 0 HG11 VAL A 117 3.899 -3.931 3.010 1.00 0.00 H new ATOM 0 HG12 VAL A 117 5.242 -3.094 3.824 1.00 0.00 H new ATOM 0 HG13 VAL A 117 3.810 -3.594 4.755 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.713 -2.783 2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.690 -2.439 4.494 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.506 -1.111 3.323 1.00 0.00 H new ATOM 1797 N GLY A 118 6.003 -1.098 5.505 1.00 0.00 N ATOM 1798 CA GLY A 118 7.433 -0.907 5.663 1.00 0.00 C ATOM 1799 C GLY A 118 8.151 -2.154 5.200 1.00 0.00 C ATOM 1800 O GLY A 118 8.008 -3.211 5.806 1.00 0.00 O ATOM 0 H GLY A 118 5.588 -1.721 6.198 1.00 0.00 H new ATOM 0 HA2 GLY A 118 7.764 -0.045 5.083 1.00 0.00 H new ATOM 0 HA3 GLY A 118 7.672 -0.700 6.706 1.00 0.00 H new ATOM 1804 N ASN A 119 8.896 -2.042 4.115 1.00 0.00 N ATOM 1805 CA ASN A 119 9.588 -3.203 3.586 1.00 0.00 C ATOM 1806 C ASN A 119 11.035 -3.247 4.059 1.00 0.00 C ATOM 1807 O ASN A 119 11.492 -2.357 4.774 1.00 0.00 O ATOM 1808 CB ASN A 119 9.542 -3.186 2.057 1.00 0.00 C ATOM 1809 CG ASN A 119 10.142 -4.472 1.499 1.00 0.00 C ATOM 1810 OD1 ASN A 119 9.637 -5.562 1.768 1.00 0.00 O ATOM 1811 ND2 ASN A 119 11.197 -4.411 0.732 1.00 0.00 N ATOM 0 H ASN A 119 9.036 -1.178 3.592 1.00 0.00 H new ATOM 0 HA ASN A 119 9.082 -4.095 3.956 1.00 0.00 H new ATOM 0 HB2 ASN A 119 8.512 -3.080 1.718 1.00 0.00 H new ATOM 0 HB3 ASN A 119 10.093 -2.325 1.679 1.00 0.00 H new ATOM 0 HD21 ASN A 119 11.604 -5.267 0.355 1.00 0.00 H new ATOM 0 HD22 ASN A 119 11.614 -3.507 0.510 1.00 0.00 H new ATOM 1818 N LYS A 120 11.733 -4.311 3.669 1.00 0.00 N ATOM 1819 CA LYS A 120 13.129 -4.511 4.061 1.00 0.00 C ATOM 1820 C LYS A 120 13.233 -4.631 5.575 1.00 0.00 C ATOM 1821 O LYS A 120 13.921 -3.849 6.223 1.00 0.00 O ATOM 1822 CB LYS A 120 14.023 -3.359 3.575 1.00 0.00 C ATOM 1823 CG LYS A 120 14.129 -3.380 2.048 1.00 0.00 C ATOM 1824 CD LYS A 120 15.023 -2.226 1.582 1.00 0.00 C ATOM 1825 CE LYS A 120 15.927 -2.695 0.437 1.00 0.00 C ATOM 1826 NZ LYS A 120 15.090 -3.110 -0.723 1.00 0.00 N ATOM 0 H LYS A 120 11.354 -5.052 3.079 1.00 0.00 H new ATOM 0 HA LYS A 120 13.476 -5.432 3.593 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.611 -2.405 3.905 1.00 0.00 H new ATOM 0 HB3 LYS A 120 15.015 -3.448 4.017 1.00 0.00 H new ATOM 0 HG2 LYS A 120 14.542 -4.332 1.715 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.138 -3.289 1.603 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.408 -1.389 1.252 1.00 0.00 H new ATOM 0 HD3 LYS A 120 15.631 -1.867 2.413 1.00 0.00 H new ATOM 0 HE2 LYS A 120 16.603 -1.892 0.142 1.00 0.00 H new ATOM 0 HE3 LYS A 120 16.547 -3.528 0.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 15.357 -4.071 -1.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.087 -3.099 -0.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 15.241 -2.451 -1.513 1.00 0.00 H new ATOM 1840 N LYS A 121 12.532 -5.606 6.136 1.00 0.00 N ATOM 1841 CA LYS A 121 12.543 -5.809 7.581 1.00 0.00 C ATOM 1842 C LYS A 121 13.938 -6.178 8.084 1.00 0.00 C ATOM 1843 O LYS A 121 14.296 -5.856 9.214 1.00 0.00 O ATOM 1844 CB LYS A 121 11.561 -6.918 7.958 1.00 0.00 C ATOM 1845 CG LYS A 121 11.293 -6.877 9.463 1.00 0.00 C ATOM 1846 CD LYS A 121 10.221 -7.909 9.818 1.00 0.00 C ATOM 1847 CE LYS A 121 10.569 -8.568 11.155 1.00 0.00 C ATOM 1848 NZ LYS A 121 11.621 -9.601 10.940 1.00 0.00 N ATOM 0 H LYS A 121 11.952 -6.266 5.618 1.00 0.00 H new ATOM 0 HA LYS A 121 12.245 -4.871 8.050 1.00 0.00 H new ATOM 0 HB2 LYS A 121 10.628 -6.793 7.409 1.00 0.00 H new ATOM 0 HB3 LYS A 121 11.969 -7.889 7.677 1.00 0.00 H new ATOM 0 HG2 LYS A 121 12.211 -7.086 10.013 1.00 0.00 H new ATOM 0 HG3 LYS A 121 10.965 -5.880 9.758 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.245 -7.428 9.881 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.155 -8.664 9.035 1.00 0.00 H new ATOM 0 HE2 LYS A 121 10.921 -7.817 11.862 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.680 -9.024 11.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.834 -10.073 11.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.282 -10.304 10.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.483 -9.148 10.575 1.00 0.00 H new ATOM 1862 N ASP A 122 14.719 -6.865 7.254 1.00 0.00 N ATOM 1863 CA ASP A 122 16.061 -7.268 7.666 1.00 0.00 C ATOM 1864 C ASP A 122 16.942 -6.052 7.921 1.00 0.00 C ATOM 1865 O ASP A 122 18.042 -6.175 8.461 1.00 0.00 O ATOM 1866 CB ASP A 122 16.702 -8.176 6.615 1.00 0.00 C ATOM 1867 CG ASP A 122 16.596 -7.555 5.228 1.00 0.00 C ATOM 1868 OD1 ASP A 122 15.559 -7.675 4.624 1.00 0.00 O ATOM 1869 OD2 ASP A 122 17.570 -7.009 4.775 1.00 0.00 O ATOM 0 H ASP A 122 14.454 -7.150 6.311 1.00 0.00 H new ATOM 0 HA ASP A 122 15.970 -7.827 8.598 1.00 0.00 H new ATOM 0 HB2 ASP A 122 17.750 -8.345 6.864 1.00 0.00 H new ATOM 0 HB3 ASP A 122 16.212 -9.150 6.621 1.00 0.00 H new ATOM 1874 N LEU A 123 16.442 -4.875 7.564 1.00 0.00 N ATOM 1875 CA LEU A 123 17.184 -3.649 7.801 1.00 0.00 C ATOM 1876 C LEU A 123 16.738 -3.073 9.127 1.00 0.00 C ATOM 1877 O LEU A 123 17.500 -2.382 9.795 1.00 0.00 O ATOM 1878 CB LEU A 123 16.956 -2.636 6.673 1.00 0.00 C ATOM 1879 CG LEU A 123 18.052 -2.781 5.616 1.00 0.00 C ATOM 1880 CD1 LEU A 123 18.003 -4.188 5.041 1.00 0.00 C ATOM 1881 CD2 LEU A 123 17.818 -1.767 4.493 1.00 0.00 C ATOM 0 H LEU A 123 15.536 -4.747 7.114 1.00 0.00 H new ATOM 0 HA LEU A 123 18.251 -3.870 7.826 1.00 0.00 H new ATOM 0 HB2 LEU A 123 15.978 -2.797 6.220 1.00 0.00 H new ATOM 0 HB3 LEU A 123 16.958 -1.623 7.076 1.00 0.00 H new ATOM 0 HG LEU A 123 19.026 -2.599 6.070 1.00 0.00 H new ATOM 0 HD11 LEU A 123 18.781 -4.300 4.286 1.00 0.00 H new ATOM 0 HD12 LEU A 123 18.164 -4.913 5.839 1.00 0.00 H new ATOM 0 HD13 LEU A 123 17.028 -4.361 4.585 1.00 0.00 H new ATOM 0 HD21 LEU A 123 18.599 -1.871 3.740 1.00 0.00 H new ATOM 0 HD22 LEU A 123 16.846 -1.950 4.035 1.00 0.00 H new ATOM 0 HD23 LEU A 123 17.842 -0.758 4.904 1.00 0.00 H new ATOM 1893 N HIS A 124 15.494 -3.385 9.508 1.00 0.00 N ATOM 1894 CA HIS A 124 14.956 -2.915 10.774 1.00 0.00 C ATOM 1895 C HIS A 124 16.035 -2.976 11.850 1.00 0.00 C ATOM 1896 O HIS A 124 15.995 -2.235 12.824 1.00 0.00 O ATOM 1897 CB HIS A 124 13.756 -3.768 11.190 1.00 0.00 C ATOM 1898 CG HIS A 124 14.222 -4.977 11.955 1.00 0.00 C ATOM 1899 ND1 HIS A 124 15.239 -5.875 11.732 1.00 0.00 N flip ATOM 1900 CD2 HIS A 124 13.602 -5.391 13.124 1.00 0.00 C flip ATOM 1901 CE1 HIS A 124 15.250 -6.829 12.746 1.00 0.00 C flip ATOM 1902 NE2 HIS A 124 14.245 -6.491 13.557 1.00 0.00 N flip ATOM 0 H HIS A 124 14.852 -3.956 8.958 1.00 0.00 H new ATOM 0 HA HIS A 124 14.627 -1.883 10.655 1.00 0.00 H new ATOM 0 HB2 HIS A 124 13.076 -3.178 11.805 1.00 0.00 H new ATOM 0 HB3 HIS A 124 13.198 -4.079 10.307 1.00 0.00 H new ATOM 0 HD2 HIS A 124 12.757 -4.917 13.600 1.00 0.00 H new ATOM 0 HE1 HIS A 124 15.927 -7.664 12.853 1.00 0.00 H new ATOM 0 HE2 HIS A 124 13.995 -7.004 14.402 1.00 0.00 H new ATOM 1911 N MET A 125 17.022 -3.844 11.661 1.00 0.00 N ATOM 1912 CA MET A 125 18.105 -3.935 12.629 1.00 0.00 C ATOM 1913 C MET A 125 18.576 -2.527 12.977 1.00 0.00 C ATOM 1914 O MET A 125 19.170 -2.294 14.030 1.00 0.00 O ATOM 1915 CB MET A 125 19.268 -4.743 12.053 1.00 0.00 C ATOM 1916 CG MET A 125 18.919 -6.233 12.078 1.00 0.00 C ATOM 1917 SD MET A 125 19.781 -7.029 13.457 1.00 0.00 S ATOM 1918 CE MET A 125 18.321 -7.388 14.464 1.00 0.00 C ATOM 0 H MET A 125 17.094 -4.480 10.867 1.00 0.00 H new ATOM 0 HA MET A 125 17.746 -4.439 13.526 1.00 0.00 H new ATOM 0 HB2 MET A 125 19.475 -4.425 11.031 1.00 0.00 H new ATOM 0 HB3 MET A 125 20.173 -4.561 12.633 1.00 0.00 H new ATOM 0 HG2 MET A 125 17.842 -6.364 12.184 1.00 0.00 H new ATOM 0 HG3 MET A 125 19.206 -6.701 11.136 1.00 0.00 H new ATOM 0 HE1 MET A 125 18.634 -7.758 15.440 1.00 0.00 H new ATOM 0 HE2 MET A 125 17.735 -6.478 14.592 1.00 0.00 H new ATOM 0 HE3 MET A 125 17.713 -8.144 13.967 1.00 0.00 H new ATOM 1928 N GLU A 126 18.296 -1.592 12.069 1.00 0.00 N ATOM 1929 CA GLU A 126 18.674 -0.204 12.249 1.00 0.00 C ATOM 1930 C GLU A 126 17.438 0.639 12.575 1.00 0.00 C ATOM 1931 O GLU A 126 17.499 1.581 13.364 1.00 0.00 O ATOM 1932 CB GLU A 126 19.345 0.261 10.955 1.00 0.00 C ATOM 1933 CG GLU A 126 18.452 1.222 10.165 1.00 0.00 C ATOM 1934 CD GLU A 126 19.112 1.553 8.830 1.00 0.00 C ATOM 1935 OE1 GLU A 126 19.478 0.625 8.127 1.00 0.00 O ATOM 1936 OE2 GLU A 126 19.241 2.728 8.530 1.00 0.00 O ATOM 0 H GLU A 126 17.804 -1.781 11.196 1.00 0.00 H new ATOM 0 HA GLU A 126 19.367 -0.091 13.083 1.00 0.00 H new ATOM 0 HB2 GLU A 126 20.289 0.753 11.191 1.00 0.00 H new ATOM 0 HB3 GLU A 126 19.583 -0.605 10.337 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.474 0.771 9.997 1.00 0.00 H new ATOM 0 HG3 GLU A 126 18.287 2.135 10.737 1.00 0.00 H new ATOM 1943 N ARG A 127 16.328 0.277 11.944 1.00 0.00 N ATOM 1944 CA ARG A 127 15.054 0.967 12.125 1.00 0.00 C ATOM 1945 C ARG A 127 15.247 2.457 12.378 1.00 0.00 C ATOM 1946 O ARG A 127 15.337 2.899 13.523 1.00 0.00 O ATOM 1947 CB ARG A 127 14.282 0.344 13.288 1.00 0.00 C ATOM 1948 CG ARG A 127 12.780 0.633 13.153 1.00 0.00 C ATOM 1949 CD ARG A 127 12.060 -0.638 12.680 1.00 0.00 C ATOM 1950 NE ARG A 127 10.623 -0.397 12.558 1.00 0.00 N ATOM 1951 CZ ARG A 127 9.721 -1.274 13.011 1.00 0.00 C ATOM 1952 NH1 ARG A 127 10.089 -2.461 13.400 1.00 0.00 N ATOM 1953 NH2 ARG A 127 8.457 -0.991 12.928 1.00 0.00 N ATOM 0 H ARG A 127 16.284 -0.505 11.291 1.00 0.00 H new ATOM 0 HA ARG A 127 14.486 0.855 11.202 1.00 0.00 H new ATOM 0 HB2 ARG A 127 14.451 -0.733 13.309 1.00 0.00 H new ATOM 0 HB3 ARG A 127 14.652 0.743 14.233 1.00 0.00 H new ATOM 0 HG2 ARG A 127 12.373 0.961 14.110 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.616 1.443 12.443 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.464 -0.956 11.719 1.00 0.00 H new ATOM 0 HD3 ARG A 127 12.240 -1.449 13.386 1.00 0.00 H new ATOM 0 HE ARG A 127 10.300 0.463 12.115 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.073 -2.728 13.361 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.394 -3.123 13.744 1.00 0.00 H new ATOM 0 HH21 ARG A 127 8.158 -0.105 12.520 1.00 0.00 H new ATOM 0 HH22 ARG A 127 7.762 -1.654 13.271 1.00 0.00 H new ATOM 1967 N VAL A 128 15.290 3.228 11.298 1.00 0.00 N ATOM 1968 CA VAL A 128 15.448 4.671 11.412 1.00 0.00 C ATOM 1969 C VAL A 128 14.158 5.285 11.942 1.00 0.00 C ATOM 1970 O VAL A 128 14.179 6.221 12.743 1.00 0.00 O ATOM 1971 CB VAL A 128 15.770 5.278 10.048 1.00 0.00 C ATOM 1972 CG1 VAL A 128 16.101 6.760 10.214 1.00 0.00 C ATOM 1973 CG2 VAL A 128 16.966 4.557 9.423 1.00 0.00 C ATOM 0 H VAL A 128 15.218 2.881 10.341 1.00 0.00 H new ATOM 0 HA VAL A 128 16.268 4.881 12.099 1.00 0.00 H new ATOM 0 HB VAL A 128 14.904 5.166 9.396 1.00 0.00 H new ATOM 0 HG11 VAL A 128 16.331 7.193 9.240 1.00 0.00 H new ATOM 0 HG12 VAL A 128 15.246 7.277 10.648 1.00 0.00 H new ATOM 0 HG13 VAL A 128 16.963 6.869 10.872 1.00 0.00 H new ATOM 0 HG21 VAL A 128 17.188 4.997 8.451 1.00 0.00 H new ATOM 0 HG22 VAL A 128 17.834 4.660 10.075 1.00 0.00 H new ATOM 0 HG23 VAL A 128 16.729 3.500 9.298 1.00 0.00 H new ATOM 1983 N ILE A 129 13.038 4.737 11.485 1.00 0.00 N ATOM 1984 CA ILE A 129 11.726 5.212 11.903 1.00 0.00 C ATOM 1985 C ILE A 129 11.259 4.461 13.141 1.00 0.00 C ATOM 1986 O ILE A 129 11.691 3.337 13.396 1.00 0.00 O ATOM 1987 CB ILE A 129 10.711 5.042 10.767 1.00 0.00 C ATOM 1988 CG1 ILE A 129 9.788 6.266 10.734 1.00 0.00 C ATOM 1989 CG2 ILE A 129 9.870 3.772 10.981 1.00 0.00 C ATOM 1990 CD1 ILE A 129 10.537 7.476 10.162 1.00 0.00 C ATOM 0 H ILE A 129 13.013 3.961 10.823 1.00 0.00 H new ATOM 0 HA ILE A 129 11.804 6.271 12.147 1.00 0.00 H new ATOM 0 HB ILE A 129 11.246 4.950 9.822 1.00 0.00 H new ATOM 0 HG12 ILE A 129 8.909 6.052 10.126 1.00 0.00 H new ATOM 0 HG13 ILE A 129 9.433 6.491 11.740 1.00 0.00 H new ATOM 0 HG21 ILE A 129 9.155 3.667 10.165 1.00 0.00 H new ATOM 0 HG22 ILE A 129 10.525 2.901 11.003 1.00 0.00 H new ATOM 0 HG23 ILE A 129 9.333 3.846 11.927 1.00 0.00 H new ATOM 0 HD11 ILE A 129 9.872 8.340 10.143 1.00 0.00 H new ATOM 0 HD12 ILE A 129 11.402 7.697 10.787 1.00 0.00 H new ATOM 0 HD13 ILE A 129 10.870 7.252 9.149 1.00 0.00 H new ATOM 2002 N SER A 130 10.378 5.087 13.901 1.00 0.00 N ATOM 2003 CA SER A 130 9.857 4.462 15.113 1.00 0.00 C ATOM 2004 C SER A 130 8.448 3.925 14.887 1.00 0.00 C ATOM 2005 O SER A 130 7.552 4.663 14.477 1.00 0.00 O ATOM 2006 CB SER A 130 9.843 5.469 16.262 1.00 0.00 C ATOM 2007 OG SER A 130 9.084 6.607 15.882 1.00 0.00 O ATOM 0 H SER A 130 10.009 6.018 13.707 1.00 0.00 H new ATOM 0 HA SER A 130 10.511 3.628 15.370 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.414 5.013 17.154 1.00 0.00 H new ATOM 0 HB3 SER A 130 10.862 5.765 16.513 1.00 0.00 H new ATOM 0 HG SER A 130 9.394 6.931 15.011 1.00 0.00 H new ATOM 2013 N TYR A 131 8.267 2.637 15.177 1.00 0.00 N ATOM 2014 CA TYR A 131 6.964 1.988 15.028 1.00 0.00 C ATOM 2015 C TYR A 131 5.862 2.958 15.431 1.00 0.00 C ATOM 2016 O TYR A 131 4.782 2.983 14.845 1.00 0.00 O ATOM 2017 CB TYR A 131 6.915 0.759 15.948 1.00 0.00 C ATOM 2018 CG TYR A 131 6.132 -0.373 15.310 1.00 0.00 C ATOM 2019 CD1 TYR A 131 4.778 -0.203 14.990 1.00 0.00 C ATOM 2020 CD2 TYR A 131 6.758 -1.602 15.061 1.00 0.00 C ATOM 2021 CE1 TYR A 131 4.055 -1.259 14.422 1.00 0.00 C ATOM 2022 CE2 TYR A 131 6.033 -2.655 14.490 1.00 0.00 C ATOM 2023 CZ TYR A 131 4.682 -2.484 14.172 1.00 0.00 C ATOM 2024 OH TYR A 131 3.968 -3.524 13.612 1.00 0.00 O ATOM 0 H TYR A 131 9.006 2.022 15.517 1.00 0.00 H new ATOM 0 HA TYR A 131 6.819 1.687 13.991 1.00 0.00 H new ATOM 0 HB2 TYR A 131 7.929 0.425 16.167 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.457 1.031 16.899 1.00 0.00 H new ATOM 0 HD1 TYR A 131 4.292 0.742 15.182 1.00 0.00 H new ATOM 0 HD2 TYR A 131 7.800 -1.737 15.310 1.00 0.00 H new ATOM 0 HE1 TYR A 131 3.012 -1.127 14.177 1.00 0.00 H new ATOM 0 HE2 TYR A 131 6.518 -3.600 14.295 1.00 0.00 H new ATOM 0 HH TYR A 131 4.554 -4.302 13.504 1.00 0.00 H new ATOM 2034 N GLU A 132 6.170 3.757 16.438 1.00 0.00 N ATOM 2035 CA GLU A 132 5.237 4.748 16.955 1.00 0.00 C ATOM 2036 C GLU A 132 4.983 5.843 15.934 1.00 0.00 C ATOM 2037 O GLU A 132 3.866 5.998 15.443 1.00 0.00 O ATOM 2038 CB GLU A 132 5.813 5.356 18.220 1.00 0.00 C ATOM 2039 CG GLU A 132 6.035 4.249 19.237 1.00 0.00 C ATOM 2040 CD GLU A 132 7.510 4.170 19.606 1.00 0.00 C ATOM 2041 OE1 GLU A 132 8.284 3.739 18.766 1.00 0.00 O ATOM 2042 OE2 GLU A 132 7.846 4.540 20.719 1.00 0.00 O ATOM 0 H GLU A 132 7.069 3.739 16.920 1.00 0.00 H new ATOM 0 HA GLU A 132 4.288 4.257 17.170 1.00 0.00 H new ATOM 0 HB2 GLU A 132 6.753 5.862 18.001 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.133 6.107 18.622 1.00 0.00 H new ATOM 0 HG2 GLU A 132 5.438 4.438 20.129 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.702 3.295 18.827 1.00 0.00 H new ATOM 2049 N GLU A 133 6.028 6.601 15.619 1.00 0.00 N ATOM 2050 CA GLU A 133 5.906 7.680 14.653 1.00 0.00 C ATOM 2051 C GLU A 133 5.045 7.234 13.482 1.00 0.00 C ATOM 2052 O GLU A 133 4.206 7.989 13.002 1.00 0.00 O ATOM 2053 CB GLU A 133 7.283 8.090 14.146 1.00 0.00 C ATOM 2054 CG GLU A 133 7.974 8.972 15.190 1.00 0.00 C ATOM 2055 CD GLU A 133 9.475 9.038 14.916 1.00 0.00 C ATOM 2056 OE1 GLU A 133 9.990 8.118 14.298 1.00 0.00 O ATOM 2057 OE2 GLU A 133 10.089 10.008 15.329 1.00 0.00 O ATOM 0 H GLU A 133 6.961 6.488 16.016 1.00 0.00 H new ATOM 0 HA GLU A 133 5.437 8.534 15.141 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.887 7.205 13.947 1.00 0.00 H new ATOM 0 HB3 GLU A 133 7.189 8.630 13.204 1.00 0.00 H new ATOM 0 HG2 GLU A 133 7.549 9.975 15.168 1.00 0.00 H new ATOM 0 HG3 GLU A 133 7.797 8.573 16.189 1.00 0.00 H new ATOM 2064 N GLY A 134 5.255 5.998 13.038 1.00 0.00 N ATOM 2065 CA GLY A 134 4.498 5.451 11.935 1.00 0.00 C ATOM 2066 C GLY A 134 3.068 5.186 12.355 1.00 0.00 C ATOM 2067 O GLY A 134 2.128 5.371 11.581 1.00 0.00 O ATOM 0 H GLY A 134 5.947 5.361 13.432 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.514 6.145 11.095 1.00 0.00 H new ATOM 0 HA3 GLY A 134 4.960 4.525 11.592 1.00 0.00 H new ATOM 2071 N LYS A 135 2.920 4.761 13.593 1.00 0.00 N ATOM 2072 CA LYS A 135 1.604 4.476 14.139 1.00 0.00 C ATOM 2073 C LYS A 135 0.766 5.744 14.137 1.00 0.00 C ATOM 2074 O LYS A 135 -0.325 5.771 13.578 1.00 0.00 O ATOM 2075 CB LYS A 135 1.724 3.944 15.569 1.00 0.00 C ATOM 2076 CG LYS A 135 0.491 3.102 15.906 1.00 0.00 C ATOM 2077 CD LYS A 135 0.262 3.109 17.419 1.00 0.00 C ATOM 2078 CE LYS A 135 -0.678 4.258 17.787 1.00 0.00 C ATOM 2079 NZ LYS A 135 -2.090 3.815 17.621 1.00 0.00 N ATOM 0 H LYS A 135 3.692 4.605 14.241 1.00 0.00 H new ATOM 0 HA LYS A 135 1.124 3.718 13.520 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.627 3.342 15.670 1.00 0.00 H new ATOM 0 HB3 LYS A 135 1.814 4.773 16.271 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -0.385 3.500 15.394 1.00 0.00 H new ATOM 0 HG3 LYS A 135 0.629 2.080 15.554 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -0.166 2.158 17.737 1.00 0.00 H new ATOM 0 HD3 LYS A 135 1.212 3.221 17.941 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -0.502 4.571 18.816 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.480 5.122 17.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -2.730 4.595 17.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -2.253 3.537 16.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -2.275 3.003 18.244 1.00 0.00 H new ATOM 2093 N ALA A 136 1.294 6.792 14.763 1.00 0.00 N ATOM 2094 CA ALA A 136 0.592 8.069 14.833 1.00 0.00 C ATOM 2095 C ALA A 136 0.267 8.588 13.435 1.00 0.00 C ATOM 2096 O ALA A 136 -0.793 9.174 13.214 1.00 0.00 O ATOM 2097 CB ALA A 136 1.458 9.095 15.565 1.00 0.00 C ATOM 0 H ALA A 136 2.202 6.782 15.227 1.00 0.00 H new ATOM 0 HA ALA A 136 -0.341 7.917 15.376 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.930 10.047 15.615 1.00 0.00 H new ATOM 0 HB2 ALA A 136 1.665 8.742 16.575 1.00 0.00 H new ATOM 0 HB3 ALA A 136 2.397 9.228 15.027 1.00 0.00 H new ATOM 2103 N LEU A 137 1.176 8.363 12.493 1.00 0.00 N ATOM 2104 CA LEU A 137 0.977 8.800 11.132 1.00 0.00 C ATOM 2105 C LEU A 137 -0.183 8.033 10.513 1.00 0.00 C ATOM 2106 O LEU A 137 -1.195 8.617 10.119 1.00 0.00 O ATOM 2107 CB LEU A 137 2.271 8.519 10.378 1.00 0.00 C ATOM 2108 CG LEU A 137 2.624 9.672 9.432 1.00 0.00 C ATOM 2109 CD1 LEU A 137 3.982 9.406 8.781 1.00 0.00 C ATOM 2110 CD2 LEU A 137 1.562 9.780 8.356 1.00 0.00 C ATOM 0 H LEU A 137 2.058 7.878 12.656 1.00 0.00 H new ATOM 0 HA LEU A 137 0.736 9.862 11.087 1.00 0.00 H new ATOM 0 HB2 LEU A 137 3.083 8.367 11.089 1.00 0.00 H new ATOM 0 HB3 LEU A 137 2.169 7.596 9.808 1.00 0.00 H new ATOM 0 HG LEU A 137 2.671 10.603 9.997 1.00 0.00 H new ATOM 0 HD11 LEU A 137 4.230 10.227 8.109 1.00 0.00 H new ATOM 0 HD12 LEU A 137 4.746 9.326 9.554 1.00 0.00 H new ATOM 0 HD13 LEU A 137 3.938 8.475 8.216 1.00 0.00 H new ATOM 0 HD21 LEU A 137 1.810 10.599 7.681 1.00 0.00 H new ATOM 0 HD22 LEU A 137 1.518 8.847 7.794 1.00 0.00 H new ATOM 0 HD23 LEU A 137 0.594 9.971 8.818 1.00 0.00 H new ATOM 2122 N ALA A 138 -0.024 6.722 10.430 1.00 0.00 N ATOM 2123 CA ALA A 138 -1.059 5.880 9.858 1.00 0.00 C ATOM 2124 C ALA A 138 -2.396 6.138 10.550 1.00 0.00 C ATOM 2125 O ALA A 138 -3.444 6.117 9.912 1.00 0.00 O ATOM 2126 CB ALA A 138 -0.670 4.402 9.983 1.00 0.00 C ATOM 0 H ALA A 138 0.806 6.222 10.749 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.163 6.125 8.801 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.455 3.781 9.550 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.266 4.226 9.453 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -0.544 4.147 11.035 1.00 0.00 H new ATOM 2132 N GLU A 139 -2.357 6.401 11.853 1.00 0.00 N ATOM 2133 CA GLU A 139 -3.576 6.677 12.593 1.00 0.00 C ATOM 2134 C GLU A 139 -4.158 8.021 12.158 1.00 0.00 C ATOM 2135 O GLU A 139 -5.371 8.228 12.205 1.00 0.00 O ATOM 2136 CB GLU A 139 -3.275 6.671 14.101 1.00 0.00 C ATOM 2137 CG GLU A 139 -4.094 7.740 14.814 1.00 0.00 C ATOM 2138 CD GLU A 139 -4.013 7.533 16.324 1.00 0.00 C ATOM 2139 OE1 GLU A 139 -4.841 6.807 16.848 1.00 0.00 O ATOM 2140 OE2 GLU A 139 -3.123 8.102 16.933 1.00 0.00 O ATOM 0 H GLU A 139 -1.503 6.428 12.410 1.00 0.00 H new ATOM 0 HA GLU A 139 -4.314 5.903 12.383 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.503 5.691 14.519 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -2.212 6.848 14.266 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.721 8.731 14.553 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -5.133 7.694 14.487 1.00 0.00 H new ATOM 2147 N SER A 140 -3.282 8.934 11.745 1.00 0.00 N ATOM 2148 CA SER A 140 -3.719 10.258 11.316 1.00 0.00 C ATOM 2149 C SER A 140 -4.585 10.161 10.065 1.00 0.00 C ATOM 2150 O SER A 140 -5.651 10.771 9.990 1.00 0.00 O ATOM 2151 CB SER A 140 -2.504 11.140 11.028 1.00 0.00 C ATOM 2152 OG SER A 140 -2.325 11.247 9.621 1.00 0.00 O ATOM 0 H SER A 140 -2.274 8.783 11.699 1.00 0.00 H new ATOM 0 HA SER A 140 -4.310 10.700 12.118 1.00 0.00 H new ATOM 0 HB2 SER A 140 -2.646 12.129 11.465 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.613 10.713 11.488 1.00 0.00 H new ATOM 0 HG SER A 140 -1.880 10.441 9.286 1.00 0.00 H new ATOM 2158 N TRP A 141 -4.128 9.384 9.089 1.00 0.00 N ATOM 2159 CA TRP A 141 -4.886 9.213 7.854 1.00 0.00 C ATOM 2160 C TRP A 141 -5.850 8.043 7.987 1.00 0.00 C ATOM 2161 O TRP A 141 -6.634 7.760 7.080 1.00 0.00 O ATOM 2162 CB TRP A 141 -3.941 8.950 6.680 1.00 0.00 C ATOM 2163 CG TRP A 141 -2.797 9.915 6.703 1.00 0.00 C ATOM 2164 CD1 TRP A 141 -1.494 9.565 6.806 1.00 0.00 C ATOM 2165 CD2 TRP A 141 -2.822 11.373 6.615 1.00 0.00 C ATOM 2166 NE1 TRP A 141 -0.719 10.709 6.788 1.00 0.00 N ATOM 2167 CE2 TRP A 141 -1.489 11.849 6.672 1.00 0.00 C ATOM 2168 CE3 TRP A 141 -3.856 12.321 6.492 1.00 0.00 C ATOM 2169 CZ2 TRP A 141 -1.194 13.211 6.611 1.00 0.00 C ATOM 2170 CZ3 TRP A 141 -3.562 13.693 6.431 1.00 0.00 C ATOM 2171 CH2 TRP A 141 -2.233 14.137 6.490 1.00 0.00 C ATOM 0 H TRP A 141 -3.249 8.869 9.127 1.00 0.00 H new ATOM 0 HA TRP A 141 -5.446 10.129 7.669 1.00 0.00 H new ATOM 0 HB2 TRP A 141 -3.564 7.928 6.730 1.00 0.00 H new ATOM 0 HB3 TRP A 141 -4.485 9.043 5.740 1.00 0.00 H new ATOM 0 HD1 TRP A 141 -1.120 8.555 6.889 1.00 0.00 H new ATOM 0 HE1 TRP A 141 0.299 10.711 6.853 1.00 0.00 H new ATOM 0 HE3 TRP A 141 -4.883 11.990 6.444 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 -0.169 13.548 6.657 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 -4.364 14.410 6.338 1.00 0.00 H new ATOM 0 HH2 TRP A 141 -2.013 15.193 6.442 1.00 0.00 H new ATOM 2182 N ASN A 142 -5.772 7.356 9.119 1.00 0.00 N ATOM 2183 CA ASN A 142 -6.623 6.199 9.370 1.00 0.00 C ATOM 2184 C ASN A 142 -6.098 5.006 8.586 1.00 0.00 C ATOM 2185 O ASN A 142 -6.824 4.052 8.307 1.00 0.00 O ATOM 2186 CB ASN A 142 -8.074 6.487 8.972 1.00 0.00 C ATOM 2187 CG ASN A 142 -9.017 5.921 10.028 1.00 0.00 C ATOM 2188 OD1 ASN A 142 -9.956 5.195 9.699 1.00 0.00 O ATOM 2189 ND2 ASN A 142 -8.821 6.212 11.286 1.00 0.00 N ATOM 0 H ASN A 142 -5.128 7.579 9.878 1.00 0.00 H new ATOM 0 HA ASN A 142 -6.602 5.977 10.437 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -8.228 7.561 8.871 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -8.290 6.042 8.001 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -9.446 5.838 11.999 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -8.042 6.814 11.555 1.00 0.00 H new ATOM 2196 N ALA A 143 -4.817 5.075 8.248 1.00 0.00 N ATOM 2197 CA ALA A 143 -4.157 4.017 7.511 1.00 0.00 C ATOM 2198 C ALA A 143 -3.584 3.007 8.478 1.00 0.00 C ATOM 2199 O ALA A 143 -3.573 3.233 9.688 1.00 0.00 O ATOM 2200 CB ALA A 143 -3.028 4.605 6.669 1.00 0.00 C ATOM 0 H ALA A 143 -4.213 5.864 8.478 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.881 3.529 6.859 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -2.533 3.807 6.116 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -3.438 5.332 5.968 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -2.306 5.096 7.321 1.00 0.00 H new ATOM 2206 N ALA A 144 -3.117 1.894 7.941 1.00 0.00 N ATOM 2207 CA ALA A 144 -2.545 0.846 8.778 1.00 0.00 C ATOM 2208 C ALA A 144 -1.032 0.745 8.590 1.00 0.00 C ATOM 2209 O ALA A 144 -0.529 0.773 7.468 1.00 0.00 O ATOM 2210 CB ALA A 144 -3.207 -0.479 8.456 1.00 0.00 C ATOM 0 H ALA A 144 -3.120 1.690 6.942 1.00 0.00 H new ATOM 0 HA ALA A 144 -2.730 1.100 9.822 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -2.779 -1.261 9.082 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.278 -0.407 8.647 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.041 -0.723 7.407 1.00 0.00 H new ATOM 2216 N PHE A 145 -0.316 0.641 9.706 1.00 0.00 N ATOM 2217 CA PHE A 145 1.138 0.555 9.688 1.00 0.00 C ATOM 2218 C PHE A 145 1.574 -0.906 9.770 1.00 0.00 C ATOM 2219 O PHE A 145 1.179 -1.642 10.675 1.00 0.00 O ATOM 2220 CB PHE A 145 1.674 1.357 10.880 1.00 0.00 C ATOM 2221 CG PHE A 145 3.162 1.167 11.050 1.00 0.00 C ATOM 2222 CD1 PHE A 145 3.680 -0.027 11.570 1.00 0.00 C ATOM 2223 CD2 PHE A 145 4.022 2.206 10.701 1.00 0.00 C ATOM 2224 CE1 PHE A 145 5.060 -0.174 11.731 1.00 0.00 C ATOM 2225 CE2 PHE A 145 5.406 2.060 10.867 1.00 0.00 C ATOM 2226 CZ PHE A 145 5.923 0.867 11.376 1.00 0.00 C ATOM 0 H PHE A 145 -0.725 0.614 10.640 1.00 0.00 H new ATOM 0 HA PHE A 145 1.537 0.967 8.761 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.455 2.415 10.736 1.00 0.00 H new ATOM 0 HB3 PHE A 145 1.160 1.046 11.790 1.00 0.00 H new ATOM 0 HD1 PHE A 145 3.014 -0.831 11.846 1.00 0.00 H new ATOM 0 HD2 PHE A 145 3.621 3.126 10.302 1.00 0.00 H new ATOM 0 HE1 PHE A 145 5.461 -1.094 12.131 1.00 0.00 H new ATOM 0 HE2 PHE A 145 6.071 2.868 10.602 1.00 0.00 H new ATOM 0 HZ PHE A 145 6.990 0.748 11.495 1.00 0.00 H new ATOM 2236 N LEU A 146 2.339 -1.326 8.761 1.00 0.00 N ATOM 2237 CA LEU A 146 2.797 -2.702 8.618 1.00 0.00 C ATOM 2238 C LEU A 146 4.286 -2.734 8.296 1.00 0.00 C ATOM 2239 O LEU A 146 4.744 -1.944 7.497 1.00 0.00 O ATOM 2240 CB LEU A 146 2.030 -3.335 7.460 1.00 0.00 C ATOM 2241 CG LEU A 146 1.001 -4.339 7.968 1.00 0.00 C ATOM 2242 CD1 LEU A 146 1.694 -5.532 8.593 1.00 0.00 C ATOM 2243 CD2 LEU A 146 0.104 -3.672 8.983 1.00 0.00 C ATOM 0 H LEU A 146 2.660 -0.710 8.014 1.00 0.00 H new ATOM 0 HA LEU A 146 2.626 -3.244 9.548 1.00 0.00 H new ATOM 0 HB2 LEU A 146 1.530 -2.557 6.883 1.00 0.00 H new ATOM 0 HB3 LEU A 146 2.728 -3.833 6.787 1.00 0.00 H new ATOM 0 HG LEU A 146 0.400 -4.688 7.128 1.00 0.00 H new ATOM 0 HD11 LEU A 146 0.947 -6.240 8.951 1.00 0.00 H new ATOM 0 HD12 LEU A 146 2.326 -6.017 7.849 1.00 0.00 H new ATOM 0 HD13 LEU A 146 2.308 -5.199 9.429 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.632 -4.390 9.346 1.00 0.00 H new ATOM 0 HD22 LEU A 146 0.704 -3.313 9.819 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.409 -2.831 8.518 1.00 0.00 H new ATOM 2255 N GLU A 147 5.032 -3.642 8.917 1.00 0.00 N ATOM 2256 CA GLU A 147 6.474 -3.753 8.650 1.00 0.00 C ATOM 2257 C GLU A 147 6.812 -5.195 8.293 1.00 0.00 C ATOM 2258 O GLU A 147 6.735 -6.091 9.134 1.00 0.00 O ATOM 2259 CB GLU A 147 7.283 -3.305 9.876 1.00 0.00 C ATOM 2260 CG GLU A 147 8.785 -3.342 9.558 1.00 0.00 C ATOM 2261 CD GLU A 147 9.523 -2.256 10.344 1.00 0.00 C ATOM 2262 OE1 GLU A 147 9.018 -1.140 10.402 1.00 0.00 O ATOM 2263 OE2 GLU A 147 10.584 -2.557 10.880 1.00 0.00 O ATOM 0 H GLU A 147 4.674 -4.307 9.602 1.00 0.00 H new ATOM 0 HA GLU A 147 6.734 -3.104 7.814 1.00 0.00 H new ATOM 0 HB2 GLU A 147 6.989 -2.296 10.167 1.00 0.00 H new ATOM 0 HB3 GLU A 147 7.066 -3.956 10.723 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.192 -4.322 9.808 1.00 0.00 H new ATOM 0 HG3 GLU A 147 8.941 -3.196 8.489 1.00 0.00 H new ATOM 2270 N SER A 148 7.163 -5.411 7.029 1.00 0.00 N ATOM 2271 CA SER A 148 7.486 -6.748 6.551 1.00 0.00 C ATOM 2272 C SER A 148 8.725 -6.732 5.664 1.00 0.00 C ATOM 2273 O SER A 148 9.401 -5.712 5.544 1.00 0.00 O ATOM 2274 CB SER A 148 6.302 -7.289 5.749 1.00 0.00 C ATOM 2275 OG SER A 148 5.954 -6.351 4.740 1.00 0.00 O ATOM 0 H SER A 148 7.230 -4.680 6.321 1.00 0.00 H new ATOM 0 HA SER A 148 7.689 -7.384 7.413 1.00 0.00 H new ATOM 0 HB2 SER A 148 6.560 -8.247 5.298 1.00 0.00 H new ATOM 0 HB3 SER A 148 5.451 -7.465 6.407 1.00 0.00 H new ATOM 0 HG SER A 148 5.580 -6.825 3.968 1.00 0.00 H new ATOM 2281 N SER A 149 9.024 -7.875 5.053 1.00 0.00 N ATOM 2282 CA SER A 149 10.189 -7.982 4.177 1.00 0.00 C ATOM 2283 C SER A 149 9.847 -8.775 2.918 1.00 0.00 C ATOM 2284 O SER A 149 9.142 -9.783 2.986 1.00 0.00 O ATOM 2285 CB SER A 149 11.336 -8.668 4.920 1.00 0.00 C ATOM 2286 OG SER A 149 10.844 -9.223 6.133 1.00 0.00 O ATOM 0 H SER A 149 8.482 -8.734 5.146 1.00 0.00 H new ATOM 0 HA SER A 149 10.493 -6.977 3.884 1.00 0.00 H new ATOM 0 HB2 SER A 149 11.771 -9.451 4.298 1.00 0.00 H new ATOM 0 HB3 SER A 149 12.129 -7.951 5.130 1.00 0.00 H new ATOM 0 HG SER A 149 11.530 -9.798 6.532 1.00 0.00 H new ATOM 2292 N ALA A 150 10.354 -8.327 1.769 1.00 0.00 N ATOM 2293 CA ALA A 150 10.097 -9.016 0.519 1.00 0.00 C ATOM 2294 C ALA A 150 10.724 -10.396 0.550 1.00 0.00 C ATOM 2295 O ALA A 150 10.231 -11.333 -0.067 1.00 0.00 O ATOM 2296 CB ALA A 150 10.692 -8.225 -0.630 1.00 0.00 C ATOM 0 H ALA A 150 10.940 -7.496 1.685 1.00 0.00 H new ATOM 0 HA ALA A 150 9.020 -9.111 0.382 1.00 0.00 H new ATOM 0 HB1 ALA A 150 10.498 -8.744 -1.568 1.00 0.00 H new ATOM 0 HB2 ALA A 150 10.239 -7.234 -0.663 1.00 0.00 H new ATOM 0 HB3 ALA A 150 11.768 -8.127 -0.486 1.00 0.00 H new ATOM 2302 N LYS A 151 11.824 -10.505 1.273 1.00 0.00 N ATOM 2303 CA LYS A 151 12.521 -11.778 1.392 1.00 0.00 C ATOM 2304 C LYS A 151 11.820 -12.664 2.419 1.00 0.00 C ATOM 2305 O LYS A 151 12.370 -13.671 2.864 1.00 0.00 O ATOM 2306 CB LYS A 151 13.972 -11.550 1.820 1.00 0.00 C ATOM 2307 CG LYS A 151 14.838 -12.701 1.304 1.00 0.00 C ATOM 2308 CD LYS A 151 16.190 -12.686 2.016 1.00 0.00 C ATOM 2309 CE LYS A 151 17.079 -13.794 1.447 1.00 0.00 C ATOM 2310 NZ LYS A 151 17.816 -14.459 2.558 1.00 0.00 N ATOM 0 H LYS A 151 12.254 -9.734 1.785 1.00 0.00 H new ATOM 0 HA LYS A 151 12.509 -12.272 0.421 1.00 0.00 H new ATOM 0 HB2 LYS A 151 14.335 -10.601 1.425 1.00 0.00 H new ATOM 0 HB3 LYS A 151 14.038 -11.489 2.906 1.00 0.00 H new ATOM 0 HG2 LYS A 151 14.336 -13.653 1.477 1.00 0.00 H new ATOM 0 HG3 LYS A 151 14.982 -12.607 0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 151 16.671 -11.716 1.886 1.00 0.00 H new ATOM 0 HD3 LYS A 151 16.050 -12.831 3.087 1.00 0.00 H new ATOM 0 HE2 LYS A 151 16.471 -14.523 0.911 1.00 0.00 H new ATOM 0 HE3 LYS A 151 17.783 -13.376 0.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 18.420 -15.212 2.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 18.407 -13.759 3.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 17.136 -14.871 3.228 1.00 0.00 H new ATOM 2324 N GLU A 152 10.602 -12.275 2.792 1.00 0.00 N ATOM 2325 CA GLU A 152 9.831 -13.036 3.773 1.00 0.00 C ATOM 2326 C GLU A 152 8.342 -13.012 3.428 1.00 0.00 C ATOM 2327 O GLU A 152 7.731 -11.946 3.343 1.00 0.00 O ATOM 2328 CB GLU A 152 10.045 -12.445 5.167 1.00 0.00 C ATOM 2329 CG GLU A 152 10.111 -13.575 6.196 1.00 0.00 C ATOM 2330 CD GLU A 152 10.153 -12.993 7.605 1.00 0.00 C ATOM 2331 OE1 GLU A 152 10.833 -11.998 7.794 1.00 0.00 O ATOM 2332 OE2 GLU A 152 9.504 -13.552 8.475 1.00 0.00 O ATOM 0 H GLU A 152 10.131 -11.444 2.433 1.00 0.00 H new ATOM 0 HA GLU A 152 10.175 -14.070 3.757 1.00 0.00 H new ATOM 0 HB2 GLU A 152 10.967 -11.864 5.190 1.00 0.00 H new ATOM 0 HB3 GLU A 152 9.232 -11.762 5.413 1.00 0.00 H new ATOM 0 HG2 GLU A 152 9.244 -14.227 6.088 1.00 0.00 H new ATOM 0 HG3 GLU A 152 10.995 -14.188 6.020 1.00 0.00 H new ATOM 2339 N ASN A 153 7.767 -14.195 3.226 1.00 0.00 N ATOM 2340 CA ASN A 153 6.351 -14.306 2.885 1.00 0.00 C ATOM 2341 C ASN A 153 5.468 -14.120 4.111 1.00 0.00 C ATOM 2342 O ASN A 153 4.568 -13.280 4.111 1.00 0.00 O ATOM 2343 CB ASN A 153 6.072 -15.672 2.259 1.00 0.00 C ATOM 2344 CG ASN A 153 4.716 -15.662 1.562 1.00 0.00 C ATOM 2345 OD1 ASN A 153 4.479 -14.784 0.627 1.00 0.00 O flip ATOM 2346 ND2 ASN A 153 3.849 -16.478 1.877 1.00 0.00 N flip ATOM 0 H ASN A 153 8.257 -15.087 3.292 1.00 0.00 H new ATOM 0 HA ASN A 153 6.116 -13.517 2.171 1.00 0.00 H new ATOM 0 HB2 ASN A 153 6.856 -15.919 1.543 1.00 0.00 H new ATOM 0 HB3 ASN A 153 6.088 -16.444 3.029 1.00 0.00 H new ATOM 0 HD21 ASN A 153 4.036 -17.164 2.608 1.00 0.00 H new ATOM 0 HD22 ASN A 153 2.944 -16.468 1.406 1.00 0.00 H new ATOM 2353 N GLN A 154 5.724 -14.914 5.147 1.00 0.00 N ATOM 2354 CA GLN A 154 4.942 -14.836 6.377 1.00 0.00 C ATOM 2355 C GLN A 154 4.572 -13.392 6.693 1.00 0.00 C ATOM 2356 O GLN A 154 3.399 -13.064 6.861 1.00 0.00 O ATOM 2357 CB GLN A 154 5.745 -15.437 7.538 1.00 0.00 C ATOM 2358 CG GLN A 154 5.350 -14.765 8.856 1.00 0.00 C ATOM 2359 CD GLN A 154 5.831 -15.609 10.033 1.00 0.00 C ATOM 2360 OE1 GLN A 154 6.965 -16.085 10.033 1.00 0.00 O ATOM 2361 NE2 GLN A 154 5.029 -15.824 11.041 1.00 0.00 N ATOM 0 H GLN A 154 6.464 -15.616 5.160 1.00 0.00 H new ATOM 0 HA GLN A 154 4.021 -15.403 6.240 1.00 0.00 H new ATOM 0 HB2 GLN A 154 5.563 -16.510 7.599 1.00 0.00 H new ATOM 0 HB3 GLN A 154 6.812 -15.305 7.359 1.00 0.00 H new ATOM 0 HG2 GLN A 154 5.785 -13.767 8.911 1.00 0.00 H new ATOM 0 HG3 GLN A 154 4.268 -14.643 8.902 1.00 0.00 H new ATOM 0 HE21 GLN A 154 4.089 -15.428 11.038 1.00 0.00 H new ATOM 0 HE22 GLN A 154 5.343 -16.388 11.831 1.00 0.00 H new ATOM 2370 N THR A 155 5.577 -12.533 6.776 1.00 0.00 N ATOM 2371 CA THR A 155 5.331 -11.132 7.075 1.00 0.00 C ATOM 2372 C THR A 155 4.374 -10.535 6.047 1.00 0.00 C ATOM 2373 O THR A 155 3.362 -9.920 6.395 1.00 0.00 O ATOM 2374 CB THR A 155 6.646 -10.355 7.068 1.00 0.00 C ATOM 2375 OG1 THR A 155 7.226 -10.411 5.772 1.00 0.00 O ATOM 2376 CG2 THR A 155 7.607 -10.959 8.083 1.00 0.00 C ATOM 0 H THR A 155 6.558 -12.778 6.642 1.00 0.00 H new ATOM 0 HA THR A 155 4.880 -11.060 8.065 1.00 0.00 H new ATOM 0 HB THR A 155 6.450 -9.316 7.333 1.00 0.00 H new ATOM 0 HG1 THR A 155 7.181 -11.329 5.433 1.00 0.00 H new ATOM 0 HG21 THR A 155 8.543 -10.401 8.074 1.00 0.00 H new ATOM 0 HG22 THR A 155 7.164 -10.909 9.078 1.00 0.00 H new ATOM 0 HG23 THR A 155 7.802 -12.000 7.825 1.00 0.00 H new ATOM 2384 N ALA A 156 4.694 -10.738 4.773 1.00 0.00 N ATOM 2385 CA ALA A 156 3.857 -10.237 3.694 1.00 0.00 C ATOM 2386 C ALA A 156 2.410 -10.591 3.968 1.00 0.00 C ATOM 2387 O ALA A 156 1.548 -9.723 4.096 1.00 0.00 O ATOM 2388 CB ALA A 156 4.284 -10.877 2.380 1.00 0.00 C ATOM 0 H ALA A 156 5.524 -11.244 4.465 1.00 0.00 H new ATOM 0 HA ALA A 156 3.965 -9.154 3.629 1.00 0.00 H new ATOM 0 HB1 ALA A 156 3.657 -10.501 1.572 1.00 0.00 H new ATOM 0 HB2 ALA A 156 5.326 -10.629 2.176 1.00 0.00 H new ATOM 0 HB3 ALA A 156 4.176 -11.959 2.450 1.00 0.00 H new ATOM 2394 N VAL A 157 2.164 -11.885 4.069 1.00 0.00 N ATOM 2395 CA VAL A 157 0.824 -12.380 4.347 1.00 0.00 C ATOM 2396 C VAL A 157 0.162 -11.501 5.404 1.00 0.00 C ATOM 2397 O VAL A 157 -0.936 -10.986 5.207 1.00 0.00 O ATOM 2398 CB VAL A 157 0.911 -13.825 4.846 1.00 0.00 C ATOM 2399 CG1 VAL A 157 -0.487 -14.371 5.147 1.00 0.00 C ATOM 2400 CG2 VAL A 157 1.570 -14.687 3.769 1.00 0.00 C ATOM 0 H VAL A 157 2.872 -12.612 3.963 1.00 0.00 H new ATOM 0 HA VAL A 157 0.226 -12.350 3.436 1.00 0.00 H new ATOM 0 HB VAL A 157 1.503 -13.850 5.761 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -0.408 -15.399 5.501 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -0.959 -13.758 5.915 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -1.091 -14.345 4.240 1.00 0.00 H new ATOM 0 HG21 VAL A 157 1.635 -15.718 4.117 1.00 0.00 H new ATOM 0 HG22 VAL A 157 0.974 -14.649 2.857 1.00 0.00 H new ATOM 0 HG23 VAL A 157 2.572 -14.309 3.563 1.00 0.00 H new ATOM 2410 N ASP A 158 0.847 -11.330 6.520 1.00 0.00 N ATOM 2411 CA ASP A 158 0.327 -10.510 7.606 1.00 0.00 C ATOM 2412 C ASP A 158 -0.160 -9.162 7.080 1.00 0.00 C ATOM 2413 O ASP A 158 -1.110 -8.585 7.610 1.00 0.00 O ATOM 2414 CB ASP A 158 1.418 -10.285 8.655 1.00 0.00 C ATOM 2415 CG ASP A 158 0.794 -10.173 10.042 1.00 0.00 C ATOM 2416 OD1 ASP A 158 0.126 -11.110 10.446 1.00 0.00 O ATOM 2417 OD2 ASP A 158 0.993 -9.152 10.679 1.00 0.00 O ATOM 0 H ASP A 158 1.761 -11.745 6.701 1.00 0.00 H new ATOM 0 HA ASP A 158 -0.515 -11.034 8.059 1.00 0.00 H new ATOM 0 HB2 ASP A 158 2.130 -11.110 8.633 1.00 0.00 H new ATOM 0 HB3 ASP A 158 1.975 -9.377 8.423 1.00 0.00 H new ATOM 2422 N VAL A 159 0.507 -8.658 6.044 1.00 0.00 N ATOM 2423 CA VAL A 159 0.155 -7.378 5.467 1.00 0.00 C ATOM 2424 C VAL A 159 -1.103 -7.505 4.598 1.00 0.00 C ATOM 2425 O VAL A 159 -1.868 -6.552 4.450 1.00 0.00 O ATOM 2426 CB VAL A 159 1.348 -6.850 4.645 1.00 0.00 C ATOM 2427 CG1 VAL A 159 1.119 -5.394 4.295 1.00 0.00 C ATOM 2428 CG2 VAL A 159 2.652 -6.943 5.452 1.00 0.00 C ATOM 0 H VAL A 159 1.294 -9.123 5.592 1.00 0.00 H new ATOM 0 HA VAL A 159 -0.069 -6.668 6.263 1.00 0.00 H new ATOM 0 HB VAL A 159 1.431 -7.458 3.744 1.00 0.00 H new ATOM 0 HG11 VAL A 159 1.963 -5.022 3.714 1.00 0.00 H new ATOM 0 HG12 VAL A 159 0.205 -5.300 3.708 1.00 0.00 H new ATOM 0 HG13 VAL A 159 1.024 -4.810 5.211 1.00 0.00 H new ATOM 0 HG21 VAL A 159 3.479 -6.565 4.851 1.00 0.00 H new ATOM 0 HG22 VAL A 159 2.561 -6.347 6.360 1.00 0.00 H new ATOM 0 HG23 VAL A 159 2.842 -7.983 5.718 1.00 0.00 H new ATOM 2438 N PHE A 160 -1.307 -8.691 4.037 1.00 0.00 N ATOM 2439 CA PHE A 160 -2.475 -8.959 3.186 1.00 0.00 C ATOM 2440 C PHE A 160 -3.773 -8.959 3.991 1.00 0.00 C ATOM 2441 O PHE A 160 -4.806 -8.460 3.537 1.00 0.00 O ATOM 2442 CB PHE A 160 -2.325 -10.320 2.504 1.00 0.00 C ATOM 2443 CG PHE A 160 -3.581 -11.140 2.718 1.00 0.00 C ATOM 2444 CD1 PHE A 160 -3.692 -11.975 3.839 1.00 0.00 C ATOM 2445 CD2 PHE A 160 -4.634 -11.069 1.798 1.00 0.00 C ATOM 2446 CE1 PHE A 160 -4.850 -12.737 4.037 1.00 0.00 C ATOM 2447 CE2 PHE A 160 -5.793 -11.833 1.998 1.00 0.00 C ATOM 2448 CZ PHE A 160 -5.899 -12.665 3.116 1.00 0.00 C ATOM 0 H PHE A 160 -0.681 -9.488 4.152 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.523 -8.163 2.443 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -2.145 -10.185 1.438 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -1.461 -10.847 2.909 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -2.882 -12.031 4.552 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -4.554 -10.426 0.934 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -4.933 -13.380 4.901 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -6.604 -11.778 1.287 1.00 0.00 H new ATOM 0 HZ PHE A 160 -6.792 -13.253 3.268 1.00 0.00 H new ATOM 2458 N ARG A 161 -3.733 -9.538 5.176 1.00 0.00 N ATOM 2459 CA ARG A 161 -4.931 -9.588 6.004 1.00 0.00 C ATOM 2460 C ARG A 161 -5.162 -8.263 6.719 1.00 0.00 C ATOM 2461 O ARG A 161 -6.261 -7.709 6.677 1.00 0.00 O ATOM 2462 CB ARG A 161 -4.834 -10.723 7.019 1.00 0.00 C ATOM 2463 CG ARG A 161 -5.977 -10.605 8.030 1.00 0.00 C ATOM 2464 CD ARG A 161 -6.310 -11.990 8.588 1.00 0.00 C ATOM 2465 NE ARG A 161 -6.733 -12.881 7.513 1.00 0.00 N ATOM 2466 CZ ARG A 161 -8.001 -12.929 7.116 1.00 0.00 C ATOM 2467 NH1 ARG A 161 -8.895 -12.166 7.685 1.00 0.00 N ATOM 2468 NH2 ARG A 161 -8.353 -13.739 6.156 1.00 0.00 N ATOM 0 H ARG A 161 -2.905 -9.973 5.584 1.00 0.00 H new ATOM 0 HA ARG A 161 -5.781 -9.774 5.348 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -4.883 -11.685 6.510 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -3.874 -10.683 7.534 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -5.692 -9.934 8.840 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -6.856 -10.173 7.552 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -5.438 -12.406 9.092 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -7.100 -11.908 9.334 1.00 0.00 H new ATOM 0 HE ARG A 161 -6.043 -13.478 7.057 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -8.621 -11.532 8.435 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -9.867 -12.204 7.379 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -7.656 -14.335 5.710 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -9.326 -13.776 5.851 1.00 0.00 H new ATOM 2482 N ARG A 162 -4.128 -7.765 7.381 1.00 0.00 N ATOM 2483 CA ARG A 162 -4.237 -6.512 8.108 1.00 0.00 C ATOM 2484 C ARG A 162 -4.739 -5.391 7.204 1.00 0.00 C ATOM 2485 O ARG A 162 -5.508 -4.535 7.644 1.00 0.00 O ATOM 2486 CB ARG A 162 -2.879 -6.130 8.695 1.00 0.00 C ATOM 2487 CG ARG A 162 -2.504 -7.121 9.800 1.00 0.00 C ATOM 2488 CD ARG A 162 -2.961 -6.574 11.152 1.00 0.00 C ATOM 2489 NE ARG A 162 -3.059 -7.653 12.127 1.00 0.00 N ATOM 2490 CZ ARG A 162 -3.824 -7.535 13.209 1.00 0.00 C ATOM 2491 NH1 ARG A 162 -4.499 -6.438 13.413 1.00 0.00 N ATOM 2492 NH2 ARG A 162 -3.898 -8.517 14.066 1.00 0.00 N ATOM 0 H ARG A 162 -3.210 -8.207 7.429 1.00 0.00 H new ATOM 0 HA ARG A 162 -4.958 -6.651 8.914 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -2.119 -6.135 7.914 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -2.916 -5.118 9.097 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -2.971 -8.087 9.610 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -1.426 -7.284 9.807 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -2.257 -5.820 11.504 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.928 -6.082 11.045 1.00 0.00 H new ATOM 0 HE ARG A 162 -2.532 -8.513 11.977 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -4.440 -5.671 12.743 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -5.086 -6.347 14.242 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -3.369 -9.374 13.906 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -4.484 -8.427 14.896 1.00 0.00 H new ATOM 2506 N ILE A 163 -4.314 -5.387 5.939 1.00 0.00 N ATOM 2507 CA ILE A 163 -4.757 -4.345 5.026 1.00 0.00 C ATOM 2508 C ILE A 163 -6.243 -4.509 4.715 1.00 0.00 C ATOM 2509 O ILE A 163 -7.027 -3.603 4.981 1.00 0.00 O ATOM 2510 CB ILE A 163 -3.911 -4.345 3.747 1.00 0.00 C ATOM 2511 CG1 ILE A 163 -4.410 -3.234 2.798 1.00 0.00 C ATOM 2512 CG2 ILE A 163 -4.037 -5.692 3.067 1.00 0.00 C ATOM 2513 CD1 ILE A 163 -3.547 -3.170 1.532 1.00 0.00 C ATOM 0 H ILE A 163 -3.680 -6.077 5.536 1.00 0.00 H new ATOM 0 HA ILE A 163 -4.620 -3.377 5.508 1.00 0.00 H new ATOM 0 HB ILE A 163 -2.866 -4.160 3.997 1.00 0.00 H new ATOM 0 HG12 ILE A 163 -5.449 -3.421 2.526 1.00 0.00 H new ATOM 0 HG13 ILE A 163 -4.383 -2.272 3.311 1.00 0.00 H new ATOM 0 HG21 ILE A 163 -3.437 -5.698 2.157 1.00 0.00 H new ATOM 0 HG22 ILE A 163 -3.683 -6.474 3.739 1.00 0.00 H new ATOM 0 HG23 ILE A 163 -5.081 -5.876 2.815 1.00 0.00 H new ATOM 0 HD11 ILE A 163 -3.918 -2.380 0.879 1.00 0.00 H new ATOM 0 HD12 ILE A 163 -2.513 -2.959 1.806 1.00 0.00 H new ATOM 0 HD13 ILE A 163 -3.596 -4.125 1.010 1.00 0.00 H new ATOM 2525 N ILE A 164 -6.645 -5.664 4.175 1.00 0.00 N ATOM 2526 CA ILE A 164 -8.064 -5.871 3.881 1.00 0.00 C ATOM 2527 C ILE A 164 -8.912 -5.442 5.079 1.00 0.00 C ATOM 2528 O ILE A 164 -10.037 -4.960 4.927 1.00 0.00 O ATOM 2529 CB ILE A 164 -8.331 -7.326 3.557 1.00 0.00 C ATOM 2530 CG1 ILE A 164 -7.515 -7.708 2.328 1.00 0.00 C ATOM 2531 CG2 ILE A 164 -9.815 -7.511 3.240 1.00 0.00 C ATOM 2532 CD1 ILE A 164 -7.522 -9.220 2.191 1.00 0.00 C ATOM 0 H ILE A 164 -6.032 -6.444 3.940 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.332 -5.265 3.015 1.00 0.00 H new ATOM 0 HB ILE A 164 -8.056 -7.951 4.406 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.937 -7.246 1.436 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.493 -7.342 2.424 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -10.009 -8.558 3.006 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -10.411 -7.215 4.103 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -10.084 -6.892 2.384 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -6.941 -9.509 1.315 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -7.082 -9.668 3.082 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -8.548 -9.570 2.078 1.00 0.00 H new ATOM 2544 N LEU A 165 -8.362 -5.631 6.271 1.00 0.00 N ATOM 2545 CA LEU A 165 -9.064 -5.278 7.499 1.00 0.00 C ATOM 2546 C LEU A 165 -9.350 -3.780 7.563 1.00 0.00 C ATOM 2547 O LEU A 165 -10.509 -3.355 7.550 1.00 0.00 O ATOM 2548 CB LEU A 165 -8.213 -5.709 8.702 1.00 0.00 C ATOM 2549 CG LEU A 165 -8.941 -6.770 9.528 1.00 0.00 C ATOM 2550 CD1 LEU A 165 -10.245 -6.194 10.053 1.00 0.00 C ATOM 2551 CD2 LEU A 165 -9.220 -7.992 8.653 1.00 0.00 C ATOM 0 H LEU A 165 -7.433 -6.026 6.414 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.023 -5.796 7.518 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.258 -6.103 8.355 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.993 -4.843 9.326 1.00 0.00 H new ATOM 0 HG LEU A 165 -8.320 -7.071 10.372 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.765 -6.949 10.642 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.034 -5.327 10.679 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -10.873 -5.892 9.215 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -9.739 -8.749 9.241 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -9.842 -7.699 7.807 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.278 -8.400 8.286 1.00 0.00 H new ATOM 2563 N GLU A 166 -8.303 -2.973 7.628 1.00 0.00 N ATOM 2564 CA GLU A 166 -8.504 -1.535 7.686 1.00 0.00 C ATOM 2565 C GLU A 166 -9.221 -1.074 6.431 1.00 0.00 C ATOM 2566 O GLU A 166 -9.934 -0.070 6.441 1.00 0.00 O ATOM 2567 CB GLU A 166 -7.170 -0.804 7.839 1.00 0.00 C ATOM 2568 CG GLU A 166 -7.104 -0.151 9.222 1.00 0.00 C ATOM 2569 CD GLU A 166 -8.136 0.968 9.321 1.00 0.00 C ATOM 2570 OE1 GLU A 166 -7.941 1.985 8.676 1.00 0.00 O ATOM 2571 OE2 GLU A 166 -9.105 0.791 10.040 1.00 0.00 O ATOM 0 H GLU A 166 -7.330 -3.278 7.642 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.115 -1.299 8.557 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -6.343 -1.503 7.715 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -7.066 -0.047 7.062 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -7.289 -0.897 9.995 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -6.105 0.248 9.397 1.00 0.00 H new ATOM 2578 N ALA A 167 -9.046 -1.830 5.358 1.00 0.00 N ATOM 2579 CA ALA A 167 -9.702 -1.509 4.107 1.00 0.00 C ATOM 2580 C ALA A 167 -11.205 -1.477 4.328 1.00 0.00 C ATOM 2581 O ALA A 167 -11.916 -0.651 3.756 1.00 0.00 O ATOM 2582 CB ALA A 167 -9.361 -2.561 3.053 1.00 0.00 C ATOM 0 H ALA A 167 -8.459 -2.664 5.331 1.00 0.00 H new ATOM 0 HA ALA A 167 -9.359 -0.535 3.757 1.00 0.00 H new ATOM 0 HB1 ALA A 167 -9.859 -2.312 2.116 1.00 0.00 H new ATOM 0 HB2 ALA A 167 -8.282 -2.583 2.897 1.00 0.00 H new ATOM 0 HB3 ALA A 167 -9.698 -3.540 3.394 1.00 0.00 H new ATOM 2588 N GLU A 168 -11.678 -2.384 5.179 1.00 0.00 N ATOM 2589 CA GLU A 168 -13.103 -2.453 5.487 1.00 0.00 C ATOM 2590 C GLU A 168 -13.525 -1.241 6.305 1.00 0.00 C ATOM 2591 O GLU A 168 -14.480 -0.547 5.958 1.00 0.00 O ATOM 2592 CB GLU A 168 -13.432 -3.736 6.255 1.00 0.00 C ATOM 2593 CG GLU A 168 -13.431 -4.924 5.291 1.00 0.00 C ATOM 2594 CD GLU A 168 -14.780 -5.022 4.586 1.00 0.00 C ATOM 2595 OE1 GLU A 168 -15.707 -5.531 5.194 1.00 0.00 O ATOM 2596 OE2 GLU A 168 -14.866 -4.584 3.450 1.00 0.00 O ATOM 0 H GLU A 168 -11.103 -3.074 5.662 1.00 0.00 H new ATOM 0 HA GLU A 168 -13.653 -2.459 4.546 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -12.700 -3.896 7.047 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -14.406 -3.645 6.735 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -12.635 -4.806 4.556 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -13.228 -5.846 5.836 1.00 0.00 H new ATOM 2603 N LYS A 169 -12.803 -0.991 7.394 1.00 0.00 N ATOM 2604 CA LYS A 169 -13.119 0.147 8.252 1.00 0.00 C ATOM 2605 C LYS A 169 -13.149 1.439 7.438 1.00 0.00 C ATOM 2606 O LYS A 169 -14.173 2.121 7.369 1.00 0.00 O ATOM 2607 CB LYS A 169 -12.080 0.267 9.368 1.00 0.00 C ATOM 2608 CG LYS A 169 -12.699 0.986 10.568 1.00 0.00 C ATOM 2609 CD LYS A 169 -11.617 1.780 11.305 1.00 0.00 C ATOM 2610 CE LYS A 169 -12.233 2.480 12.517 1.00 0.00 C ATOM 2611 NZ LYS A 169 -13.490 3.167 12.110 1.00 0.00 N ATOM 0 H LYS A 169 -12.007 -1.551 7.700 1.00 0.00 H new ATOM 0 HA LYS A 169 -14.103 -0.016 8.691 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -11.733 -0.723 9.664 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -11.209 0.817 9.011 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -13.492 1.655 10.234 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -13.156 0.262 11.243 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -10.816 1.113 11.625 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -11.171 2.515 10.635 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -12.441 1.754 13.302 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -11.529 3.202 12.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -13.726 3.901 12.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -13.359 3.606 11.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -14.264 2.474 12.061 1.00 0.00 H new ATOM 2625 N ILE A 170 -12.018 1.766 6.823 1.00 0.00 N ATOM 2626 CA ILE A 170 -11.919 2.974 6.012 1.00 0.00 C ATOM 2627 C ILE A 170 -13.073 3.054 5.018 1.00 0.00 C ATOM 2628 O ILE A 170 -13.573 4.144 4.720 1.00 0.00 O ATOM 2629 CB ILE A 170 -10.593 2.981 5.259 1.00 0.00 C ATOM 2630 CG1 ILE A 170 -9.440 3.073 6.260 1.00 0.00 C ATOM 2631 CG2 ILE A 170 -10.561 4.189 4.329 1.00 0.00 C ATOM 2632 CD1 ILE A 170 -8.138 2.639 5.584 1.00 0.00 C ATOM 0 H ILE A 170 -11.161 1.215 6.870 1.00 0.00 H new ATOM 0 HA ILE A 170 -11.970 3.839 6.673 1.00 0.00 H new ATOM 0 HB ILE A 170 -10.491 2.065 4.677 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -9.347 4.094 6.630 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -9.643 2.439 7.123 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -9.617 4.204 3.785 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -11.387 4.125 3.621 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -10.657 5.103 4.916 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -7.317 2.705 6.298 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -8.234 1.611 5.236 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -7.934 3.292 4.735 1.00 0.00 H new ATOM 2644 N ASP A 171 -13.499 1.902 4.505 1.00 0.00 N ATOM 2645 CA ASP A 171 -14.598 1.875 3.549 1.00 0.00 C ATOM 2646 C ASP A 171 -15.885 2.318 4.228 1.00 0.00 C ATOM 2647 O ASP A 171 -16.682 3.057 3.651 1.00 0.00 O ATOM 2648 CB ASP A 171 -14.776 0.470 2.984 1.00 0.00 C ATOM 2649 CG ASP A 171 -16.249 0.074 3.017 1.00 0.00 C ATOM 2650 OD1 ASP A 171 -16.744 -0.197 4.099 1.00 0.00 O ATOM 2651 OD2 ASP A 171 -16.859 0.049 1.962 1.00 0.00 O ATOM 0 H ASP A 171 -13.106 0.989 4.732 1.00 0.00 H new ATOM 0 HA ASP A 171 -14.365 2.558 2.732 1.00 0.00 H new ATOM 0 HB2 ASP A 171 -14.404 0.432 1.960 1.00 0.00 H new ATOM 0 HB3 ASP A 171 -14.187 -0.241 3.564 1.00 0.00 H new ATOM 2656 N GLY A 172 -16.073 1.875 5.468 1.00 0.00 N ATOM 2657 CA GLY A 172 -17.257 2.250 6.226 1.00 0.00 C ATOM 2658 C GLY A 172 -17.311 3.761 6.397 1.00 0.00 C ATOM 2659 O GLY A 172 -18.387 4.357 6.442 1.00 0.00 O ATOM 0 H GLY A 172 -15.426 1.262 5.963 1.00 0.00 H new ATOM 0 HA2 GLY A 172 -18.153 1.902 5.712 1.00 0.00 H new ATOM 0 HA3 GLY A 172 -17.242 1.766 7.202 1.00 0.00 H new ATOM 2663 N ALA A 173 -16.134 4.377 6.483 1.00 0.00 N ATOM 2664 CA ALA A 173 -16.050 5.825 6.639 1.00 0.00 C ATOM 2665 C ALA A 173 -16.533 6.517 5.368 1.00 0.00 C ATOM 2666 O ALA A 173 -17.649 7.035 5.325 1.00 0.00 O ATOM 2667 CB ALA A 173 -14.606 6.237 6.933 1.00 0.00 C ATOM 0 H ALA A 173 -15.233 3.900 6.448 1.00 0.00 H new ATOM 0 HA ALA A 173 -16.685 6.126 7.473 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -14.553 7.320 7.048 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -14.271 5.758 7.853 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -13.964 5.928 6.108 1.00 0.00 H new ATOM 2673 N ALA A 174 -15.687 6.521 4.339 1.00 0.00 N ATOM 2674 CA ALA A 174 -16.041 7.151 3.070 1.00 0.00 C ATOM 2675 C ALA A 174 -17.510 6.914 2.731 1.00 0.00 C ATOM 2676 O ALA A 174 -18.295 7.859 2.646 1.00 0.00 O ATOM 2677 CB ALA A 174 -15.164 6.591 1.948 1.00 0.00 C ATOM 0 H ALA A 174 -14.759 6.098 4.359 1.00 0.00 H new ATOM 0 HA ALA A 174 -15.875 8.224 3.167 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -15.434 7.065 1.004 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -14.116 6.794 2.170 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -15.317 5.515 1.870 1.00 0.00 H new