USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1089 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 122 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 126 GLN : amide:sc= -0.212 K(o=-0.21,f=-2.2!) USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 104 MET CE :methyl 171:sc= -2.91 (180deg=-3.07) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0481 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0488 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 HIS : no HD1:sc= -5.83! K(o=-5.8!,f=-4.1) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 70:sc= 1.11 USER MOD Single : A 26 LYS NZ :NH3+ 163:sc= -1.59! (180deg=-2.4!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : A 31 HIS : no HD1:sc= -0.428 X(o=-0.43,f=-0.88) USER MOD Single : A 36 LYS NZ :NH3+ -166:sc= -2.1! (180deg=-2.94!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= -0.471 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 15:sc= 0.0755 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= -0.728 X(o=-0.73,f=-0.71) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=-0.0053) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 CYS SG : rot -79:sc= 0.957 USER MOD Single : A 69 ASN : amide:sc= -0.0957 X(o=-0.096,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.251 X(o=-0.25,f=-0.74) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot 10:sc= 0.0541 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc=-1.01e-06 (180deg=-1.01e-06) USER MOD Single : A 83 SER OG : rot 23:sc= 0.0486 USER MOD Single : A 87 MET CE :methyl -174:sc= -1.2! (180deg=-1.37!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 141:sc= 0.0928 USER MOD Single : A 94 CYS SG : rot 100:sc= -1.74 USER MOD Single : A 95 GLN : amide:sc= -3.43 K(o=-3.4,f=-6.3!) USER MOD Single : A 98 GLN : amide:sc= -1.12 K(o=-1.1,f=-4.8!) USER MOD Single : A 99 GLN : amide:sc= -3.02 K(o=-3,f=-6.1!) USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 58:sc=0.000348 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl 162:sc= -0.882 (180deg=-1.62) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 89:sc= 0.102 USER MOD Single : A 121 TYR OH : rot 180:sc= -0.0868 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.48 K(o=-0.48,f=-4.4!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.458 -18.478 5.349 1.00 0.00 N ATOM 2 CA GLY A 1 10.663 -17.160 4.779 1.00 0.00 C ATOM 3 C GLY A 1 10.410 -16.050 5.779 1.00 0.00 C ATOM 4 O GLY A 1 11.269 -15.196 6.000 1.00 0.00 O ATOM 0 H1 GLY A 1 10.643 -19.202 4.626 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.107 -18.615 6.150 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.476 -18.564 5.681 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.685 -17.083 4.407 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.001 -17.031 3.923 1.00 0.00 H new ATOM 8 N SER A 2 9.227 -16.059 6.386 1.00 0.00 N ATOM 9 CA SER A 2 8.861 -15.042 7.364 1.00 0.00 C ATOM 10 C SER A 2 9.970 -14.858 8.397 1.00 0.00 C ATOM 11 O SER A 2 10.289 -13.736 8.787 1.00 0.00 O ATOM 12 CB SER A 2 7.555 -15.424 8.064 1.00 0.00 C ATOM 13 OG SER A 2 7.739 -16.546 8.910 1.00 0.00 O ATOM 0 H SER A 2 8.506 -16.760 6.217 1.00 0.00 H new ATOM 0 HA SER A 2 8.720 -14.099 6.836 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.192 -14.579 8.649 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.791 -15.648 7.319 1.00 0.00 H new ATOM 0 HG SER A 2 6.891 -16.769 9.347 1.00 0.00 H new ATOM 19 N SER A 3 10.552 -15.970 8.835 1.00 0.00 N ATOM 20 CA SER A 3 11.622 -15.933 9.825 1.00 0.00 C ATOM 21 C SER A 3 12.886 -15.313 9.236 1.00 0.00 C ATOM 22 O SER A 3 12.995 -15.130 8.024 1.00 0.00 O ATOM 23 CB SER A 3 11.923 -17.344 10.335 1.00 0.00 C ATOM 24 OG SER A 3 12.284 -18.205 9.269 1.00 0.00 O ATOM 0 H SER A 3 10.301 -16.907 8.520 1.00 0.00 H new ATOM 0 HA SER A 3 11.290 -15.316 10.660 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.731 -17.305 11.065 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.048 -17.743 10.849 1.00 0.00 H new ATOM 0 HG SER A 3 12.473 -19.100 9.621 1.00 0.00 H new ATOM 30 N GLY A 4 13.840 -14.992 10.104 1.00 0.00 N ATOM 31 CA GLY A 4 15.084 -14.396 9.653 1.00 0.00 C ATOM 32 C GLY A 4 15.241 -12.961 10.116 1.00 0.00 C ATOM 33 O GLY A 4 14.429 -12.100 9.777 1.00 0.00 O ATOM 0 H GLY A 4 13.774 -15.134 11.112 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.922 -14.987 10.023 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.126 -14.430 8.564 1.00 0.00 H new ATOM 37 N SER A 5 16.287 -12.703 10.894 1.00 0.00 N ATOM 38 CA SER A 5 16.544 -11.363 11.409 1.00 0.00 C ATOM 39 C SER A 5 17.096 -10.457 10.313 1.00 0.00 C ATOM 40 O SER A 5 17.735 -10.923 9.370 1.00 0.00 O ATOM 41 CB SER A 5 17.528 -11.424 12.580 1.00 0.00 C ATOM 42 OG SER A 5 16.922 -11.997 13.726 1.00 0.00 O ATOM 0 H SER A 5 16.970 -13.404 11.182 1.00 0.00 H new ATOM 0 HA SER A 5 15.599 -10.947 11.759 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.401 -12.010 12.295 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.881 -10.420 12.815 1.00 0.00 H new ATOM 0 HG SER A 5 17.571 -12.026 14.459 1.00 0.00 H new ATOM 48 N SER A 6 16.845 -9.158 10.446 1.00 0.00 N ATOM 49 CA SER A 6 17.313 -8.185 9.466 1.00 0.00 C ATOM 50 C SER A 6 17.088 -6.761 9.964 1.00 0.00 C ATOM 51 O SER A 6 16.339 -6.534 10.914 1.00 0.00 O ATOM 52 CB SER A 6 16.595 -8.390 8.131 1.00 0.00 C ATOM 53 OG SER A 6 17.154 -7.568 7.120 1.00 0.00 O ATOM 0 H SER A 6 16.320 -8.756 11.223 1.00 0.00 H new ATOM 0 HA SER A 6 18.383 -8.336 9.322 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.665 -9.436 7.834 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.535 -8.161 8.245 1.00 0.00 H new ATOM 0 HG SER A 6 16.679 -7.719 6.276 1.00 0.00 H new ATOM 59 N GLY A 7 17.744 -5.803 9.316 1.00 0.00 N ATOM 60 CA GLY A 7 17.604 -4.412 9.707 1.00 0.00 C ATOM 61 C GLY A 7 16.246 -3.843 9.346 1.00 0.00 C ATOM 62 O GLY A 7 15.283 -4.588 9.161 1.00 0.00 O ATOM 0 H GLY A 7 18.370 -5.965 8.527 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.758 -4.323 10.782 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.382 -3.822 9.223 1.00 0.00 H new ATOM 66 N ILE A 8 16.168 -2.521 9.248 1.00 0.00 N ATOM 67 CA ILE A 8 14.918 -1.853 8.908 1.00 0.00 C ATOM 68 C ILE A 8 14.120 -2.663 7.892 1.00 0.00 C ATOM 69 O ILE A 8 14.409 -2.659 6.695 1.00 0.00 O ATOM 70 CB ILE A 8 15.168 -0.443 8.342 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.904 0.420 9.369 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.853 0.208 7.940 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.103 0.679 10.625 1.00 0.00 C ATOM 0 H ILE A 8 16.956 -1.891 9.399 1.00 0.00 H new ATOM 0 HA ILE A 8 14.345 -1.768 9.831 1.00 0.00 H new ATOM 0 HB ILE A 8 15.794 -0.530 7.454 1.00 0.00 H new ATOM 0 HG12 ILE A 8 16.840 -0.069 9.639 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.164 1.374 8.910 1.00 0.00 H new ATOM 0 HG21 ILE A 8 14.047 1.204 7.542 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.365 -0.399 7.178 1.00 0.00 H new ATOM 0 HG23 ILE A 8 13.204 0.286 8.812 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.686 1.297 11.308 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.179 1.196 10.367 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.865 -0.269 11.107 1.00 0.00 H new ATOM 85 N PRO A 9 13.092 -3.374 8.377 1.00 0.00 N ATOM 86 CA PRO A 9 12.229 -4.200 7.527 1.00 0.00 C ATOM 87 C PRO A 9 11.345 -3.362 6.610 1.00 0.00 C ATOM 88 O PRO A 9 10.292 -2.877 7.022 1.00 0.00 O ATOM 89 CB PRO A 9 11.374 -4.973 8.535 1.00 0.00 C ATOM 90 CG PRO A 9 11.356 -4.115 9.752 1.00 0.00 C ATOM 91 CD PRO A 9 12.691 -3.425 9.793 1.00 0.00 C ATOM 0 HA PRO A 9 12.806 -4.839 6.858 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.367 -5.140 8.154 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.801 -5.953 8.748 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.543 -3.390 9.706 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.199 -4.714 10.649 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.615 -2.427 10.225 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.411 -3.979 10.395 1.00 0.00 H new ATOM 99 N GLU A 10 11.780 -3.198 5.365 1.00 0.00 N ATOM 100 CA GLU A 10 11.026 -2.418 4.390 1.00 0.00 C ATOM 101 C GLU A 10 10.587 -3.291 3.218 1.00 0.00 C ATOM 102 O GLU A 10 11.250 -4.270 2.875 1.00 0.00 O ATOM 103 CB GLU A 10 11.869 -1.247 3.880 1.00 0.00 C ATOM 104 CG GLU A 10 12.513 -0.432 4.989 1.00 0.00 C ATOM 105 CD GLU A 10 13.260 0.779 4.464 1.00 0.00 C ATOM 106 OE1 GLU A 10 12.673 1.537 3.664 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.432 0.967 4.853 1.00 0.00 O ATOM 0 H GLU A 10 12.649 -3.594 5.008 1.00 0.00 H new ATOM 0 HA GLU A 10 10.136 -2.028 4.884 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.649 -1.631 3.223 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.239 -0.592 3.278 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.743 -0.105 5.688 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.202 -1.066 5.547 1.00 0.00 H new ATOM 114 N LEU A 11 9.463 -2.929 2.608 1.00 0.00 N ATOM 115 CA LEU A 11 8.933 -3.679 1.474 1.00 0.00 C ATOM 116 C LEU A 11 9.196 -2.943 0.164 1.00 0.00 C ATOM 117 O LEU A 11 8.929 -1.747 0.046 1.00 0.00 O ATOM 118 CB LEU A 11 7.431 -3.911 1.649 1.00 0.00 C ATOM 119 CG LEU A 11 7.029 -5.221 2.329 1.00 0.00 C ATOM 120 CD1 LEU A 11 5.731 -5.044 3.101 1.00 0.00 C ATOM 121 CD2 LEU A 11 6.895 -6.336 1.303 1.00 0.00 C ATOM 0 H LEU A 11 8.902 -2.122 2.879 1.00 0.00 H new ATOM 0 HA LEU A 11 9.442 -4.642 1.437 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.021 -3.084 2.228 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.961 -3.876 0.666 1.00 0.00 H new ATOM 0 HG LEU A 11 7.812 -5.498 3.034 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.460 -5.986 3.578 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.863 -4.276 3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.938 -4.743 2.416 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.609 -7.260 1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.132 -6.068 0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.849 -6.480 0.795 1.00 0.00 H new ATOM 133 N LYS A 12 9.720 -3.667 -0.820 1.00 0.00 N ATOM 134 CA LYS A 12 10.016 -3.085 -2.123 1.00 0.00 C ATOM 135 C LYS A 12 9.179 -3.743 -3.216 1.00 0.00 C ATOM 136 O LYS A 12 9.399 -4.903 -3.565 1.00 0.00 O ATOM 137 CB LYS A 12 11.505 -3.237 -2.446 1.00 0.00 C ATOM 138 CG LYS A 12 12.417 -2.541 -1.450 1.00 0.00 C ATOM 139 CD LYS A 12 12.695 -1.104 -1.859 1.00 0.00 C ATOM 140 CE LYS A 12 13.222 -0.285 -0.690 1.00 0.00 C ATOM 141 NZ LYS A 12 14.673 -0.521 -0.457 1.00 0.00 N ATOM 0 H LYS A 12 9.948 -4.658 -0.739 1.00 0.00 H new ATOM 0 HA LYS A 12 9.764 -2.025 -2.085 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.755 -4.297 -2.476 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.695 -2.836 -3.442 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.957 -2.557 -0.462 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.357 -3.087 -1.373 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.421 -1.090 -2.672 1.00 0.00 H new ATOM 0 HD3 LYS A 12 11.781 -0.650 -2.241 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.053 0.774 -0.883 1.00 0.00 H new ATOM 0 HE3 LYS A 12 12.664 -0.538 0.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.994 0.055 0.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 14.832 -1.527 -0.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 15.209 -0.256 -1.308 1.00 0.00 H new ATOM 155 N ASP A 13 8.221 -2.995 -3.752 1.00 0.00 N ATOM 156 CA ASP A 13 7.353 -3.505 -4.806 1.00 0.00 C ATOM 157 C ASP A 13 6.433 -2.408 -5.331 1.00 0.00 C ATOM 158 O ASP A 13 6.050 -1.499 -4.593 1.00 0.00 O ATOM 159 CB ASP A 13 6.522 -4.680 -4.288 1.00 0.00 C ATOM 160 CG ASP A 13 7.224 -6.011 -4.472 1.00 0.00 C ATOM 161 OD1 ASP A 13 7.406 -6.430 -5.634 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.590 -6.635 -3.453 1.00 0.00 O ATOM 0 H ASP A 13 8.026 -2.033 -3.474 1.00 0.00 H new ATOM 0 HA ASP A 13 7.983 -3.849 -5.626 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.306 -4.530 -3.230 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.565 -4.702 -4.809 1.00 0.00 H new ATOM 167 N HIS A 14 6.082 -2.497 -6.610 1.00 0.00 N ATOM 168 CA HIS A 14 5.207 -1.511 -7.234 1.00 0.00 C ATOM 169 C HIS A 14 3.785 -2.050 -7.363 1.00 0.00 C ATOM 170 O HIS A 14 3.539 -3.011 -8.093 1.00 0.00 O ATOM 171 CB HIS A 14 5.744 -1.121 -8.611 1.00 0.00 C ATOM 172 CG HIS A 14 4.726 -0.450 -9.483 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.536 -0.780 -10.808 1.00 0.00 N ATOM 174 CD2 HIS A 14 3.840 0.536 -9.210 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.578 -0.024 -11.314 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.138 0.782 -10.365 1.00 0.00 N ATOM 0 H HIS A 14 6.390 -3.242 -7.235 1.00 0.00 H new ATOM 0 HA HIS A 14 5.185 -0.627 -6.597 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.597 -0.455 -8.484 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.110 -2.015 -9.116 1.00 0.00 H new ATOM 0 HD2 HIS A 14 3.709 1.036 -8.262 1.00 0.00 H new ATOM 0 HE1 HIS A 14 3.216 -0.059 -12.331 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.397 1.475 -10.472 1.00 0.00 H new ATOM 185 N LEU A 15 2.855 -1.427 -6.649 1.00 0.00 N ATOM 186 CA LEU A 15 1.457 -1.844 -6.683 1.00 0.00 C ATOM 187 C LEU A 15 0.698 -1.117 -7.788 1.00 0.00 C ATOM 188 O LEU A 15 1.286 -0.371 -8.572 1.00 0.00 O ATOM 189 CB LEU A 15 0.792 -1.578 -5.332 1.00 0.00 C ATOM 190 CG LEU A 15 1.495 -2.170 -4.110 1.00 0.00 C ATOM 191 CD1 LEU A 15 1.195 -1.343 -2.869 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.074 -3.618 -3.902 1.00 0.00 C ATOM 0 H LEU A 15 3.043 -0.631 -6.039 1.00 0.00 H new ATOM 0 HA LEU A 15 1.428 -2.914 -6.891 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.714 -0.500 -5.194 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.225 -1.970 -5.367 1.00 0.00 H new ATOM 0 HG LEU A 15 2.570 -2.146 -4.287 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.704 -1.779 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.546 -0.322 -3.019 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.120 -1.334 -2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.584 -4.023 -3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.004 -3.665 -3.747 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.340 -4.204 -4.782 1.00 0.00 H new ATOM 204 N ARG A 16 -0.611 -1.337 -7.844 1.00 0.00 N ATOM 205 CA ARG A 16 -1.451 -0.702 -8.852 1.00 0.00 C ATOM 206 C ARG A 16 -1.825 0.717 -8.433 1.00 0.00 C ATOM 207 O ARG A 16 -2.515 0.918 -7.433 1.00 0.00 O ATOM 208 CB ARG A 16 -2.718 -1.527 -9.084 1.00 0.00 C ATOM 209 CG ARG A 16 -2.553 -2.615 -10.132 1.00 0.00 C ATOM 210 CD ARG A 16 -2.744 -2.069 -11.538 1.00 0.00 C ATOM 211 NE ARG A 16 -2.031 -2.862 -12.536 1.00 0.00 N ATOM 212 CZ ARG A 16 -2.319 -2.844 -13.832 1.00 0.00 C ATOM 213 NH1 ARG A 16 -3.301 -2.077 -14.286 1.00 0.00 N ATOM 214 NH2 ARG A 16 -1.624 -3.593 -14.678 1.00 0.00 N ATOM 0 H ARG A 16 -1.113 -1.951 -7.203 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.884 -0.650 -9.781 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -3.021 -1.985 -8.142 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.525 -0.860 -9.389 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -1.561 -3.058 -10.045 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -3.275 -3.411 -9.949 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -3.807 -2.054 -11.779 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -2.393 -1.038 -11.577 1.00 0.00 H new ATOM 0 HE ARG A 16 -1.270 -3.463 -12.220 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -3.837 -1.499 -13.639 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -3.520 -2.065 -15.282 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -0.867 -4.184 -14.333 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -1.846 -3.578 -15.673 1.00 0.00 H new ATOM 228 N ILE A 17 -1.364 1.696 -9.204 1.00 0.00 N ATOM 229 CA ILE A 17 -1.651 3.096 -8.913 1.00 0.00 C ATOM 230 C ILE A 17 -2.404 3.753 -10.064 1.00 0.00 C ATOM 231 O ILE A 17 -2.023 3.619 -11.227 1.00 0.00 O ATOM 232 CB ILE A 17 -0.359 3.889 -8.639 1.00 0.00 C ATOM 233 CG1 ILE A 17 0.194 3.543 -7.255 1.00 0.00 C ATOM 234 CG2 ILE A 17 -0.623 5.384 -8.751 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.481 4.265 -6.921 1.00 0.00 C ATOM 0 H ILE A 17 -0.791 1.546 -10.034 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.274 3.112 -8.019 1.00 0.00 H new ATOM 0 HB ILE A 17 0.385 3.613 -9.386 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.556 3.786 -6.502 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.365 2.468 -7.199 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.299 5.932 -8.555 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -0.977 5.617 -9.755 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.380 5.675 -8.023 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.815 3.972 -5.926 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.246 4.003 -7.652 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.311 5.341 -6.944 1.00 0.00 H new ATOM 247 N PHE A 18 -3.475 4.467 -9.732 1.00 0.00 N ATOM 248 CA PHE A 18 -4.282 5.147 -10.738 1.00 0.00 C ATOM 249 C PHE A 18 -4.763 6.502 -10.225 1.00 0.00 C ATOM 250 O PHE A 18 -5.279 6.608 -9.112 1.00 0.00 O ATOM 251 CB PHE A 18 -5.482 4.283 -11.130 1.00 0.00 C ATOM 252 CG PHE A 18 -6.400 4.944 -12.117 1.00 0.00 C ATOM 253 CD1 PHE A 18 -5.903 5.825 -13.064 1.00 0.00 C ATOM 254 CD2 PHE A 18 -7.761 4.686 -12.098 1.00 0.00 C ATOM 255 CE1 PHE A 18 -6.745 6.435 -13.974 1.00 0.00 C ATOM 256 CE2 PHE A 18 -8.609 5.293 -13.006 1.00 0.00 C ATOM 257 CZ PHE A 18 -8.100 6.169 -13.944 1.00 0.00 C ATOM 0 H PHE A 18 -3.804 4.589 -8.774 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.659 5.311 -11.617 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.122 3.345 -11.553 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.047 4.032 -10.232 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.844 6.037 -13.091 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.164 4.003 -11.365 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.344 7.119 -14.708 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -9.668 5.082 -12.982 1.00 0.00 H new ATOM 0 HZ PHE A 18 -8.760 6.646 -14.653 1.00 0.00 H new ATOM 267 N ARG A 19 -4.588 7.534 -11.044 1.00 0.00 N ATOM 268 CA ARG A 19 -5.002 8.882 -10.673 1.00 0.00 C ATOM 269 C ARG A 19 -5.735 9.562 -11.825 1.00 0.00 C ATOM 270 O ARG A 19 -5.154 10.322 -12.600 1.00 0.00 O ATOM 271 CB ARG A 19 -3.788 9.716 -10.263 1.00 0.00 C ATOM 272 CG ARG A 19 -2.922 9.053 -9.203 1.00 0.00 C ATOM 273 CD ARG A 19 -3.431 9.352 -7.802 1.00 0.00 C ATOM 274 NE ARG A 19 -4.872 9.143 -7.686 1.00 0.00 N ATOM 275 CZ ARG A 19 -5.769 10.111 -7.835 1.00 0.00 C ATOM 276 NH1 ARG A 19 -5.376 11.348 -8.105 1.00 0.00 N ATOM 277 NH2 ARG A 19 -7.063 9.843 -7.715 1.00 0.00 N ATOM 0 H ARG A 19 -4.163 7.463 -11.968 1.00 0.00 H new ATOM 0 HA ARG A 19 -5.684 8.806 -9.826 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -3.179 9.914 -11.145 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -4.130 10.681 -9.889 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -2.909 7.975 -9.364 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -1.894 9.403 -9.300 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -2.914 8.715 -7.085 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -3.192 10.383 -7.542 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.208 8.202 -7.479 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.382 11.558 -8.199 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -6.067 12.089 -8.219 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -7.370 8.893 -7.508 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -7.751 10.587 -7.830 1.00 0.00 H new ATOM 291 N PRO A 20 -7.041 9.283 -11.943 1.00 0.00 N ATOM 292 CA PRO A 20 -7.882 9.858 -12.998 1.00 0.00 C ATOM 293 C PRO A 20 -8.118 11.352 -12.802 1.00 0.00 C ATOM 294 O PRO A 20 -7.499 11.980 -11.943 1.00 0.00 O ATOM 295 CB PRO A 20 -9.197 9.086 -12.864 1.00 0.00 C ATOM 296 CG PRO A 20 -9.230 8.639 -11.444 1.00 0.00 C ATOM 297 CD PRO A 20 -7.800 8.386 -11.056 1.00 0.00 C ATOM 0 HA PRO A 20 -7.419 9.771 -13.981 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.053 9.718 -13.100 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -9.229 8.237 -13.547 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.679 9.400 -10.806 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.830 7.736 -11.333 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.622 8.615 -10.005 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -7.522 7.343 -11.206 1.00 0.00 H new ATOM 305 N ARG A 21 -9.017 11.914 -13.603 1.00 0.00 N ATOM 306 CA ARG A 21 -9.334 13.334 -13.517 1.00 0.00 C ATOM 307 C ARG A 21 -10.475 13.695 -14.464 1.00 0.00 C ATOM 308 O ARG A 21 -10.394 13.458 -15.670 1.00 0.00 O ATOM 309 CB ARG A 21 -8.099 14.175 -13.847 1.00 0.00 C ATOM 310 CG ARG A 21 -8.303 15.666 -13.634 1.00 0.00 C ATOM 311 CD ARG A 21 -8.386 16.013 -12.156 1.00 0.00 C ATOM 312 NE ARG A 21 -7.070 16.025 -11.522 1.00 0.00 N ATOM 313 CZ ARG A 21 -6.861 16.415 -10.270 1.00 0.00 C ATOM 314 NH1 ARG A 21 -7.877 16.822 -9.521 1.00 0.00 N ATOM 315 NH2 ARG A 21 -5.635 16.398 -9.764 1.00 0.00 N ATOM 0 H ARG A 21 -9.539 11.408 -14.319 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.650 13.549 -12.496 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -7.266 13.839 -13.230 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -7.818 14.000 -14.885 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.481 16.216 -14.092 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -9.217 15.984 -14.135 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -8.854 16.991 -12.039 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -9.026 15.291 -11.649 1.00 0.00 H new ATOM 0 HE ARG A 21 -6.268 15.717 -12.071 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -8.821 16.836 -9.906 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -7.714 17.121 -8.560 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -4.851 16.085 -10.337 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -5.476 16.698 -8.802 1.00 0.00 H new ATOM 329 N LYS A 22 -11.537 14.269 -13.910 1.00 0.00 N ATOM 330 CA LYS A 22 -12.695 14.663 -14.704 1.00 0.00 C ATOM 331 C LYS A 22 -13.291 13.462 -15.431 1.00 0.00 C ATOM 332 O LYS A 22 -13.627 13.543 -16.613 1.00 0.00 O ATOM 333 CB LYS A 22 -12.302 15.742 -15.716 1.00 0.00 C ATOM 334 CG LYS A 22 -12.420 17.156 -15.174 1.00 0.00 C ATOM 335 CD LYS A 22 -13.870 17.603 -15.094 1.00 0.00 C ATOM 336 CE LYS A 22 -13.979 19.109 -14.911 1.00 0.00 C ATOM 337 NZ LYS A 22 -15.375 19.592 -15.103 1.00 0.00 N ATOM 0 H LYS A 22 -11.620 14.472 -12.914 1.00 0.00 H new ATOM 0 HA LYS A 22 -13.448 15.066 -14.027 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -11.275 15.570 -16.038 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.933 15.647 -16.600 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.968 17.206 -14.184 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.862 17.840 -15.814 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -14.394 17.307 -16.003 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -14.362 17.098 -14.263 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -13.635 19.379 -13.912 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.321 19.610 -15.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -15.407 20.623 -14.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -15.695 19.357 -16.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -15.999 19.134 -14.409 1.00 0.00 H new ATOM 351 N LEU A 23 -13.421 12.349 -14.717 1.00 0.00 N ATOM 352 CA LEU A 23 -13.979 11.131 -15.295 1.00 0.00 C ATOM 353 C LEU A 23 -13.114 10.628 -16.446 1.00 0.00 C ATOM 354 O LEU A 23 -13.623 10.102 -17.436 1.00 0.00 O ATOM 355 CB LEU A 23 -15.405 11.382 -15.785 1.00 0.00 C ATOM 356 CG LEU A 23 -16.507 11.271 -14.731 1.00 0.00 C ATOM 357 CD1 LEU A 23 -16.427 12.431 -13.751 1.00 0.00 C ATOM 358 CD2 LEU A 23 -17.877 11.224 -15.393 1.00 0.00 C ATOM 0 H LEU A 23 -13.148 12.265 -13.738 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.998 10.366 -14.519 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -15.447 12.380 -16.222 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -15.623 10.674 -16.585 1.00 0.00 H new ATOM 0 HG LEU A 23 -16.361 10.343 -14.178 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -17.219 12.335 -13.008 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -15.458 12.419 -13.252 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -16.546 13.371 -14.289 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -18.649 11.145 -14.627 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -18.033 12.134 -15.972 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -17.932 10.359 -16.054 1.00 0.00 H new ATOM 370 N THR A 24 -11.801 10.792 -16.309 1.00 0.00 N ATOM 371 CA THR A 24 -10.865 10.355 -17.337 1.00 0.00 C ATOM 372 C THR A 24 -10.185 9.049 -16.941 1.00 0.00 C ATOM 373 O THR A 24 -9.857 8.837 -15.773 1.00 0.00 O ATOM 374 CB THR A 24 -9.787 11.421 -17.605 1.00 0.00 C ATOM 375 OG1 THR A 24 -10.403 12.656 -17.986 1.00 0.00 O ATOM 376 CG2 THR A 24 -8.834 10.964 -18.700 1.00 0.00 C ATOM 0 H THR A 24 -11.363 11.224 -15.496 1.00 0.00 H new ATOM 0 HA THR A 24 -11.445 10.199 -18.247 1.00 0.00 H new ATOM 0 HB THR A 24 -9.217 11.568 -16.688 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.857 13.048 -17.211 1.00 0.00 H new ATOM 0 HG21 THR A 24 -8.081 11.733 -18.872 1.00 0.00 H new ATOM 0 HG22 THR A 24 -8.345 10.039 -18.394 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.393 10.791 -19.620 1.00 0.00 H new ATOM 384 N LEU A 25 -9.977 8.176 -17.921 1.00 0.00 N ATOM 385 CA LEU A 25 -9.334 6.889 -17.675 1.00 0.00 C ATOM 386 C LEU A 25 -8.060 6.750 -18.501 1.00 0.00 C ATOM 387 O LEU A 25 -7.919 5.816 -19.291 1.00 0.00 O ATOM 388 CB LEU A 25 -10.296 5.746 -18.002 1.00 0.00 C ATOM 389 CG LEU A 25 -11.042 5.857 -19.332 1.00 0.00 C ATOM 390 CD1 LEU A 25 -11.462 4.481 -19.825 1.00 0.00 C ATOM 391 CD2 LEU A 25 -12.254 6.766 -19.190 1.00 0.00 C ATOM 0 H LEU A 25 -10.244 8.335 -18.892 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.067 6.840 -16.619 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -9.733 4.812 -18.001 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -11.031 5.676 -17.200 1.00 0.00 H new ATOM 0 HG LEU A 25 -10.368 6.295 -20.068 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -11.992 4.580 -20.773 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -10.578 3.860 -19.967 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.118 4.016 -19.090 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -12.773 6.833 -20.146 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -12.930 6.357 -18.439 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -11.929 7.760 -18.883 1.00 0.00 H new ATOM 403 N LYS A 26 -7.134 7.684 -18.313 1.00 0.00 N ATOM 404 CA LYS A 26 -5.869 7.664 -19.039 1.00 0.00 C ATOM 405 C LYS A 26 -5.180 6.311 -18.895 1.00 0.00 C ATOM 406 O LYS A 26 -4.393 5.910 -19.751 1.00 0.00 O ATOM 407 CB LYS A 26 -4.948 8.775 -18.528 1.00 0.00 C ATOM 408 CG LYS A 26 -4.293 8.457 -17.195 1.00 0.00 C ATOM 409 CD LYS A 26 -5.109 8.993 -16.031 1.00 0.00 C ATOM 410 CE LYS A 26 -4.792 10.456 -15.756 1.00 0.00 C ATOM 411 NZ LYS A 26 -5.285 11.344 -16.845 1.00 0.00 N ATOM 0 H LYS A 26 -7.235 8.464 -17.664 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.081 7.832 -20.095 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.171 8.961 -19.270 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -5.523 9.696 -18.430 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.178 7.378 -17.093 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.292 8.888 -17.168 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.171 8.884 -16.249 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.905 8.401 -15.139 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.245 10.754 -14.811 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.715 10.580 -15.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -5.315 12.326 -16.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.644 11.280 -17.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.240 11.047 -17.130 1.00 0.00 H new ATOM 425 N GLY A 27 -5.482 5.611 -17.806 1.00 0.00 N ATOM 426 CA GLY A 27 -4.884 4.310 -17.571 1.00 0.00 C ATOM 427 C GLY A 27 -3.911 4.320 -16.408 1.00 0.00 C ATOM 428 O GLY A 27 -3.797 5.316 -15.694 1.00 0.00 O ATOM 0 H GLY A 27 -6.130 5.922 -17.082 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.671 3.582 -17.376 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.365 3.984 -18.472 1.00 0.00 H new ATOM 432 N TYR A 28 -3.209 3.209 -16.217 1.00 0.00 N ATOM 433 CA TYR A 28 -2.244 3.092 -15.130 1.00 0.00 C ATOM 434 C TYR A 28 -0.833 3.401 -15.619 1.00 0.00 C ATOM 435 O TYR A 28 -0.571 3.419 -16.822 1.00 0.00 O ATOM 436 CB TYR A 28 -2.291 1.687 -14.527 1.00 0.00 C ATOM 437 CG TYR A 28 -3.485 1.453 -13.629 1.00 0.00 C ATOM 438 CD1 TYR A 28 -4.768 1.365 -14.155 1.00 0.00 C ATOM 439 CD2 TYR A 28 -3.329 1.318 -12.255 1.00 0.00 C ATOM 440 CE1 TYR A 28 -5.861 1.151 -13.338 1.00 0.00 C ATOM 441 CE2 TYR A 28 -4.417 1.103 -11.431 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.680 1.021 -11.977 1.00 0.00 C ATOM 443 OH TYR A 28 -6.767 0.807 -11.160 1.00 0.00 O ATOM 0 H TYR A 28 -3.290 2.376 -16.801 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.510 3.818 -14.362 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -2.305 0.955 -15.334 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -1.378 1.515 -13.956 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.913 1.466 -15.220 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.341 1.382 -11.824 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.852 1.086 -13.763 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -4.279 1.000 -10.365 1.00 0.00 H new ATOM 0 HH TYR A 28 -6.468 0.737 -10.229 1.00 0.00 H new ATOM 453 N ARG A 29 0.073 3.643 -14.677 1.00 0.00 N ATOM 454 CA ARG A 29 1.458 3.952 -15.011 1.00 0.00 C ATOM 455 C ARG A 29 2.419 3.099 -14.188 1.00 0.00 C ATOM 456 O ARG A 29 2.069 2.618 -13.111 1.00 0.00 O ATOM 457 CB ARG A 29 1.744 5.436 -14.771 1.00 0.00 C ATOM 458 CG ARG A 29 0.929 6.364 -15.658 1.00 0.00 C ATOM 459 CD ARG A 29 -0.421 6.685 -15.036 1.00 0.00 C ATOM 460 NE ARG A 29 -0.355 7.847 -14.153 1.00 0.00 N ATOM 461 CZ ARG A 29 -0.353 9.102 -14.588 1.00 0.00 C ATOM 462 NH1 ARG A 29 -0.414 9.356 -15.888 1.00 0.00 N ATOM 463 NH2 ARG A 29 -0.291 10.105 -13.723 1.00 0.00 N ATOM 0 H ARG A 29 -0.127 3.631 -13.677 1.00 0.00 H new ATOM 0 HA ARG A 29 1.610 3.725 -16.066 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.539 5.673 -13.727 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.804 5.625 -14.939 1.00 0.00 H new ATOM 0 HG2 ARG A 29 1.483 7.288 -15.826 1.00 0.00 H new ATOM 0 HG3 ARG A 29 0.781 5.900 -16.633 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.149 6.871 -15.826 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.775 5.822 -14.473 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.308 7.686 -13.147 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.463 8.587 -16.556 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.412 10.321 -16.220 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -0.245 9.913 -12.722 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.290 11.068 -14.058 1.00 0.00 H new ATOM 477 N GLN A 30 3.630 2.916 -14.705 1.00 0.00 N ATOM 478 CA GLN A 30 4.640 2.119 -14.018 1.00 0.00 C ATOM 479 C GLN A 30 5.521 2.999 -13.137 1.00 0.00 C ATOM 480 O GLN A 30 6.506 3.574 -13.602 1.00 0.00 O ATOM 481 CB GLN A 30 5.503 1.367 -15.033 1.00 0.00 C ATOM 482 CG GLN A 30 6.658 0.605 -14.403 1.00 0.00 C ATOM 483 CD GLN A 30 7.656 0.105 -15.428 1.00 0.00 C ATOM 484 OE1 GLN A 30 8.168 0.876 -16.240 1.00 0.00 O ATOM 485 NE2 GLN A 30 7.938 -1.192 -15.397 1.00 0.00 N ATOM 0 H GLN A 30 3.935 3.308 -15.596 1.00 0.00 H new ATOM 0 HA GLN A 30 4.127 1.398 -13.382 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.875 0.667 -15.584 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.900 2.078 -15.758 1.00 0.00 H new ATOM 0 HG2 GLN A 30 7.169 1.252 -13.690 1.00 0.00 H new ATOM 0 HG3 GLN A 30 6.265 -0.242 -13.841 1.00 0.00 H new ATOM 0 HE21 GLN A 30 7.490 -1.795 -14.707 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.602 -1.586 -16.063 1.00 0.00 H new ATOM 494 N HIS A 31 5.159 3.101 -11.862 1.00 0.00 N ATOM 495 CA HIS A 31 5.917 3.911 -10.915 1.00 0.00 C ATOM 496 C HIS A 31 6.479 3.048 -9.789 1.00 0.00 C ATOM 497 O HIS A 31 5.901 2.021 -9.435 1.00 0.00 O ATOM 498 CB HIS A 31 5.033 5.015 -10.334 1.00 0.00 C ATOM 499 CG HIS A 31 4.611 6.038 -11.343 1.00 0.00 C ATOM 500 ND1 HIS A 31 3.549 6.895 -11.148 1.00 0.00 N ATOM 501 CD2 HIS A 31 5.117 6.341 -12.562 1.00 0.00 C ATOM 502 CE1 HIS A 31 3.418 7.679 -12.203 1.00 0.00 C ATOM 503 NE2 HIS A 31 4.358 7.363 -13.076 1.00 0.00 N ATOM 0 H HIS A 31 4.346 2.633 -11.461 1.00 0.00 H new ATOM 0 HA HIS A 31 6.750 4.367 -11.450 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.144 4.563 -9.893 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.571 5.513 -9.527 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.961 5.867 -13.041 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.670 8.447 -12.330 1.00 0.00 H new ATOM 0 HE2 HIS A 31 4.497 7.806 -13.984 1.00 0.00 H new ATOM 512 N TRP A 32 7.608 3.472 -9.233 1.00 0.00 N ATOM 513 CA TRP A 32 8.248 2.737 -8.148 1.00 0.00 C ATOM 514 C TRP A 32 7.613 3.084 -6.806 1.00 0.00 C ATOM 515 O TRP A 32 7.195 4.220 -6.582 1.00 0.00 O ATOM 516 CB TRP A 32 9.747 3.043 -8.112 1.00 0.00 C ATOM 517 CG TRP A 32 10.466 2.356 -6.991 1.00 0.00 C ATOM 518 CD1 TRP A 32 11.193 2.950 -5.999 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.528 0.947 -6.748 1.00 0.00 C ATOM 520 NE1 TRP A 32 11.704 1.994 -5.154 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.310 0.757 -5.592 1.00 0.00 C ATOM 522 CE3 TRP A 32 9.999 -0.174 -7.394 1.00 0.00 C ATOM 523 CZ2 TRP A 32 11.574 -0.507 -5.071 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.261 -1.427 -6.876 1.00 0.00 C ATOM 525 CH2 TRP A 32 11.042 -1.586 -5.724 1.00 0.00 C ATOM 0 H TRP A 32 8.099 4.320 -9.515 1.00 0.00 H new ATOM 0 HA TRP A 32 8.106 1.672 -8.331 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.195 2.743 -9.059 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.889 4.120 -8.019 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.344 4.014 -5.894 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.283 2.176 -4.334 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.396 -0.062 -8.283 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.177 -0.632 -4.184 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 9.857 -2.300 -7.368 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.228 -2.580 -5.344 1.00 0.00 H new ATOM 536 N VAL A 33 7.545 2.099 -5.916 1.00 0.00 N ATOM 537 CA VAL A 33 6.962 2.302 -4.595 1.00 0.00 C ATOM 538 C VAL A 33 7.816 1.652 -3.512 1.00 0.00 C ATOM 539 O VAL A 33 8.409 0.595 -3.725 1.00 0.00 O ATOM 540 CB VAL A 33 5.533 1.731 -4.519 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.845 2.184 -3.240 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.729 2.145 -5.742 1.00 0.00 C ATOM 0 H VAL A 33 7.886 1.153 -6.086 1.00 0.00 H new ATOM 0 HA VAL A 33 6.925 3.378 -4.427 1.00 0.00 H new ATOM 0 HB VAL A 33 5.595 0.643 -4.504 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.837 1.771 -3.203 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.412 1.833 -2.378 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.792 3.273 -3.221 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.722 1.733 -5.672 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.674 3.233 -5.790 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.214 1.766 -6.642 1.00 0.00 H new ATOM 552 N VAL A 34 7.873 2.292 -2.348 1.00 0.00 N ATOM 553 CA VAL A 34 8.653 1.775 -1.230 1.00 0.00 C ATOM 554 C VAL A 34 7.916 1.971 0.091 1.00 0.00 C ATOM 555 O VAL A 34 7.596 3.096 0.474 1.00 0.00 O ATOM 556 CB VAL A 34 10.030 2.459 -1.143 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.779 1.997 0.098 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.842 2.183 -2.399 1.00 0.00 C ATOM 0 H VAL A 34 7.389 3.169 -2.155 1.00 0.00 H new ATOM 0 HA VAL A 34 8.796 0.709 -1.409 1.00 0.00 H new ATOM 0 HB VAL A 34 9.877 3.535 -1.066 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.750 2.491 0.142 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.202 2.251 0.987 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.923 0.917 0.055 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.812 2.674 -2.320 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.987 1.108 -2.510 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.310 2.569 -3.268 1.00 0.00 H new ATOM 568 N PHE A 35 7.651 0.868 0.783 1.00 0.00 N ATOM 569 CA PHE A 35 6.951 0.918 2.061 1.00 0.00 C ATOM 570 C PHE A 35 7.941 0.934 3.223 1.00 0.00 C ATOM 571 O PHE A 35 8.830 0.086 3.308 1.00 0.00 O ATOM 572 CB PHE A 35 6.008 -0.279 2.197 1.00 0.00 C ATOM 573 CG PHE A 35 5.398 -0.409 3.563 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.668 0.632 4.113 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.556 -1.573 4.298 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.105 0.515 5.370 1.00 0.00 C ATOM 577 CE2 PHE A 35 4.995 -1.696 5.556 1.00 0.00 C ATOM 578 CZ PHE A 35 4.270 -0.651 6.093 1.00 0.00 C ATOM 0 H PHE A 35 7.910 -0.071 0.480 1.00 0.00 H new ATOM 0 HA PHE A 35 6.367 1.838 2.091 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.211 -0.189 1.459 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.556 -1.192 1.964 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.537 1.546 3.553 1.00 0.00 H new ATOM 0 HD2 PHE A 35 6.124 -2.393 3.884 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.537 1.334 5.786 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.124 -2.609 6.118 1.00 0.00 H new ATOM 0 HZ PHE A 35 3.833 -0.745 7.076 1.00 0.00 H new ATOM 588 N LYS A 36 7.781 1.904 4.115 1.00 0.00 N ATOM 589 CA LYS A 36 8.658 2.033 5.273 1.00 0.00 C ATOM 590 C LYS A 36 7.912 1.700 6.561 1.00 0.00 C ATOM 591 O LYS A 36 6.685 1.778 6.615 1.00 0.00 O ATOM 592 CB LYS A 36 9.227 3.451 5.353 1.00 0.00 C ATOM 593 CG LYS A 36 10.223 3.644 6.483 1.00 0.00 C ATOM 594 CD LYS A 36 11.505 2.866 6.236 1.00 0.00 C ATOM 595 CE LYS A 36 12.706 3.557 6.864 1.00 0.00 C ATOM 596 NZ LYS A 36 13.980 3.164 6.200 1.00 0.00 N ATOM 0 H LYS A 36 7.051 2.614 4.059 1.00 0.00 H new ATOM 0 HA LYS A 36 9.478 1.325 5.156 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.712 3.693 4.407 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.406 4.156 5.479 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.454 4.704 6.588 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.775 3.321 7.423 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.407 1.861 6.646 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.666 2.758 5.163 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.580 4.638 6.797 1.00 0.00 H new ATOM 0 HE3 LYS A 36 12.756 3.307 7.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.784 3.458 6.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 14.002 2.132 6.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 14.045 3.627 5.271 1.00 0.00 H new ATOM 610 N GLU A 37 8.661 1.329 7.595 1.00 0.00 N ATOM 611 CA GLU A 37 8.068 0.985 8.882 1.00 0.00 C ATOM 612 C GLU A 37 6.812 1.812 9.141 1.00 0.00 C ATOM 613 O GLU A 37 5.701 1.283 9.169 1.00 0.00 O ATOM 614 CB GLU A 37 9.079 1.206 10.009 1.00 0.00 C ATOM 615 CG GLU A 37 10.331 0.356 9.879 1.00 0.00 C ATOM 616 CD GLU A 37 11.175 0.363 11.139 1.00 0.00 C ATOM 617 OE1 GLU A 37 10.923 -0.478 12.027 1.00 0.00 O ATOM 618 OE2 GLU A 37 12.088 1.209 11.236 1.00 0.00 O ATOM 0 H GLU A 37 9.678 1.259 7.567 1.00 0.00 H new ATOM 0 HA GLU A 37 7.789 -0.068 8.855 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.365 2.258 10.028 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.600 0.988 10.963 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.046 -0.669 9.643 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.929 0.722 9.044 1.00 0.00 H new ATOM 625 N THR A 38 6.997 3.115 9.332 1.00 0.00 N ATOM 626 CA THR A 38 5.881 4.016 9.591 1.00 0.00 C ATOM 627 C THR A 38 5.813 5.122 8.544 1.00 0.00 C ATOM 628 O THR A 38 5.180 6.156 8.758 1.00 0.00 O ATOM 629 CB THR A 38 5.987 4.654 10.989 1.00 0.00 C ATOM 630 OG1 THR A 38 7.353 4.963 11.285 1.00 0.00 O ATOM 631 CG2 THR A 38 5.431 3.720 12.053 1.00 0.00 C ATOM 0 H THR A 38 7.910 3.570 9.312 1.00 0.00 H new ATOM 0 HA THR A 38 4.972 3.416 9.541 1.00 0.00 H new ATOM 0 HB THR A 38 5.399 5.572 10.990 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.411 5.370 12.175 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.516 4.192 13.032 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.382 3.511 11.841 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.995 2.787 12.049 1.00 0.00 H new ATOM 639 N THR A 39 6.469 4.898 7.409 1.00 0.00 N ATOM 640 CA THR A 39 6.484 5.876 6.329 1.00 0.00 C ATOM 641 C THR A 39 6.278 5.204 4.976 1.00 0.00 C ATOM 642 O THR A 39 6.317 3.977 4.868 1.00 0.00 O ATOM 643 CB THR A 39 7.807 6.664 6.302 1.00 0.00 C ATOM 644 OG1 THR A 39 8.333 6.784 7.629 1.00 0.00 O ATOM 645 CG2 THR A 39 7.600 8.049 5.706 1.00 0.00 C ATOM 0 H THR A 39 6.997 4.047 7.215 1.00 0.00 H new ATOM 0 HA THR A 39 5.662 6.567 6.517 1.00 0.00 H new ATOM 0 HB THR A 39 8.516 6.120 5.678 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.175 7.285 7.603 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.548 8.587 5.697 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.227 7.954 4.686 1.00 0.00 H new ATOM 0 HG23 THR A 39 6.876 8.599 6.307 1.00 0.00 H new ATOM 653 N LEU A 40 6.061 6.013 3.946 1.00 0.00 N ATOM 654 CA LEU A 40 5.850 5.497 2.598 1.00 0.00 C ATOM 655 C LEU A 40 6.261 6.525 1.550 1.00 0.00 C ATOM 656 O LEU A 40 5.988 7.717 1.694 1.00 0.00 O ATOM 657 CB LEU A 40 4.383 5.111 2.402 1.00 0.00 C ATOM 658 CG LEU A 40 4.080 4.208 1.206 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.823 3.390 1.458 1.00 0.00 C ATOM 660 CD2 LEU A 40 3.935 5.035 -0.063 1.00 0.00 C ATOM 0 H LEU A 40 6.026 7.030 4.018 1.00 0.00 H new ATOM 0 HA LEU A 40 6.472 4.611 2.474 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.036 4.611 3.306 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.798 6.025 2.299 1.00 0.00 H new ATOM 0 HG LEU A 40 4.915 3.520 1.074 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.624 2.754 0.596 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.964 2.769 2.342 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.978 4.060 1.617 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.720 4.376 -0.904 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.119 5.747 0.058 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.863 5.575 -0.253 1.00 0.00 H new ATOM 672 N SER A 41 6.919 6.056 0.494 1.00 0.00 N ATOM 673 CA SER A 41 7.369 6.936 -0.579 1.00 0.00 C ATOM 674 C SER A 41 7.373 6.203 -1.917 1.00 0.00 C ATOM 675 O SER A 41 7.707 5.020 -1.989 1.00 0.00 O ATOM 676 CB SER A 41 8.770 7.471 -0.274 1.00 0.00 C ATOM 677 OG SER A 41 9.560 6.490 0.375 1.00 0.00 O ATOM 0 H SER A 41 7.152 5.072 0.359 1.00 0.00 H new ATOM 0 HA SER A 41 6.674 7.773 -0.645 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.255 7.778 -1.200 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.695 8.357 0.356 1.00 0.00 H new ATOM 0 HG SER A 41 10.451 6.856 0.557 1.00 0.00 H new ATOM 683 N TYR A 42 6.999 6.915 -2.974 1.00 0.00 N ATOM 684 CA TYR A 42 6.956 6.333 -4.311 1.00 0.00 C ATOM 685 C TYR A 42 7.618 7.257 -5.329 1.00 0.00 C ATOM 686 O TYR A 42 7.582 8.480 -5.190 1.00 0.00 O ATOM 687 CB TYR A 42 5.510 6.054 -4.722 1.00 0.00 C ATOM 688 CG TYR A 42 4.786 7.271 -5.252 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.599 8.394 -4.456 1.00 0.00 C ATOM 690 CD2 TYR A 42 4.290 7.299 -6.550 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.938 9.508 -4.936 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.628 8.409 -7.038 1.00 0.00 C ATOM 693 CZ TYR A 42 3.454 9.511 -6.227 1.00 0.00 C ATOM 694 OH TYR A 42 2.796 10.619 -6.709 1.00 0.00 O ATOM 0 H TYR A 42 6.721 7.896 -2.932 1.00 0.00 H new ATOM 0 HA TYR A 42 7.508 5.393 -4.289 1.00 0.00 H new ATOM 0 HB2 TYR A 42 5.502 5.276 -5.485 1.00 0.00 H new ATOM 0 HB3 TYR A 42 4.966 5.663 -3.862 1.00 0.00 H new ATOM 0 HD1 TYR A 42 4.977 8.396 -3.444 1.00 0.00 H new ATOM 0 HD2 TYR A 42 4.424 6.438 -7.188 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.801 10.372 -4.303 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.249 8.414 -8.049 1.00 0.00 H new ATOM 0 HH TYR A 42 2.520 10.458 -7.636 1.00 0.00 H new ATOM 704 N TYR A 43 8.221 6.663 -6.352 1.00 0.00 N ATOM 705 CA TYR A 43 8.892 7.431 -7.394 1.00 0.00 C ATOM 706 C TYR A 43 8.395 7.023 -8.778 1.00 0.00 C ATOM 707 O TYR A 43 7.733 5.997 -8.936 1.00 0.00 O ATOM 708 CB TYR A 43 10.407 7.234 -7.306 1.00 0.00 C ATOM 709 CG TYR A 43 10.960 7.413 -5.910 1.00 0.00 C ATOM 710 CD1 TYR A 43 10.593 6.556 -4.880 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.850 8.440 -5.622 1.00 0.00 C ATOM 712 CE1 TYR A 43 11.095 6.717 -3.604 1.00 0.00 C ATOM 713 CE2 TYR A 43 12.359 8.608 -4.348 1.00 0.00 C ATOM 714 CZ TYR A 43 11.979 7.744 -3.343 1.00 0.00 C ATOM 715 OH TYR A 43 12.482 7.908 -2.073 1.00 0.00 O ATOM 0 H TYR A 43 8.259 5.652 -6.482 1.00 0.00 H new ATOM 0 HA TYR A 43 8.659 8.485 -7.240 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.656 6.234 -7.661 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.897 7.941 -7.975 1.00 0.00 H new ATOM 0 HD1 TYR A 43 9.903 5.750 -5.081 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.149 9.119 -6.407 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.797 6.043 -2.814 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.050 9.411 -4.141 1.00 0.00 H new ATOM 0 HH TYR A 43 13.091 8.676 -2.059 1.00 0.00 H new ATOM 725 N LYS A 44 8.719 7.835 -9.778 1.00 0.00 N ATOM 726 CA LYS A 44 8.309 7.561 -11.150 1.00 0.00 C ATOM 727 C LYS A 44 9.250 6.558 -11.810 1.00 0.00 C ATOM 728 O LYS A 44 8.831 5.754 -12.643 1.00 0.00 O ATOM 729 CB LYS A 44 8.277 8.857 -11.963 1.00 0.00 C ATOM 730 CG LYS A 44 7.618 8.706 -13.324 1.00 0.00 C ATOM 731 CD LYS A 44 8.037 9.816 -14.273 1.00 0.00 C ATOM 732 CE LYS A 44 7.182 11.060 -14.087 1.00 0.00 C ATOM 733 NZ LYS A 44 5.933 11.001 -14.896 1.00 0.00 N ATOM 0 H LYS A 44 9.265 8.689 -9.664 1.00 0.00 H new ATOM 0 HA LYS A 44 7.308 7.130 -11.124 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.745 9.620 -11.394 1.00 0.00 H new ATOM 0 HB3 LYS A 44 9.297 9.215 -12.100 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.884 7.740 -13.753 1.00 0.00 H new ATOM 0 HG3 LYS A 44 6.534 8.716 -13.208 1.00 0.00 H new ATOM 0 HD2 LYS A 44 9.085 10.065 -14.104 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.954 9.467 -15.302 1.00 0.00 H new ATOM 0 HE2 LYS A 44 6.927 11.171 -13.033 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.757 11.942 -14.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.378 11.867 -14.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.176 10.921 -15.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 5.372 10.174 -14.608 1.00 0.00 H new ATOM 747 N SER A 45 10.523 6.610 -11.431 1.00 0.00 N ATOM 748 CA SER A 45 11.523 5.707 -11.987 1.00 0.00 C ATOM 749 C SER A 45 12.551 5.316 -10.929 1.00 0.00 C ATOM 750 O SER A 45 13.202 6.174 -10.335 1.00 0.00 O ATOM 751 CB SER A 45 12.225 6.361 -13.178 1.00 0.00 C ATOM 752 OG SER A 45 11.424 6.291 -14.345 1.00 0.00 O ATOM 0 H SER A 45 10.886 7.268 -10.741 1.00 0.00 H new ATOM 0 HA SER A 45 11.013 4.805 -12.325 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.445 7.403 -12.947 1.00 0.00 H new ATOM 0 HB3 SER A 45 13.179 5.866 -13.358 1.00 0.00 H new ATOM 0 HG SER A 45 10.506 6.054 -14.098 1.00 0.00 H new ATOM 758 N GLN A 46 12.688 4.014 -10.699 1.00 0.00 N ATOM 759 CA GLN A 46 13.635 3.508 -9.712 1.00 0.00 C ATOM 760 C GLN A 46 14.979 4.219 -9.834 1.00 0.00 C ATOM 761 O GLN A 46 15.764 4.249 -8.886 1.00 0.00 O ATOM 762 CB GLN A 46 13.825 2.000 -9.883 1.00 0.00 C ATOM 763 CG GLN A 46 12.849 1.168 -9.066 1.00 0.00 C ATOM 764 CD GLN A 46 12.675 -0.234 -9.616 1.00 0.00 C ATOM 765 OE1 GLN A 46 11.777 -0.491 -10.420 1.00 0.00 O ATOM 766 NE2 GLN A 46 13.534 -1.150 -9.186 1.00 0.00 N ATOM 0 H GLN A 46 12.156 3.291 -11.182 1.00 0.00 H new ATOM 0 HA GLN A 46 13.228 3.705 -8.720 1.00 0.00 H new ATOM 0 HB2 GLN A 46 13.713 1.745 -10.937 1.00 0.00 H new ATOM 0 HB3 GLN A 46 14.843 1.736 -9.597 1.00 0.00 H new ATOM 0 HG2 GLN A 46 13.201 1.109 -8.036 1.00 0.00 H new ATOM 0 HG3 GLN A 46 11.881 1.668 -9.044 1.00 0.00 H new ATOM 0 HE21 GLN A 46 14.262 -0.893 -8.520 1.00 0.00 H new ATOM 0 HE22 GLN A 46 13.466 -2.111 -9.522 1.00 0.00 H new ATOM 775 N ASP A 47 15.237 4.789 -11.006 1.00 0.00 N ATOM 776 CA ASP A 47 16.487 5.500 -11.251 1.00 0.00 C ATOM 777 C ASP A 47 16.505 6.836 -10.515 1.00 0.00 C ATOM 778 O ASP A 47 17.529 7.237 -9.964 1.00 0.00 O ATOM 779 CB ASP A 47 16.683 5.728 -12.751 1.00 0.00 C ATOM 780 CG ASP A 47 16.792 4.428 -13.524 1.00 0.00 C ATOM 781 OD1 ASP A 47 17.815 3.729 -13.369 1.00 0.00 O ATOM 782 OD2 ASP A 47 15.853 4.110 -14.284 1.00 0.00 O ATOM 0 H ASP A 47 14.598 4.773 -11.801 1.00 0.00 H new ATOM 0 HA ASP A 47 17.305 4.886 -10.874 1.00 0.00 H new ATOM 0 HB2 ASP A 47 15.847 6.310 -13.140 1.00 0.00 H new ATOM 0 HB3 ASP A 47 17.584 6.319 -12.911 1.00 0.00 H new ATOM 787 N GLU A 48 15.365 7.520 -10.511 1.00 0.00 N ATOM 788 CA GLU A 48 15.252 8.811 -9.844 1.00 0.00 C ATOM 789 C GLU A 48 15.484 8.670 -8.342 1.00 0.00 C ATOM 790 O GLU A 48 15.859 9.629 -7.669 1.00 0.00 O ATOM 791 CB GLU A 48 13.874 9.425 -10.103 1.00 0.00 C ATOM 792 CG GLU A 48 12.839 9.063 -9.051 1.00 0.00 C ATOM 793 CD GLU A 48 11.529 9.801 -9.245 1.00 0.00 C ATOM 794 OE1 GLU A 48 11.033 9.842 -10.390 1.00 0.00 O ATOM 795 OE2 GLU A 48 10.998 10.338 -8.249 1.00 0.00 O ATOM 0 H GLU A 48 14.507 7.201 -10.962 1.00 0.00 H new ATOM 0 HA GLU A 48 16.018 9.470 -10.252 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.971 10.510 -10.147 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.517 9.097 -11.079 1.00 0.00 H new ATOM 0 HG2 GLU A 48 12.655 7.989 -9.082 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.237 9.290 -8.062 1.00 0.00 H new ATOM 802 N ALA A 49 15.257 7.467 -7.825 1.00 0.00 N ATOM 803 CA ALA A 49 15.443 7.199 -6.404 1.00 0.00 C ATOM 804 C ALA A 49 16.879 6.783 -6.107 1.00 0.00 C ATOM 805 O ALA A 49 17.547 6.145 -6.921 1.00 0.00 O ATOM 806 CB ALA A 49 14.472 6.123 -5.939 1.00 0.00 C ATOM 0 H ALA A 49 14.944 6.663 -8.369 1.00 0.00 H new ATOM 0 HA ALA A 49 15.239 8.119 -5.856 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.622 5.933 -4.876 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.449 6.459 -6.107 1.00 0.00 H new ATOM 0 HB3 ALA A 49 14.649 5.206 -6.500 1.00 0.00 H new ATOM 812 N PRO A 50 17.368 7.153 -4.914 1.00 0.00 N ATOM 813 CA PRO A 50 16.583 7.913 -3.938 1.00 0.00 C ATOM 814 C PRO A 50 16.330 9.348 -4.388 1.00 0.00 C ATOM 815 O PRO A 50 15.197 9.827 -4.362 1.00 0.00 O ATOM 816 CB PRO A 50 17.460 7.893 -2.683 1.00 0.00 C ATOM 817 CG PRO A 50 18.847 7.711 -3.195 1.00 0.00 C ATOM 818 CD PRO A 50 18.726 6.857 -4.426 1.00 0.00 C ATOM 0 HA PRO A 50 15.592 7.483 -3.789 1.00 0.00 H new ATOM 0 HB2 PRO A 50 17.365 8.820 -2.118 1.00 0.00 H new ATOM 0 HB3 PRO A 50 17.175 7.081 -2.013 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.305 8.672 -3.430 1.00 0.00 H new ATOM 0 HG3 PRO A 50 19.479 7.231 -2.448 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.484 7.111 -5.167 1.00 0.00 H new ATOM 0 HD3 PRO A 50 18.848 5.799 -4.195 1.00 0.00 H new ATOM 826 N GLY A 51 17.394 10.030 -4.802 1.00 0.00 N ATOM 827 CA GLY A 51 17.266 11.403 -5.253 1.00 0.00 C ATOM 828 C GLY A 51 16.192 12.163 -4.499 1.00 0.00 C ATOM 829 O GLY A 51 16.427 12.651 -3.394 1.00 0.00 O ATOM 0 H GLY A 51 18.342 9.656 -4.833 1.00 0.00 H new ATOM 0 HA2 GLY A 51 18.222 11.913 -5.131 1.00 0.00 H new ATOM 0 HA3 GLY A 51 17.034 11.412 -6.318 1.00 0.00 H new ATOM 833 N ASP A 52 15.011 12.264 -5.099 1.00 0.00 N ATOM 834 CA ASP A 52 13.896 12.971 -4.477 1.00 0.00 C ATOM 835 C ASP A 52 12.564 12.345 -4.880 1.00 0.00 C ATOM 836 O ASP A 52 12.192 12.318 -6.053 1.00 0.00 O ATOM 837 CB ASP A 52 13.919 14.449 -4.870 1.00 0.00 C ATOM 838 CG ASP A 52 12.898 15.267 -4.104 1.00 0.00 C ATOM 839 OD1 ASP A 52 11.711 14.879 -4.097 1.00 0.00 O ATOM 840 OD2 ASP A 52 13.287 16.295 -3.511 1.00 0.00 O ATOM 0 H ASP A 52 14.801 11.866 -6.014 1.00 0.00 H new ATOM 0 HA ASP A 52 14.003 12.889 -3.395 1.00 0.00 H new ATOM 0 HB2 ASP A 52 14.915 14.855 -4.690 1.00 0.00 H new ATOM 0 HB3 ASP A 52 13.726 14.541 -5.939 1.00 0.00 H new ATOM 845 N PRO A 53 11.829 11.828 -3.884 1.00 0.00 N ATOM 846 CA PRO A 53 10.527 11.193 -4.110 1.00 0.00 C ATOM 847 C PRO A 53 9.453 12.198 -4.514 1.00 0.00 C ATOM 848 O PRO A 53 9.448 13.336 -4.044 1.00 0.00 O ATOM 849 CB PRO A 53 10.195 10.572 -2.751 1.00 0.00 C ATOM 850 CG PRO A 53 10.950 11.395 -1.764 1.00 0.00 C ATOM 851 CD PRO A 53 12.210 11.825 -2.462 1.00 0.00 C ATOM 0 HA PRO A 53 10.562 10.472 -4.927 1.00 0.00 H new ATOM 0 HB2 PRO A 53 9.123 10.601 -2.554 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.499 9.526 -2.709 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.365 12.259 -1.447 1.00 0.00 H new ATOM 0 HG3 PRO A 53 11.178 10.818 -0.868 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.536 12.811 -2.131 1.00 0.00 H new ATOM 0 HD3 PRO A 53 13.032 11.136 -2.268 1.00 0.00 H new ATOM 859 N ILE A 54 8.547 11.769 -5.386 1.00 0.00 N ATOM 860 CA ILE A 54 7.468 12.632 -5.850 1.00 0.00 C ATOM 861 C ILE A 54 6.769 13.318 -4.681 1.00 0.00 C ATOM 862 O ILE A 54 6.499 14.518 -4.724 1.00 0.00 O ATOM 863 CB ILE A 54 6.426 11.842 -6.664 1.00 0.00 C ATOM 864 CG1 ILE A 54 7.018 11.406 -8.005 1.00 0.00 C ATOM 865 CG2 ILE A 54 5.174 12.680 -6.878 1.00 0.00 C ATOM 866 CD1 ILE A 54 6.080 10.554 -8.832 1.00 0.00 C ATOM 0 H ILE A 54 8.539 10.830 -5.785 1.00 0.00 H new ATOM 0 HA ILE A 54 7.923 13.387 -6.491 1.00 0.00 H new ATOM 0 HB ILE A 54 6.150 10.949 -6.103 1.00 0.00 H new ATOM 0 HG12 ILE A 54 7.291 12.292 -8.578 1.00 0.00 H new ATOM 0 HG13 ILE A 54 7.937 10.849 -7.823 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.447 12.108 -7.455 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.744 12.944 -5.912 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.433 13.589 -7.421 1.00 0.00 H new ATOM 0 HD11 ILE A 54 6.566 10.282 -9.769 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.827 9.650 -8.279 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.171 11.116 -9.045 1.00 0.00 H new ATOM 878 N GLN A 55 6.482 12.547 -3.636 1.00 0.00 N ATOM 879 CA GLN A 55 5.816 13.081 -2.454 1.00 0.00 C ATOM 880 C GLN A 55 5.886 12.092 -1.296 1.00 0.00 C ATOM 881 O GLN A 55 5.365 10.980 -1.386 1.00 0.00 O ATOM 882 CB GLN A 55 4.356 13.412 -2.771 1.00 0.00 C ATOM 883 CG GLN A 55 3.784 14.525 -1.909 1.00 0.00 C ATOM 884 CD GLN A 55 4.728 15.703 -1.775 1.00 0.00 C ATOM 885 OE1 GLN A 55 4.905 16.482 -2.712 1.00 0.00 O ATOM 886 NE2 GLN A 55 5.341 15.841 -0.605 1.00 0.00 N ATOM 0 H GLN A 55 6.700 11.552 -3.584 1.00 0.00 H new ATOM 0 HA GLN A 55 6.332 13.994 -2.159 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.276 13.699 -3.820 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.752 12.514 -2.639 1.00 0.00 H new ATOM 0 HG2 GLN A 55 2.843 14.866 -2.340 1.00 0.00 H new ATOM 0 HG3 GLN A 55 3.557 14.132 -0.918 1.00 0.00 H new ATOM 0 HE21 GLN A 55 5.165 15.172 0.145 1.00 0.00 H new ATOM 0 HE22 GLN A 55 5.988 16.616 -0.456 1.00 0.00 H new ATOM 895 N GLN A 56 6.534 12.503 -0.211 1.00 0.00 N ATOM 896 CA GLN A 56 6.673 11.651 0.964 1.00 0.00 C ATOM 897 C GLN A 56 5.642 12.017 2.027 1.00 0.00 C ATOM 898 O GLN A 56 5.399 13.195 2.291 1.00 0.00 O ATOM 899 CB GLN A 56 8.084 11.771 1.543 1.00 0.00 C ATOM 900 CG GLN A 56 8.495 13.201 1.854 1.00 0.00 C ATOM 901 CD GLN A 56 9.672 13.275 2.806 1.00 0.00 C ATOM 902 OE1 GLN A 56 9.588 12.831 3.952 1.00 0.00 O ATOM 903 NE2 GLN A 56 10.779 13.840 2.337 1.00 0.00 N ATOM 0 H GLN A 56 6.971 13.420 -0.121 1.00 0.00 H new ATOM 0 HA GLN A 56 6.500 10.620 0.656 1.00 0.00 H new ATOM 0 HB2 GLN A 56 8.145 11.178 2.455 1.00 0.00 H new ATOM 0 HB3 GLN A 56 8.795 11.343 0.836 1.00 0.00 H new ATOM 0 HG2 GLN A 56 8.751 13.712 0.926 1.00 0.00 H new ATOM 0 HG3 GLN A 56 7.648 13.733 2.287 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.805 14.195 1.381 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.603 13.919 2.933 1.00 0.00 H new ATOM 912 N LEU A 57 5.039 11.001 2.633 1.00 0.00 N ATOM 913 CA LEU A 57 4.033 11.216 3.668 1.00 0.00 C ATOM 914 C LEU A 57 4.165 10.179 4.779 1.00 0.00 C ATOM 915 O LEU A 57 4.716 9.099 4.571 1.00 0.00 O ATOM 916 CB LEU A 57 2.629 11.156 3.062 1.00 0.00 C ATOM 917 CG LEU A 57 2.460 11.813 1.692 1.00 0.00 C ATOM 918 CD1 LEU A 57 3.012 10.914 0.597 1.00 0.00 C ATOM 919 CD2 LEU A 57 0.996 12.137 1.433 1.00 0.00 C ATOM 0 H LEU A 57 5.229 10.020 2.426 1.00 0.00 H new ATOM 0 HA LEU A 57 4.194 12.204 4.098 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.335 10.110 2.979 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.935 11.628 3.757 1.00 0.00 H new ATOM 0 HG LEU A 57 3.024 12.746 1.685 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.883 11.398 -0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.072 10.734 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.477 9.964 0.602 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.895 12.604 0.453 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.410 11.218 1.459 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.633 12.821 2.200 1.00 0.00 H new ATOM 931 N ASN A 58 3.653 10.515 5.958 1.00 0.00 N ATOM 932 CA ASN A 58 3.712 9.612 7.102 1.00 0.00 C ATOM 933 C ASN A 58 2.357 8.957 7.349 1.00 0.00 C ATOM 934 O ASN A 58 1.384 9.628 7.697 1.00 0.00 O ATOM 935 CB ASN A 58 4.160 10.370 8.354 1.00 0.00 C ATOM 936 CG ASN A 58 5.669 10.401 8.502 1.00 0.00 C ATOM 937 OD1 ASN A 58 6.361 11.114 7.775 1.00 0.00 O ATOM 938 ND2 ASN A 58 6.186 9.625 9.447 1.00 0.00 N ATOM 0 H ASN A 58 3.193 11.405 6.147 1.00 0.00 H new ATOM 0 HA ASN A 58 4.438 8.830 6.879 1.00 0.00 H new ATOM 0 HB2 ASN A 58 3.781 11.391 8.312 1.00 0.00 H new ATOM 0 HB3 ASN A 58 3.721 9.902 9.235 1.00 0.00 H new ATOM 0 HD21 ASN A 58 7.195 9.603 9.594 1.00 0.00 H new ATOM 0 HD22 ASN A 58 5.574 9.050 10.026 1.00 0.00 H new ATOM 945 N LEU A 59 2.300 7.642 7.166 1.00 0.00 N ATOM 946 CA LEU A 59 1.063 6.894 7.369 1.00 0.00 C ATOM 947 C LEU A 59 0.614 6.970 8.825 1.00 0.00 C ATOM 948 O LEU A 59 -0.492 6.553 9.167 1.00 0.00 O ATOM 949 CB LEU A 59 1.255 5.434 6.958 1.00 0.00 C ATOM 950 CG LEU A 59 1.405 5.172 5.459 1.00 0.00 C ATOM 951 CD1 LEU A 59 1.921 3.763 5.212 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.080 5.389 4.744 1.00 0.00 C ATOM 0 H LEU A 59 3.095 7.072 6.878 1.00 0.00 H new ATOM 0 HA LEU A 59 0.289 7.342 6.746 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.140 5.049 7.464 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.404 4.860 7.323 1.00 0.00 H new ATOM 0 HG LEU A 59 2.132 5.879 5.058 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.021 3.595 4.140 1.00 0.00 H new ATOM 0 HD12 LEU A 59 2.893 3.642 5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.219 3.040 5.628 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.206 5.198 3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.668 4.707 5.149 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.249 6.418 4.892 1.00 0.00 H new ATOM 964 N LYS A 60 1.479 7.508 9.678 1.00 0.00 N ATOM 965 CA LYS A 60 1.171 7.643 11.097 1.00 0.00 C ATOM 966 C LYS A 60 0.127 8.732 11.326 1.00 0.00 C ATOM 967 O LYS A 60 0.446 9.920 11.332 1.00 0.00 O ATOM 968 CB LYS A 60 2.441 7.966 11.888 1.00 0.00 C ATOM 969 CG LYS A 60 2.456 7.369 13.284 1.00 0.00 C ATOM 970 CD LYS A 60 1.443 8.047 14.191 1.00 0.00 C ATOM 971 CE LYS A 60 2.053 9.234 14.920 1.00 0.00 C ATOM 972 NZ LYS A 60 1.044 10.295 15.193 1.00 0.00 N ATOM 0 H LYS A 60 2.399 7.858 9.411 1.00 0.00 H new ATOM 0 HA LYS A 60 0.764 6.694 11.446 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.306 7.599 11.336 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.547 9.048 11.964 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.238 6.302 13.227 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.453 7.468 13.713 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.590 8.381 13.600 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.065 7.328 14.918 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.490 8.897 15.860 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.864 9.649 14.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.499 11.087 15.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 0.645 10.634 14.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.282 9.906 15.785 1.00 0.00 H new ATOM 986 N GLY A 61 -1.122 8.318 11.516 1.00 0.00 N ATOM 987 CA GLY A 61 -2.193 9.270 11.744 1.00 0.00 C ATOM 988 C GLY A 61 -3.059 9.475 10.517 1.00 0.00 C ATOM 989 O GLY A 61 -3.731 10.498 10.387 1.00 0.00 O ATOM 0 H GLY A 61 -1.411 7.340 11.516 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.814 8.922 12.569 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.766 10.226 12.047 1.00 0.00 H new ATOM 993 N CYS A 62 -3.041 8.501 9.614 1.00 0.00 N ATOM 994 CA CYS A 62 -3.829 8.580 8.389 1.00 0.00 C ATOM 995 C CYS A 62 -5.048 7.666 8.466 1.00 0.00 C ATOM 996 O CYS A 62 -5.312 7.055 9.501 1.00 0.00 O ATOM 997 CB CYS A 62 -2.970 8.203 7.180 1.00 0.00 C ATOM 998 SG CYS A 62 -2.653 6.430 7.024 1.00 0.00 S ATOM 0 H CYS A 62 -2.490 7.648 9.707 1.00 0.00 H new ATOM 0 HA CYS A 62 -4.174 9.607 8.275 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -3.463 8.554 6.274 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.017 8.727 7.248 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.711 6.083 7.850 1.00 0.00 H new ATOM 1004 N GLU A 63 -5.787 7.578 7.365 1.00 0.00 N ATOM 1005 CA GLU A 63 -6.979 6.741 7.310 1.00 0.00 C ATOM 1006 C GLU A 63 -6.796 5.598 6.315 1.00 0.00 C ATOM 1007 O GLU A 63 -6.084 5.734 5.320 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.200 7.578 6.923 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.503 7.060 7.507 1.00 0.00 C ATOM 1010 CD GLU A 63 -9.710 7.491 8.946 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -9.376 8.649 9.273 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -10.206 6.670 9.746 1.00 0.00 O ATOM 0 H GLU A 63 -5.581 8.076 6.499 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.139 6.315 8.301 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.046 8.605 7.255 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.283 7.603 5.836 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.336 7.418 6.901 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.514 5.971 7.453 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.444 4.471 6.591 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.354 3.304 5.721 1.00 0.00 C ATOM 1021 C VAL A 64 -8.715 2.637 5.555 1.00 0.00 C ATOM 1022 O VAL A 64 -9.370 2.285 6.536 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.351 2.272 6.269 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.404 0.990 5.452 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -4.944 2.850 6.280 1.00 0.00 C ATOM 0 H VAL A 64 -8.037 4.341 7.410 1.00 0.00 H new ATOM 0 HA VAL A 64 -7.005 3.658 4.751 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.628 2.032 7.296 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.689 0.273 5.854 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.408 0.568 5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.154 1.209 4.414 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.248 2.107 6.670 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.654 3.121 5.265 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -4.920 3.737 6.913 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.134 2.464 4.306 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.417 1.837 4.010 1.00 0.00 C ATOM 1037 C VAL A 65 -10.252 0.691 3.017 1.00 0.00 C ATOM 1038 O VAL A 65 -10.025 0.898 1.825 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.421 2.855 3.439 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.804 2.232 3.320 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.463 4.104 4.306 1.00 0.00 C ATOM 0 H VAL A 65 -8.604 2.749 3.482 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.803 1.446 4.951 1.00 0.00 H new ATOM 0 HB VAL A 65 -11.092 3.144 2.441 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.500 2.966 2.915 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.759 1.369 2.655 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.145 1.913 4.305 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -12.178 4.813 3.888 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.768 3.835 5.317 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.474 4.560 4.335 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.369 -0.547 3.519 1.00 0.00 N ATOM 1052 CA PRO A 66 -10.238 -1.751 2.693 1.00 0.00 C ATOM 1053 C PRO A 66 -11.408 -1.925 1.731 1.00 0.00 C ATOM 1054 O PRO A 66 -12.562 -1.700 2.095 1.00 0.00 O ATOM 1055 CB PRO A 66 -10.218 -2.886 3.721 1.00 0.00 C ATOM 1056 CG PRO A 66 -10.943 -2.340 4.902 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.639 -0.868 4.931 1.00 0.00 C ATOM 0 HA PRO A 66 -9.352 -1.715 2.059 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.708 -3.779 3.334 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -9.197 -3.169 3.979 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.015 -2.515 4.817 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.613 -2.825 5.821 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.478 -0.292 5.321 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.780 -0.648 5.565 1.00 0.00 H new ATOM 1065 N ASP A 67 -11.103 -2.326 0.502 1.00 0.00 N ATOM 1066 CA ASP A 67 -12.130 -2.531 -0.513 1.00 0.00 C ATOM 1067 C ASP A 67 -11.919 -3.856 -1.240 1.00 0.00 C ATOM 1068 O ASP A 67 -12.190 -3.970 -2.435 1.00 0.00 O ATOM 1069 CB ASP A 67 -12.123 -1.378 -1.517 1.00 0.00 C ATOM 1070 CG ASP A 67 -13.024 -0.235 -1.092 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -14.218 -0.487 -0.827 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -12.534 0.912 -1.024 1.00 0.00 O ATOM 0 H ASP A 67 -10.153 -2.516 0.184 1.00 0.00 H new ATOM 0 HA ASP A 67 -13.098 -2.561 -0.013 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -11.104 -1.009 -1.635 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.444 -1.747 -2.491 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.433 -4.855 -0.509 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.185 -6.172 -1.084 1.00 0.00 C ATOM 1079 C VAL A 68 -12.482 -6.959 -1.232 1.00 0.00 C ATOM 1080 O VAL A 68 -13.296 -7.012 -0.311 1.00 0.00 O ATOM 1081 CB VAL A 68 -10.199 -6.983 -0.223 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -10.683 -7.057 1.217 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -10.009 -8.377 -0.802 1.00 0.00 C ATOM 0 H VAL A 68 -11.203 -4.777 0.482 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.747 -6.011 -2.069 1.00 0.00 H new ATOM 0 HB VAL A 68 -9.234 -6.476 -0.231 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.973 -7.634 1.810 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.763 -6.050 1.626 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.659 -7.540 1.248 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.309 -8.937 -0.181 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.968 -8.895 -0.825 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.614 -8.300 -1.815 1.00 0.00 H new ATOM 1093 N ASN A 69 -12.667 -7.571 -2.397 1.00 0.00 N ATOM 1094 CA ASN A 69 -13.866 -8.357 -2.666 1.00 0.00 C ATOM 1095 C ASN A 69 -13.501 -9.767 -3.122 1.00 0.00 C ATOM 1096 O ASN A 69 -13.570 -10.084 -4.310 1.00 0.00 O ATOM 1097 CB ASN A 69 -14.723 -7.670 -3.730 1.00 0.00 C ATOM 1098 CG ASN A 69 -15.447 -6.451 -3.192 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -15.289 -5.344 -3.706 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -16.246 -6.650 -2.150 1.00 0.00 N ATOM 0 H ASN A 69 -12.002 -7.538 -3.170 1.00 0.00 H new ATOM 0 HA ASN A 69 -14.438 -8.430 -1.741 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.090 -7.373 -4.566 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -15.453 -8.380 -4.119 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -16.759 -5.867 -1.744 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -16.347 -7.585 -1.756 1.00 0.00 H new ATOM 1107 N VAL A 70 -13.113 -10.609 -2.170 1.00 0.00 N ATOM 1108 CA VAL A 70 -12.740 -11.986 -2.473 1.00 0.00 C ATOM 1109 C VAL A 70 -13.675 -12.593 -3.512 1.00 0.00 C ATOM 1110 O VAL A 70 -13.285 -13.481 -4.270 1.00 0.00 O ATOM 1111 CB VAL A 70 -12.756 -12.863 -1.207 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -12.306 -14.279 -1.534 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -11.879 -12.253 -0.125 1.00 0.00 C ATOM 0 H VAL A 70 -13.049 -10.362 -1.182 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.727 -11.959 -2.874 1.00 0.00 H new ATOM 0 HB VAL A 70 -13.778 -12.909 -0.830 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -12.323 -14.885 -0.628 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -12.979 -14.713 -2.274 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -11.293 -14.255 -1.935 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -11.902 -12.886 0.762 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.854 -12.175 -0.488 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -12.251 -11.260 0.128 1.00 0.00 H new ATOM 1123 N SER A 71 -14.913 -12.109 -3.541 1.00 0.00 N ATOM 1124 CA SER A 71 -15.907 -12.606 -4.485 1.00 0.00 C ATOM 1125 C SER A 71 -15.346 -12.626 -5.904 1.00 0.00 C ATOM 1126 O SER A 71 -15.400 -13.646 -6.590 1.00 0.00 O ATOM 1127 CB SER A 71 -17.167 -11.741 -4.435 1.00 0.00 C ATOM 1128 OG SER A 71 -18.041 -12.049 -5.507 1.00 0.00 O ATOM 0 H SER A 71 -15.251 -11.373 -2.921 1.00 0.00 H new ATOM 0 HA SER A 71 -16.164 -13.626 -4.200 1.00 0.00 H new ATOM 0 HB2 SER A 71 -17.681 -11.897 -3.487 1.00 0.00 H new ATOM 0 HB3 SER A 71 -16.890 -10.688 -4.479 1.00 0.00 H new ATOM 0 HG SER A 71 -18.839 -11.483 -5.451 1.00 0.00 H new ATOM 1134 N GLY A 72 -14.807 -11.490 -6.337 1.00 0.00 N ATOM 1135 CA GLY A 72 -14.244 -11.398 -7.671 1.00 0.00 C ATOM 1136 C GLY A 72 -12.728 -11.381 -7.661 1.00 0.00 C ATOM 1137 O GLY A 72 -12.104 -10.717 -8.488 1.00 0.00 O ATOM 0 H GLY A 72 -14.750 -10.632 -5.788 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.591 -12.242 -8.267 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.611 -10.493 -8.155 1.00 0.00 H new ATOM 1141 N GLN A 73 -12.136 -12.112 -6.722 1.00 0.00 N ATOM 1142 CA GLN A 73 -10.684 -12.176 -6.607 1.00 0.00 C ATOM 1143 C GLN A 73 -10.062 -10.797 -6.799 1.00 0.00 C ATOM 1144 O GLN A 73 -9.162 -10.619 -7.621 1.00 0.00 O ATOM 1145 CB GLN A 73 -10.113 -13.155 -7.634 1.00 0.00 C ATOM 1146 CG GLN A 73 -10.645 -14.571 -7.487 1.00 0.00 C ATOM 1147 CD GLN A 73 -10.643 -15.049 -6.048 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -11.695 -15.323 -5.471 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -9.457 -15.151 -5.460 1.00 0.00 N ATOM 0 H GLN A 73 -12.639 -12.668 -6.030 1.00 0.00 H new ATOM 0 HA GLN A 73 -10.439 -12.528 -5.605 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.342 -12.792 -8.636 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.027 -13.173 -7.542 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.661 -14.616 -7.879 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.040 -15.247 -8.091 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.610 -14.913 -5.976 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.393 -15.467 -4.492 1.00 0.00 H new ATOM 1158 N LYS A 74 -10.546 -9.823 -6.037 1.00 0.00 N ATOM 1159 CA LYS A 74 -10.037 -8.459 -6.122 1.00 0.00 C ATOM 1160 C LYS A 74 -9.617 -7.948 -4.748 1.00 0.00 C ATOM 1161 O LYS A 74 -10.312 -8.165 -3.755 1.00 0.00 O ATOM 1162 CB LYS A 74 -11.099 -7.533 -6.719 1.00 0.00 C ATOM 1163 CG LYS A 74 -10.612 -6.112 -6.942 1.00 0.00 C ATOM 1164 CD LYS A 74 -11.567 -5.326 -7.824 1.00 0.00 C ATOM 1165 CE LYS A 74 -12.700 -4.716 -7.013 1.00 0.00 C ATOM 1166 NZ LYS A 74 -13.946 -4.579 -7.817 1.00 0.00 N ATOM 0 H LYS A 74 -11.291 -9.953 -5.353 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.161 -8.465 -6.771 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.436 -7.946 -7.670 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.964 -7.512 -6.056 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.505 -5.608 -5.981 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.624 -6.133 -7.403 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -11.021 -4.536 -8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.979 -5.982 -8.591 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.898 -5.338 -6.140 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.396 -3.736 -6.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -14.694 -4.160 -7.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.765 -3.965 -8.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.251 -5.517 -8.148 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.476 -7.268 -4.698 1.00 0.00 N ATOM 1181 CA PHE A 75 -7.964 -6.726 -3.445 1.00 0.00 C ATOM 1182 C PHE A 75 -7.392 -5.326 -3.651 1.00 0.00 C ATOM 1183 O PHE A 75 -6.500 -5.124 -4.475 1.00 0.00 O ATOM 1184 CB PHE A 75 -6.888 -7.648 -2.867 1.00 0.00 C ATOM 1185 CG PHE A 75 -7.198 -9.108 -3.033 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -7.188 -9.695 -4.288 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.500 -9.895 -1.933 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -7.474 -11.038 -4.443 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -7.787 -11.239 -2.081 1.00 0.00 C ATOM 1190 CZ PHE A 75 -7.773 -11.811 -3.338 1.00 0.00 C ATOM 0 H PHE A 75 -7.889 -7.079 -5.510 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.794 -6.661 -2.741 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.936 -7.430 -3.350 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.765 -7.429 -1.806 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.954 -9.096 -5.155 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -7.511 -9.453 -0.948 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.464 -11.483 -5.427 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -8.022 -11.841 -1.215 1.00 0.00 H new ATOM 0 HZ PHE A 75 -7.996 -12.861 -3.457 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.913 -4.364 -2.898 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.457 -2.983 -2.998 1.00 0.00 C ATOM 1202 C CYS A 76 -7.296 -2.361 -1.615 1.00 0.00 C ATOM 1203 O CYS A 76 -7.832 -2.869 -0.629 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.440 -2.158 -3.830 1.00 0.00 C ATOM 1205 SG CYS A 76 -7.828 -0.519 -4.286 1.00 0.00 S ATOM 0 H CYS A 76 -8.652 -4.515 -2.211 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.485 -2.983 -3.491 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.682 -2.709 -4.739 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -9.368 -2.044 -3.269 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.566 -0.429 -3.989 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.552 -1.262 -1.549 1.00 0.00 N ATOM 1212 CA ILE A 77 -6.320 -0.572 -0.286 1.00 0.00 C ATOM 1213 C ILE A 77 -6.462 0.937 -0.450 1.00 0.00 C ATOM 1214 O ILE A 77 -5.590 1.596 -1.018 1.00 0.00 O ATOM 1215 CB ILE A 77 -4.923 -0.887 0.279 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.651 -2.391 0.217 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.803 -0.381 1.709 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -3.182 -2.744 0.299 1.00 0.00 C ATOM 0 H ILE A 77 -6.100 -0.830 -2.355 1.00 0.00 H new ATOM 0 HA ILE A 77 -7.075 -0.931 0.413 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.178 -0.376 -0.331 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.180 -2.882 1.034 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -5.060 -2.788 -0.712 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.810 -0.611 2.094 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.958 0.698 1.727 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.555 -0.866 2.331 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -3.065 -3.827 0.249 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.650 -2.282 -0.533 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.772 -2.378 1.240 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.565 1.481 0.054 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.821 2.914 -0.033 1.00 0.00 C ATOM 1232 C LYS A 78 -7.031 3.673 1.028 1.00 0.00 C ATOM 1233 O LYS A 78 -7.358 3.620 2.215 1.00 0.00 O ATOM 1234 CB LYS A 78 -9.316 3.196 0.129 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.775 4.464 -0.572 1.00 0.00 C ATOM 1236 CD LYS A 78 -11.194 4.837 -0.177 1.00 0.00 C ATOM 1237 CE LYS A 78 -11.212 5.744 1.044 1.00 0.00 C ATOM 1238 NZ LYS A 78 -12.600 6.026 1.505 1.00 0.00 N ATOM 0 H LYS A 78 -8.296 0.950 0.527 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.497 3.257 -1.016 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.881 2.350 -0.262 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.550 3.273 1.191 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.100 5.283 -0.323 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.722 4.324 -1.652 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.685 5.338 -1.011 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.765 3.932 0.032 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.649 5.277 1.852 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -10.710 6.682 0.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.569 6.647 2.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.130 6.495 0.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.071 5.133 1.756 1.00 0.00 H new ATOM 1252 N LEU A 79 -5.993 4.379 0.595 1.00 0.00 N ATOM 1253 CA LEU A 79 -5.157 5.151 1.508 1.00 0.00 C ATOM 1254 C LEU A 79 -5.552 6.624 1.494 1.00 0.00 C ATOM 1255 O LEU A 79 -5.668 7.236 0.431 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.683 5.002 1.131 1.00 0.00 C ATOM 1257 CG LEU A 79 -2.681 5.107 2.282 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -2.750 3.869 3.164 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.271 5.304 1.746 1.00 0.00 C ATOM 0 H LEU A 79 -5.710 4.433 -0.383 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.308 4.763 2.515 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.549 4.035 0.646 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.439 5.766 0.392 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.942 5.975 2.888 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.030 3.961 3.977 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.754 3.772 3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.515 2.986 2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.572 5.377 2.579 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.999 4.456 1.117 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.230 6.220 1.157 1.00 0.00 H new ATOM 1271 N LEU A 80 -5.755 7.189 2.679 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.133 8.592 2.803 1.00 0.00 C ATOM 1273 C LEU A 80 -5.299 9.289 3.873 1.00 0.00 C ATOM 1274 O LEU A 80 -5.547 9.131 5.069 1.00 0.00 O ATOM 1275 CB LEU A 80 -7.620 8.711 3.142 1.00 0.00 C ATOM 1276 CG LEU A 80 -8.584 8.676 1.955 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -10.023 8.580 2.438 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -8.395 9.906 1.078 1.00 0.00 C ATOM 0 H LEU A 80 -5.664 6.697 3.568 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.944 9.080 1.847 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.883 7.901 3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.775 9.644 3.683 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.363 7.791 1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.694 8.556 1.579 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -10.150 7.669 3.023 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.257 9.445 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.089 9.864 0.238 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.588 10.804 1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.372 9.931 0.702 1.00 0.00 H new ATOM 1290 N VAL A 81 -4.310 10.062 3.435 1.00 0.00 N ATOM 1291 CA VAL A 81 -3.441 10.786 4.355 1.00 0.00 C ATOM 1292 C VAL A 81 -3.713 12.285 4.303 1.00 0.00 C ATOM 1293 O VAL A 81 -3.822 12.884 3.233 1.00 0.00 O ATOM 1294 CB VAL A 81 -1.955 10.533 4.039 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.066 11.323 4.987 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -1.640 9.047 4.113 1.00 0.00 C ATOM 0 H VAL A 81 -4.091 10.203 2.449 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.660 10.415 5.356 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.754 10.873 3.023 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.020 11.132 4.749 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.274 12.387 4.879 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.266 11.017 6.014 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.586 8.887 3.887 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.856 8.679 5.116 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.252 8.509 3.389 1.00 0.00 H new ATOM 1306 N PRO A 82 -3.825 12.907 5.486 1.00 0.00 N ATOM 1307 CA PRO A 82 -4.085 14.345 5.602 1.00 0.00 C ATOM 1308 C PRO A 82 -2.892 15.187 5.162 1.00 0.00 C ATOM 1309 O PRO A 82 -1.741 14.786 5.332 1.00 0.00 O ATOM 1310 CB PRO A 82 -4.352 14.538 7.097 1.00 0.00 C ATOM 1311 CG PRO A 82 -3.634 13.412 7.758 1.00 0.00 C ATOM 1312 CD PRO A 82 -3.707 12.255 6.801 1.00 0.00 C ATOM 0 HA PRO A 82 -4.909 14.663 4.963 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -3.981 15.502 7.444 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.419 14.510 7.316 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.598 13.680 7.968 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -4.098 13.160 8.711 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.817 11.628 6.860 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -4.563 11.614 7.010 1.00 0.00 H new ATOM 1320 N SER A 83 -3.176 16.356 4.595 1.00 0.00 N ATOM 1321 CA SER A 83 -2.126 17.253 4.127 1.00 0.00 C ATOM 1322 C SER A 83 -2.515 18.710 4.354 1.00 0.00 C ATOM 1323 O SER A 83 -3.687 19.084 4.288 1.00 0.00 O ATOM 1324 CB SER A 83 -1.845 17.013 2.642 1.00 0.00 C ATOM 1325 OG SER A 83 -0.964 15.918 2.460 1.00 0.00 O ATOM 0 H SER A 83 -4.124 16.703 4.449 1.00 0.00 H new ATOM 0 HA SER A 83 -1.222 17.044 4.699 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.781 16.821 2.118 1.00 0.00 H new ATOM 0 HB3 SER A 83 -1.411 17.910 2.201 1.00 0.00 H new ATOM 0 HG SER A 83 -1.001 15.334 3.246 1.00 0.00 H new ATOM 1331 N PRO A 84 -1.510 19.555 4.628 1.00 0.00 N ATOM 1332 CA PRO A 84 -1.721 20.985 4.869 1.00 0.00 C ATOM 1333 C PRO A 84 -2.135 21.732 3.606 1.00 0.00 C ATOM 1334 O PRO A 84 -2.522 22.899 3.663 1.00 0.00 O ATOM 1335 CB PRO A 84 -0.352 21.470 5.353 1.00 0.00 C ATOM 1336 CG PRO A 84 0.620 20.504 4.766 1.00 0.00 C ATOM 1337 CD PRO A 84 -0.089 19.179 4.721 1.00 0.00 C ATOM 0 HA PRO A 84 -2.527 21.163 5.581 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -0.151 22.487 5.018 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -0.296 21.476 6.442 1.00 0.00 H new ATOM 0 HG2 PRO A 84 0.926 20.817 3.768 1.00 0.00 H new ATOM 0 HG3 PRO A 84 1.524 20.443 5.372 1.00 0.00 H new ATOM 0 HD2 PRO A 84 0.226 18.584 3.864 1.00 0.00 H new ATOM 0 HD3 PRO A 84 0.112 18.585 5.613 1.00 0.00 H new ATOM 1345 N GLU A 85 -2.051 21.051 2.467 1.00 0.00 N ATOM 1346 CA GLU A 85 -2.417 21.652 1.190 1.00 0.00 C ATOM 1347 C GLU A 85 -3.740 21.087 0.682 1.00 0.00 C ATOM 1348 O GLU A 85 -4.476 21.755 -0.043 1.00 0.00 O ATOM 1349 CB GLU A 85 -1.316 21.412 0.154 1.00 0.00 C ATOM 1350 CG GLU A 85 -1.642 21.970 -1.221 1.00 0.00 C ATOM 1351 CD GLU A 85 -1.199 23.411 -1.385 1.00 0.00 C ATOM 1352 OE1 GLU A 85 -1.383 24.200 -0.435 1.00 0.00 O ATOM 1353 OE2 GLU A 85 -0.669 23.750 -2.464 1.00 0.00 O ATOM 0 H GLU A 85 -1.733 20.084 2.403 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.535 22.725 1.343 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.390 21.863 0.510 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.136 20.340 0.069 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.159 21.356 -1.982 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -2.717 21.902 -1.391 1.00 0.00 H new ATOM 1360 N GLY A 86 -4.037 19.850 1.069 1.00 0.00 N ATOM 1361 CA GLY A 86 -5.270 19.215 0.644 1.00 0.00 C ATOM 1362 C GLY A 86 -5.377 17.779 1.119 1.00 0.00 C ATOM 1363 O GLY A 86 -5.297 17.507 2.316 1.00 0.00 O ATOM 0 H GLY A 86 -3.445 19.276 1.670 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -6.118 19.784 1.024 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -5.332 19.240 -0.444 1.00 0.00 H new ATOM 1367 N MET A 87 -5.561 16.859 0.178 1.00 0.00 N ATOM 1368 CA MET A 87 -5.680 15.443 0.508 1.00 0.00 C ATOM 1369 C MET A 87 -4.987 14.580 -0.542 1.00 0.00 C ATOM 1370 O MET A 87 -5.112 14.826 -1.742 1.00 0.00 O ATOM 1371 CB MET A 87 -7.153 15.046 0.620 1.00 0.00 C ATOM 1372 CG MET A 87 -7.380 13.543 0.600 1.00 0.00 C ATOM 1373 SD MET A 87 -8.849 13.050 1.523 1.00 0.00 S ATOM 1374 CE MET A 87 -8.128 12.632 3.109 1.00 0.00 C ATOM 0 H MET A 87 -5.631 17.068 -0.818 1.00 0.00 H new ATOM 0 HA MET A 87 -5.192 15.277 1.469 1.00 0.00 H new ATOM 0 HB2 MET A 87 -7.562 15.455 1.544 1.00 0.00 H new ATOM 0 HB3 MET A 87 -7.707 15.500 -0.202 1.00 0.00 H new ATOM 0 HG2 MET A 87 -7.475 13.208 -0.433 1.00 0.00 H new ATOM 0 HG3 MET A 87 -6.507 13.042 1.019 1.00 0.00 H new ATOM 0 HE1 MET A 87 -8.895 12.207 3.757 1.00 0.00 H new ATOM 0 HE2 MET A 87 -7.330 11.904 2.965 1.00 0.00 H new ATOM 0 HE3 MET A 87 -7.720 13.531 3.571 1.00 0.00 H new ATOM 1384 N SER A 88 -4.257 13.569 -0.083 1.00 0.00 N ATOM 1385 CA SER A 88 -3.541 12.672 -0.983 1.00 0.00 C ATOM 1386 C SER A 88 -4.221 11.308 -1.046 1.00 0.00 C ATOM 1387 O SER A 88 -3.954 10.432 -0.224 1.00 0.00 O ATOM 1388 CB SER A 88 -2.089 12.511 -0.528 1.00 0.00 C ATOM 1389 OG SER A 88 -1.246 12.187 -1.620 1.00 0.00 O ATOM 0 H SER A 88 -4.146 13.350 0.907 1.00 0.00 H new ATOM 0 HA SER A 88 -3.555 13.111 -1.981 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.746 13.434 -0.061 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.026 11.729 0.229 1.00 0.00 H new ATOM 0 HG SER A 88 -0.323 12.091 -1.304 1.00 0.00 H new ATOM 1395 N GLU A 89 -5.103 11.138 -2.026 1.00 0.00 N ATOM 1396 CA GLU A 89 -5.822 9.881 -2.195 1.00 0.00 C ATOM 1397 C GLU A 89 -5.133 8.994 -3.228 1.00 0.00 C ATOM 1398 O GLU A 89 -5.040 9.350 -4.403 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.268 10.148 -2.620 1.00 0.00 C ATOM 1400 CG GLU A 89 -8.006 8.904 -3.085 1.00 0.00 C ATOM 1401 CD GLU A 89 -9.483 9.155 -3.319 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -9.835 9.662 -4.404 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -10.287 8.844 -2.415 1.00 0.00 O ATOM 0 H GLU A 89 -5.336 11.854 -2.714 1.00 0.00 H new ATOM 0 HA GLU A 89 -5.822 9.361 -1.237 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.808 10.589 -1.782 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -7.271 10.884 -3.424 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.553 8.541 -4.007 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.889 8.117 -2.340 1.00 0.00 H new ATOM 1410 N ILE A 90 -4.652 7.839 -2.781 1.00 0.00 N ATOM 1411 CA ILE A 90 -3.972 6.902 -3.666 1.00 0.00 C ATOM 1412 C ILE A 90 -4.671 5.546 -3.673 1.00 0.00 C ATOM 1413 O ILE A 90 -5.085 5.045 -2.628 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.500 6.705 -3.254 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -1.709 7.996 -3.476 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -1.881 5.557 -4.036 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -0.395 8.035 -2.730 1.00 0.00 C ATOM 0 H ILE A 90 -4.721 7.530 -1.811 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.007 7.332 -4.667 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.464 6.457 -2.193 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.516 8.115 -4.542 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.319 8.844 -3.166 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.841 5.430 -3.734 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.433 4.639 -3.833 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.925 5.778 -5.102 1.00 0.00 H new ATOM 0 HD11 ILE A 90 0.111 8.978 -2.934 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.582 7.947 -1.660 1.00 0.00 H new ATOM 0 HD13 ILE A 90 0.234 7.207 -3.058 1.00 0.00 H new ATOM 1429 N TYR A 91 -4.797 4.958 -4.857 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.447 3.661 -5.001 1.00 0.00 C ATOM 1431 C TYR A 91 -4.416 2.555 -5.206 1.00 0.00 C ATOM 1432 O TYR A 91 -3.595 2.617 -6.122 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.426 3.685 -6.176 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.613 4.594 -5.956 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.399 4.480 -4.816 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -7.950 5.568 -6.888 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.486 5.308 -4.611 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.034 6.401 -6.691 1.00 0.00 C ATOM 1439 CZ TYR A 91 -9.799 6.267 -5.551 1.00 0.00 C ATOM 1440 OH TYR A 91 -10.880 7.095 -5.352 1.00 0.00 O ATOM 0 H TYR A 91 -4.458 5.359 -5.731 1.00 0.00 H new ATOM 0 HA TYR A 91 -5.997 3.455 -4.083 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -5.896 4.004 -7.073 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -6.784 2.672 -6.361 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -8.156 3.731 -4.077 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.354 5.676 -7.782 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -10.087 5.205 -3.720 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.281 7.153 -7.426 1.00 0.00 H new ATOM 0 HH TYR A 91 -10.658 8.001 -5.653 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.465 1.543 -4.346 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.536 0.421 -4.432 1.00 0.00 C ATOM 1452 C LEU A 92 -4.287 -0.895 -4.600 1.00 0.00 C ATOM 1453 O LEU A 92 -5.028 -1.317 -3.712 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.658 0.365 -3.181 1.00 0.00 C ATOM 1455 CG LEU A 92 -1.925 1.656 -2.816 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -1.464 1.617 -1.367 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -0.743 1.880 -3.748 1.00 0.00 C ATOM 0 H LEU A 92 -5.137 1.476 -3.582 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.903 0.570 -5.307 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.282 0.074 -2.336 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.918 -0.423 -3.316 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.617 2.490 -2.933 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.944 2.544 -1.125 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.329 1.505 -0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.788 0.774 -1.223 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.233 2.803 -3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.049 1.043 -3.663 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.099 1.954 -4.776 1.00 0.00 H new ATOM 1469 N ARG A 93 -4.088 -1.542 -5.744 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.746 -2.812 -6.028 1.00 0.00 C ATOM 1471 C ARG A 93 -3.723 -3.938 -6.152 1.00 0.00 C ATOM 1472 O ARG A 93 -2.967 -3.999 -7.122 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.565 -2.709 -7.316 1.00 0.00 C ATOM 1474 CG ARG A 93 -6.580 -3.829 -7.483 1.00 0.00 C ATOM 1475 CD ARG A 93 -7.144 -3.863 -8.895 1.00 0.00 C ATOM 1476 NE ARG A 93 -7.628 -2.553 -9.322 1.00 0.00 N ATOM 1477 CZ ARG A 93 -8.738 -1.991 -8.856 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -9.474 -2.622 -7.951 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -9.113 -0.796 -9.294 1.00 0.00 N ATOM 0 H ARG A 93 -3.477 -1.208 -6.489 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.414 -3.041 -5.198 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.087 -1.752 -7.329 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.887 -2.714 -8.169 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -6.109 -4.785 -7.255 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.392 -3.695 -6.769 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -6.374 -4.208 -9.585 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -7.960 -4.584 -8.942 1.00 0.00 H new ATOM 0 HE ARG A 93 -7.084 -2.041 -10.016 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -9.188 -3.540 -7.612 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -10.326 -2.189 -7.594 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -8.549 -0.308 -9.989 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -9.965 -0.366 -8.935 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.707 -4.826 -5.164 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.777 -5.949 -5.161 1.00 0.00 C ATOM 1495 C CYS A 94 -3.176 -6.988 -6.204 1.00 0.00 C ATOM 1496 O CYS A 94 -4.261 -6.918 -6.780 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.726 -6.593 -3.775 1.00 0.00 C ATOM 1498 SG CYS A 94 -1.552 -5.815 -2.642 1.00 0.00 S ATOM 0 H CYS A 94 -4.327 -4.790 -4.355 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.787 -5.569 -5.413 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.721 -6.556 -3.332 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.465 -7.646 -3.885 1.00 0.00 H new ATOM 0 HG CYS A 94 -2.189 -5.015 -1.839 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.290 -7.950 -6.443 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.550 -9.002 -7.418 1.00 0.00 C ATOM 1506 C GLN A 95 -3.200 -10.212 -6.755 1.00 0.00 C ATOM 1507 O GLN A 95 -4.096 -10.836 -7.322 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.250 -9.420 -8.107 1.00 0.00 C ATOM 1509 CG GLN A 95 -0.192 -9.940 -7.146 1.00 0.00 C ATOM 1510 CD GLN A 95 -0.254 -11.444 -6.968 1.00 0.00 C ATOM 1511 OE1 GLN A 95 -0.874 -12.150 -7.763 1.00 0.00 O ATOM 1512 NE2 GLN A 95 0.391 -11.943 -5.920 1.00 0.00 N ATOM 0 H GLN A 95 -1.387 -8.022 -5.975 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.239 -8.607 -8.165 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.471 -10.192 -8.844 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -0.846 -8.566 -8.652 1.00 0.00 H new ATOM 0 HG2 GLN A 95 0.796 -9.662 -7.514 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -0.319 -9.458 -6.177 1.00 0.00 H new ATOM 0 HE21 GLN A 95 0.892 -11.321 -5.286 1.00 0.00 H new ATOM 0 HE22 GLN A 95 0.385 -12.949 -5.749 1.00 0.00 H new ATOM 1521 N ASP A 96 -2.742 -10.536 -5.551 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.279 -11.671 -4.809 1.00 0.00 C ATOM 1523 C ASP A 96 -3.342 -11.364 -3.316 1.00 0.00 C ATOM 1524 O ASP A 96 -2.713 -10.419 -2.841 1.00 0.00 O ATOM 1525 CB ASP A 96 -2.425 -12.917 -5.051 1.00 0.00 C ATOM 1526 CG ASP A 96 -3.205 -14.201 -4.852 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -4.448 -14.166 -4.973 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -2.573 -15.242 -4.578 1.00 0.00 O ATOM 0 H ASP A 96 -2.000 -10.029 -5.068 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.292 -11.860 -5.166 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -2.028 -12.890 -6.066 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -1.571 -12.906 -4.374 1.00 0.00 H new ATOM 1533 N GLU A 97 -4.105 -12.169 -2.583 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.251 -11.981 -1.144 1.00 0.00 C ATOM 1535 C GLU A 97 -2.886 -11.899 -0.465 1.00 0.00 C ATOM 1536 O GLU A 97 -2.686 -11.105 0.453 1.00 0.00 O ATOM 1537 CB GLU A 97 -5.067 -13.124 -0.538 1.00 0.00 C ATOM 1538 CG GLU A 97 -4.396 -14.482 -0.660 1.00 0.00 C ATOM 1539 CD GLU A 97 -5.337 -15.628 -0.344 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -5.446 -15.996 0.844 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -5.964 -16.157 -1.286 1.00 0.00 O ATOM 0 H GLU A 97 -4.631 -12.957 -2.961 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.777 -11.041 -0.978 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.248 -12.911 0.516 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.040 -13.164 -1.027 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.010 -14.603 -1.672 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.541 -14.522 0.015 1.00 0.00 H new ATOM 1548 N GLN A 98 -1.953 -12.727 -0.924 1.00 0.00 N ATOM 1549 CA GLN A 98 -0.609 -12.749 -0.361 1.00 0.00 C ATOM 1550 C GLN A 98 -0.058 -11.335 -0.210 1.00 0.00 C ATOM 1551 O GLN A 98 0.238 -10.890 0.899 1.00 0.00 O ATOM 1552 CB GLN A 98 0.323 -13.580 -1.244 1.00 0.00 C ATOM 1553 CG GLN A 98 0.363 -15.053 -0.870 1.00 0.00 C ATOM 1554 CD GLN A 98 1.005 -15.295 0.482 1.00 0.00 C ATOM 1555 OE1 GLN A 98 1.100 -14.387 1.308 1.00 0.00 O ATOM 1556 NE2 GLN A 98 1.449 -16.525 0.715 1.00 0.00 N ATOM 0 H GLN A 98 -2.103 -13.391 -1.684 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.664 -13.205 0.627 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.005 -13.486 -2.282 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.331 -13.170 -1.181 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.652 -15.450 -0.862 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.914 -15.603 -1.633 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.349 -17.247 0.001 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.890 -16.748 1.608 1.00 0.00 H new ATOM 1565 N GLN A 99 0.077 -10.634 -1.331 1.00 0.00 N ATOM 1566 CA GLN A 99 0.593 -9.271 -1.322 1.00 0.00 C ATOM 1567 C GLN A 99 -0.313 -8.351 -0.510 1.00 0.00 C ATOM 1568 O GLN A 99 0.163 -7.538 0.283 1.00 0.00 O ATOM 1569 CB GLN A 99 0.724 -8.743 -2.752 1.00 0.00 C ATOM 1570 CG GLN A 99 1.477 -7.426 -2.848 1.00 0.00 C ATOM 1571 CD GLN A 99 2.965 -7.585 -2.604 1.00 0.00 C ATOM 1572 OE1 GLN A 99 3.388 -8.414 -1.798 1.00 0.00 O ATOM 1573 NE2 GLN A 99 3.768 -6.789 -3.300 1.00 0.00 N ATOM 0 H GLN A 99 -0.164 -10.988 -2.257 1.00 0.00 H new ATOM 0 HA GLN A 99 1.578 -9.286 -0.855 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.235 -9.489 -3.360 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.272 -8.614 -3.175 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.319 -6.993 -3.836 1.00 0.00 H new ATOM 0 HG3 GLN A 99 1.067 -6.724 -2.122 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.374 -6.116 -3.958 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.779 -6.850 -3.177 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.619 -8.485 -0.712 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.591 -7.664 0.000 1.00 0.00 C ATOM 1584 C TYR A 100 -2.309 -7.663 1.499 1.00 0.00 C ATOM 1585 O TYR A 100 -2.036 -6.619 2.090 1.00 0.00 O ATOM 1586 CB TYR A 100 -4.009 -8.173 -0.264 1.00 0.00 C ATOM 1587 CG TYR A 100 -5.013 -7.735 0.779 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.306 -6.390 0.967 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.668 -8.666 1.575 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -6.222 -5.985 1.919 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.587 -8.270 2.528 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.860 -6.929 2.697 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.774 -6.530 3.645 1.00 0.00 O ATOM 0 H TYR A 100 -2.029 -9.155 -1.363 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.505 -6.641 -0.368 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.336 -7.821 -1.242 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.993 -9.262 -0.306 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.809 -5.648 0.359 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.455 -9.717 1.447 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.437 -4.935 2.053 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.089 -9.007 3.137 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.133 -7.317 4.105 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.377 -8.843 2.108 1.00 0.00 N ATOM 1604 CA ALA A 101 -2.127 -8.980 3.538 1.00 0.00 C ATOM 1605 C ALA A 101 -0.807 -8.325 3.929 1.00 0.00 C ATOM 1606 O ALA A 101 -0.766 -7.468 4.812 1.00 0.00 O ATOM 1607 CB ALA A 101 -2.129 -10.448 3.935 1.00 0.00 C ATOM 0 H ALA A 101 -2.603 -9.717 1.634 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.928 -8.470 4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.941 -10.536 5.005 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.098 -10.887 3.699 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.349 -10.975 3.385 1.00 0.00 H new ATOM 1613 N ARG A 102 0.270 -8.734 3.268 1.00 0.00 N ATOM 1614 CA ARG A 102 1.593 -8.188 3.549 1.00 0.00 C ATOM 1615 C ARG A 102 1.545 -6.665 3.636 1.00 0.00 C ATOM 1616 O ARG A 102 1.769 -6.087 4.699 1.00 0.00 O ATOM 1617 CB ARG A 102 2.585 -8.617 2.467 1.00 0.00 C ATOM 1618 CG ARG A 102 3.294 -9.926 2.775 1.00 0.00 C ATOM 1619 CD ARG A 102 4.434 -10.184 1.802 1.00 0.00 C ATOM 1620 NE ARG A 102 5.341 -11.222 2.285 1.00 0.00 N ATOM 1621 CZ ARG A 102 6.308 -11.755 1.547 1.00 0.00 C ATOM 1622 NH1 ARG A 102 6.493 -11.350 0.298 1.00 0.00 N ATOM 1623 NH2 ARG A 102 7.093 -12.696 2.057 1.00 0.00 N ATOM 0 H ARG A 102 0.253 -9.442 2.534 1.00 0.00 H new ATOM 0 HA ARG A 102 1.924 -8.579 4.511 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.056 -8.714 1.519 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.330 -7.832 2.337 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.682 -9.900 3.793 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.580 -10.748 2.727 1.00 0.00 H new ATOM 0 HD2 ARG A 102 4.026 -10.480 0.836 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.991 -9.261 1.643 1.00 0.00 H new ATOM 0 HE ARG A 102 5.225 -11.556 3.242 1.00 0.00 H new ATOM 0 HH11 ARG A 102 5.892 -10.627 -0.098 1.00 0.00 H new ATOM 0 HH12 ARG A 102 7.236 -11.761 -0.267 1.00 0.00 H new ATOM 0 HH21 ARG A 102 6.954 -13.011 3.017 1.00 0.00 H new ATOM 0 HH22 ARG A 102 7.835 -13.104 1.489 1.00 0.00 H new ATOM 1637 N TRP A 103 1.252 -6.023 2.511 1.00 0.00 N ATOM 1638 CA TRP A 103 1.175 -4.568 2.460 1.00 0.00 C ATOM 1639 C TRP A 103 0.099 -4.046 3.405 1.00 0.00 C ATOM 1640 O TRP A 103 0.395 -3.337 4.366 1.00 0.00 O ATOM 1641 CB TRP A 103 0.888 -4.101 1.032 1.00 0.00 C ATOM 1642 CG TRP A 103 2.102 -4.096 0.153 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.651 -5.168 -0.493 1.00 0.00 C ATOM 1644 CD2 TRP A 103 2.917 -2.966 -0.176 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.759 -4.772 -1.202 1.00 0.00 N ATOM 1646 CE2 TRP A 103 3.943 -3.426 -1.025 1.00 0.00 C ATOM 1647 CE3 TRP A 103 2.880 -1.611 0.163 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 4.921 -2.577 -1.537 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.852 -0.770 -0.346 1.00 0.00 C ATOM 1650 CH2 TRP A 103 4.860 -1.255 -1.189 1.00 0.00 C ATOM 0 H TRP A 103 1.064 -6.487 1.622 1.00 0.00 H new ATOM 0 HA TRP A 103 2.137 -4.167 2.779 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.131 -4.750 0.591 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.467 -3.096 1.064 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.270 -6.178 -0.452 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.349 -5.381 -1.768 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.106 -1.228 0.811 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.700 -2.949 -2.186 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.834 0.279 -0.089 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.604 -0.572 -1.572 1.00 0.00 H new ATOM 1661 N MET A 104 -1.151 -4.400 3.125 1.00 0.00 N ATOM 1662 CA MET A 104 -2.271 -3.968 3.952 1.00 0.00 C ATOM 1663 C MET A 104 -1.866 -3.895 5.421 1.00 0.00 C ATOM 1664 O MET A 104 -1.801 -2.813 6.003 1.00 0.00 O ATOM 1665 CB MET A 104 -3.455 -4.922 3.784 1.00 0.00 C ATOM 1666 CG MET A 104 -4.599 -4.647 4.747 1.00 0.00 C ATOM 1667 SD MET A 104 -4.934 -2.887 4.943 1.00 0.00 S ATOM 1668 CE MET A 104 -6.341 -2.686 3.854 1.00 0.00 C ATOM 0 H MET A 104 -1.413 -4.985 2.332 1.00 0.00 H new ATOM 0 HA MET A 104 -2.568 -2.971 3.625 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.826 -4.850 2.762 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.109 -5.946 3.927 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.499 -5.146 4.388 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.362 -5.078 5.720 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.764 -1.690 3.986 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.021 -2.810 2.819 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.096 -3.436 4.092 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.595 -5.053 6.014 1.00 0.00 N ATOM 1679 CA ALA A 105 -1.195 -5.120 7.414 1.00 0.00 C ATOM 1680 C ALA A 105 -0.206 -4.010 7.755 1.00 0.00 C ATOM 1681 O ALA A 105 -0.234 -3.456 8.853 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.592 -6.481 7.726 1.00 0.00 C ATOM 0 H ALA A 105 -1.645 -5.958 5.546 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.085 -4.980 8.028 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.298 -6.517 8.775 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.329 -7.259 7.529 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.284 -6.644 7.098 1.00 0.00 H new ATOM 1688 N GLY A 106 0.669 -3.690 6.806 1.00 0.00 N ATOM 1689 CA GLY A 106 1.655 -2.649 7.027 1.00 0.00 C ATOM 1690 C GLY A 106 1.023 -1.285 7.223 1.00 0.00 C ATOM 1691 O GLY A 106 1.267 -0.620 8.231 1.00 0.00 O ATOM 0 H GLY A 106 0.712 -4.133 5.888 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.252 -2.899 7.904 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.336 -2.612 6.177 1.00 0.00 H new ATOM 1695 N CYS A 107 0.211 -0.866 6.259 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.455 0.429 6.329 1.00 0.00 C ATOM 1697 C CYS A 107 -1.222 0.576 7.640 1.00 0.00 C ATOM 1698 O CYS A 107 -1.167 1.621 8.289 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.408 0.601 5.145 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.577 0.853 3.559 1.00 0.00 S ATOM 0 H CYS A 107 -0.002 -1.405 5.419 1.00 0.00 H new ATOM 0 HA CYS A 107 0.309 1.205 6.287 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -2.044 -0.281 5.073 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -2.062 1.451 5.339 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.466 0.986 2.620 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.936 -0.477 8.022 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.716 -0.465 9.254 1.00 0.00 C ATOM 1708 C ARG A 108 -1.815 -0.247 10.466 1.00 0.00 C ATOM 1709 O ARG A 108 -2.065 0.635 11.289 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.487 -1.777 9.408 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.752 -1.842 8.568 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.143 -3.279 8.260 1.00 0.00 C ATOM 1713 NE ARG A 108 -5.368 -4.057 9.476 1.00 0.00 N ATOM 1714 CZ ARG A 108 -6.470 -3.969 10.211 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -7.444 -3.142 9.856 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -6.601 -4.710 11.304 1.00 0.00 N ATOM 0 H ARG A 108 -1.991 -1.349 7.496 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.425 0.361 9.197 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.835 -2.606 9.133 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.750 -1.913 10.457 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.567 -1.347 9.097 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.600 -1.298 7.636 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.048 -3.286 7.652 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.358 -3.750 7.668 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.638 -4.703 9.777 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -7.348 -2.571 9.016 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -8.289 -3.077 10.423 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.855 -5.348 11.580 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.448 -4.642 11.868 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.766 -1.056 10.570 1.00 0.00 N ATOM 1731 CA LEU A 109 0.173 -0.953 11.682 1.00 0.00 C ATOM 1732 C LEU A 109 0.716 0.467 11.806 1.00 0.00 C ATOM 1733 O LEU A 109 0.822 1.008 12.906 1.00 0.00 O ATOM 1734 CB LEU A 109 1.328 -1.938 11.493 1.00 0.00 C ATOM 1735 CG LEU A 109 1.005 -3.409 11.758 1.00 0.00 C ATOM 1736 CD1 LEU A 109 1.932 -4.311 10.959 1.00 0.00 C ATOM 1737 CD2 LEU A 109 1.109 -3.718 13.245 1.00 0.00 C ATOM 0 H LEU A 109 -0.544 -1.790 9.898 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.360 -1.200 12.600 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.694 -1.846 10.471 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.144 -1.641 12.152 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.019 -3.600 11.438 1.00 0.00 H new ATOM 0 HD11 LEU A 109 1.687 -5.354 11.160 1.00 0.00 H new ATOM 0 HD12 LEU A 109 1.809 -4.108 9.895 1.00 0.00 H new ATOM 0 HD13 LEU A 109 2.965 -4.118 11.248 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.876 -4.769 13.415 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.122 -3.510 13.590 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.404 -3.096 13.796 1.00 0.00 H new ATOM 1749 N ALA A 110 1.056 1.066 10.669 1.00 0.00 N ATOM 1750 CA ALA A 110 1.584 2.425 10.650 1.00 0.00 C ATOM 1751 C ALA A 110 0.480 3.446 10.901 1.00 0.00 C ATOM 1752 O ALA A 110 0.720 4.503 11.485 1.00 0.00 O ATOM 1753 CB ALA A 110 2.273 2.705 9.323 1.00 0.00 C ATOM 0 H ALA A 110 0.975 0.632 9.750 1.00 0.00 H new ATOM 0 HA ALA A 110 2.316 2.515 11.453 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.662 3.723 9.323 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.095 2.002 9.184 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.556 2.591 8.510 1.00 0.00 H new ATOM 1759 N SER A 111 -0.731 3.124 10.456 1.00 0.00 N ATOM 1760 CA SER A 111 -1.871 4.016 10.629 1.00 0.00 C ATOM 1761 C SER A 111 -1.992 4.469 12.081 1.00 0.00 C ATOM 1762 O SER A 111 -2.482 5.562 12.364 1.00 0.00 O ATOM 1763 CB SER A 111 -3.161 3.320 10.191 1.00 0.00 C ATOM 1764 OG SER A 111 -4.291 4.139 10.435 1.00 0.00 O ATOM 0 H SER A 111 -0.947 2.252 9.973 1.00 0.00 H new ATOM 0 HA SER A 111 -1.711 4.895 10.005 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.105 3.079 9.129 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.269 2.377 10.727 1.00 0.00 H new ATOM 0 HG SER A 111 -4.185 4.991 9.963 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.541 3.620 12.998 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.596 3.930 14.421 1.00 0.00 C ATOM 1772 C LYS A 112 -0.222 4.341 14.942 1.00 0.00 C ATOM 1773 O LYS A 112 -0.102 5.271 15.739 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.111 2.723 15.208 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.549 2.355 14.885 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.524 3.391 15.421 1.00 0.00 C ATOM 1777 CE LYS A 112 -4.920 3.091 16.859 1.00 0.00 C ATOM 1778 NZ LYS A 112 -5.534 4.275 17.523 1.00 0.00 N ATOM 0 H LYS A 112 -1.133 2.711 12.780 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.282 4.765 14.559 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.470 1.865 15.002 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.029 2.933 16.274 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.669 2.266 13.805 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.781 1.380 15.313 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.071 4.381 15.366 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -5.415 3.413 14.794 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -5.624 2.259 16.876 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -4.040 2.775 17.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -5.790 4.031 18.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -4.853 5.061 17.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.388 4.561 17.003 1.00 0.00 H new ATOM 1792 N GLY A 113 0.812 3.642 14.485 1.00 0.00 N ATOM 1793 CA GLY A 113 2.164 3.951 14.915 1.00 0.00 C ATOM 1794 C GLY A 113 3.038 2.716 15.011 1.00 0.00 C ATOM 1795 O GLY A 113 4.245 2.817 15.229 1.00 0.00 O ATOM 0 H GLY A 113 0.738 2.868 13.825 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.612 4.656 14.215 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.129 4.444 15.886 1.00 0.00 H new ATOM 1799 N ARG A 114 2.427 1.547 14.850 1.00 0.00 N ATOM 1800 CA ARG A 114 3.157 0.287 14.923 1.00 0.00 C ATOM 1801 C ARG A 114 3.996 0.071 13.667 1.00 0.00 C ATOM 1802 O ARG A 114 3.638 0.529 12.581 1.00 0.00 O ATOM 1803 CB ARG A 114 2.185 -0.881 15.106 1.00 0.00 C ATOM 1804 CG ARG A 114 1.552 -0.935 16.487 1.00 0.00 C ATOM 1805 CD ARG A 114 0.773 -2.224 16.692 1.00 0.00 C ATOM 1806 NE ARG A 114 0.380 -2.410 18.087 1.00 0.00 N ATOM 1807 CZ ARG A 114 -0.620 -1.753 18.662 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -1.326 -0.871 17.967 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -0.917 -1.977 19.936 1.00 0.00 N ATOM 0 H ARG A 114 1.428 1.446 14.668 1.00 0.00 H new ATOM 0 HA ARG A 114 3.825 0.333 15.783 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.397 -0.808 14.357 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.714 -1.816 14.921 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.328 -0.853 17.248 1.00 0.00 H new ATOM 0 HG3 ARG A 114 0.886 -0.082 16.617 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.117 -2.214 16.063 1.00 0.00 H new ATOM 0 HD3 ARG A 114 1.381 -3.070 16.371 1.00 0.00 H new ATOM 0 HE ARG A 114 0.903 -3.081 18.650 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.101 -0.696 16.988 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.094 -0.368 18.412 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.377 -2.654 20.474 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -1.686 -1.472 20.377 1.00 0.00 H new ATOM 1823 N THR A 115 5.116 -0.629 13.822 1.00 0.00 N ATOM 1824 CA THR A 115 6.007 -0.904 12.702 1.00 0.00 C ATOM 1825 C THR A 115 6.059 -2.396 12.394 1.00 0.00 C ATOM 1826 O THR A 115 5.915 -3.229 13.289 1.00 0.00 O ATOM 1827 CB THR A 115 7.435 -0.399 12.983 1.00 0.00 C ATOM 1828 OG1 THR A 115 7.928 -0.975 14.198 1.00 0.00 O ATOM 1829 CG2 THR A 115 7.461 1.118 13.089 1.00 0.00 C ATOM 0 H THR A 115 5.427 -1.016 14.713 1.00 0.00 H new ATOM 0 HA THR A 115 5.604 -0.372 11.840 1.00 0.00 H new ATOM 0 HB THR A 115 8.073 -0.701 12.153 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.837 -0.650 14.369 1.00 0.00 H new ATOM 0 HG21 THR A 115 8.480 1.451 13.288 1.00 0.00 H new ATOM 0 HG22 THR A 115 7.112 1.554 12.153 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.810 1.437 13.903 1.00 0.00 H new ATOM 1837 N MET A 116 6.266 -2.726 11.124 1.00 0.00 N ATOM 1838 CA MET A 116 6.339 -4.119 10.699 1.00 0.00 C ATOM 1839 C MET A 116 7.241 -4.925 11.629 1.00 0.00 C ATOM 1840 O MET A 116 6.942 -6.071 11.959 1.00 0.00 O ATOM 1841 CB MET A 116 6.856 -4.210 9.262 1.00 0.00 C ATOM 1842 CG MET A 116 6.311 -5.404 8.495 1.00 0.00 C ATOM 1843 SD MET A 116 6.252 -5.118 6.716 1.00 0.00 S ATOM 1844 CE MET A 116 7.744 -4.156 6.477 1.00 0.00 C ATOM 0 H MET A 116 6.386 -2.048 10.371 1.00 0.00 H new ATOM 0 HA MET A 116 5.334 -4.539 10.743 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.592 -3.296 8.731 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.944 -4.265 9.279 1.00 0.00 H new ATOM 0 HG2 MET A 116 6.932 -6.276 8.698 1.00 0.00 H new ATOM 0 HG3 MET A 116 5.309 -5.636 8.855 1.00 0.00 H new ATOM 0 HE1 MET A 116 8.022 -4.171 5.423 1.00 0.00 H new ATOM 0 HE2 MET A 116 7.568 -3.127 6.791 1.00 0.00 H new ATOM 0 HE3 MET A 116 8.552 -4.583 7.071 1.00 0.00 H new ATOM 1854 N ALA A 117 8.346 -4.316 12.046 1.00 0.00 N ATOM 1855 CA ALA A 117 9.291 -4.976 12.938 1.00 0.00 C ATOM 1856 C ALA A 117 8.565 -5.718 14.055 1.00 0.00 C ATOM 1857 O ALA A 117 8.962 -6.816 14.445 1.00 0.00 O ATOM 1858 CB ALA A 117 10.264 -3.962 13.521 1.00 0.00 C ATOM 0 H ALA A 117 8.609 -3.367 11.780 1.00 0.00 H new ATOM 0 HA ALA A 117 9.852 -5.707 12.356 1.00 0.00 H new ATOM 0 HB1 ALA A 117 10.964 -4.469 14.185 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.815 -3.480 12.713 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.711 -3.209 14.083 1.00 0.00 H new ATOM 1864 N ASP A 118 7.499 -5.111 14.567 1.00 0.00 N ATOM 1865 CA ASP A 118 6.717 -5.715 15.639 1.00 0.00 C ATOM 1866 C ASP A 118 6.054 -7.006 15.168 1.00 0.00 C ATOM 1867 O ASP A 118 5.393 -7.032 14.130 1.00 0.00 O ATOM 1868 CB ASP A 118 5.655 -4.734 16.139 1.00 0.00 C ATOM 1869 CG ASP A 118 5.115 -5.112 17.504 1.00 0.00 C ATOM 1870 OD1 ASP A 118 4.403 -6.133 17.598 1.00 0.00 O ATOM 1871 OD2 ASP A 118 5.404 -4.385 18.478 1.00 0.00 O ATOM 0 H ASP A 118 7.157 -4.201 14.257 1.00 0.00 H new ATOM 0 HA ASP A 118 7.394 -5.954 16.459 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.083 -3.732 16.185 1.00 0.00 H new ATOM 0 HB3 ASP A 118 4.833 -4.697 15.424 1.00 0.00 H new ATOM 1876 N SER A 119 6.236 -8.074 15.938 1.00 0.00 N ATOM 1877 CA SER A 119 5.660 -9.369 15.597 1.00 0.00 C ATOM 1878 C SER A 119 4.186 -9.228 15.228 1.00 0.00 C ATOM 1879 O SER A 119 3.692 -9.906 14.328 1.00 0.00 O ATOM 1880 CB SER A 119 5.814 -10.343 16.766 1.00 0.00 C ATOM 1881 OG SER A 119 5.098 -9.893 17.903 1.00 0.00 O ATOM 0 H SER A 119 6.778 -8.068 16.802 1.00 0.00 H new ATOM 0 HA SER A 119 6.197 -9.762 14.733 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.453 -11.329 16.472 1.00 0.00 H new ATOM 0 HB3 SER A 119 6.869 -10.451 17.016 1.00 0.00 H new ATOM 0 HG SER A 119 5.211 -10.534 18.636 1.00 0.00 H new ATOM 1887 N SER A 120 3.489 -8.341 15.932 1.00 0.00 N ATOM 1888 CA SER A 120 2.071 -8.113 15.683 1.00 0.00 C ATOM 1889 C SER A 120 1.785 -8.053 14.185 1.00 0.00 C ATOM 1890 O SER A 120 0.679 -8.359 13.740 1.00 0.00 O ATOM 1891 CB SER A 120 1.617 -6.814 16.352 1.00 0.00 C ATOM 1892 OG SER A 120 1.493 -6.980 17.754 1.00 0.00 O ATOM 0 H SER A 120 3.884 -7.769 16.679 1.00 0.00 H new ATOM 0 HA SER A 120 1.514 -8.947 16.109 1.00 0.00 H new ATOM 0 HB2 SER A 120 2.334 -6.021 16.138 1.00 0.00 H new ATOM 0 HB3 SER A 120 0.661 -6.500 15.934 1.00 0.00 H new ATOM 0 HG SER A 120 2.350 -6.777 18.184 1.00 0.00 H new ATOM 1898 N TYR A 121 2.791 -7.656 13.413 1.00 0.00 N ATOM 1899 CA TYR A 121 2.648 -7.553 11.966 1.00 0.00 C ATOM 1900 C TYR A 121 2.097 -8.849 11.379 1.00 0.00 C ATOM 1901 O TYR A 121 1.011 -8.870 10.798 1.00 0.00 O ATOM 1902 CB TYR A 121 3.995 -7.221 11.322 1.00 0.00 C ATOM 1903 CG TYR A 121 4.085 -7.618 9.865 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.267 -7.024 8.912 1.00 0.00 C ATOM 1905 CD2 TYR A 121 4.988 -8.586 9.443 1.00 0.00 C ATOM 1906 CE1 TYR A 121 3.345 -7.383 7.581 1.00 0.00 C ATOM 1907 CE2 TYR A 121 5.073 -8.950 8.113 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.249 -8.347 7.186 1.00 0.00 C ATOM 1909 OH TYR A 121 4.331 -8.707 5.860 1.00 0.00 O ATOM 0 H TYR A 121 3.714 -7.401 13.765 1.00 0.00 H new ATOM 0 HA TYR A 121 1.943 -6.750 11.753 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.176 -6.150 11.410 1.00 0.00 H new ATOM 0 HB3 TYR A 121 4.787 -7.724 11.876 1.00 0.00 H new ATOM 0 HD1 TYR A 121 2.558 -6.269 9.217 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.634 -9.062 10.166 1.00 0.00 H new ATOM 0 HE1 TYR A 121 2.702 -6.911 6.853 1.00 0.00 H new ATOM 0 HE2 TYR A 121 5.781 -9.703 7.801 1.00 0.00 H new ATOM 0 HH TYR A 121 5.018 -9.397 5.750 1.00 0.00 H new ATOM 1919 N THR A 122 2.853 -9.931 11.535 1.00 0.00 N ATOM 1920 CA THR A 122 2.443 -11.232 11.022 1.00 0.00 C ATOM 1921 C THR A 122 1.064 -11.619 11.544 1.00 0.00 C ATOM 1922 O THR A 122 0.327 -12.358 10.891 1.00 0.00 O ATOM 1923 CB THR A 122 3.452 -12.331 11.405 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.310 -13.453 10.527 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.246 -12.777 12.844 1.00 0.00 C ATOM 0 H THR A 122 3.754 -9.932 12.013 1.00 0.00 H new ATOM 0 HA THR A 122 2.406 -11.146 9.936 1.00 0.00 H new ATOM 0 HB THR A 122 4.457 -11.920 11.310 1.00 0.00 H new ATOM 0 HG1 THR A 122 3.956 -14.147 10.776 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.970 -13.553 13.091 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.384 -11.927 13.512 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.237 -13.171 12.962 1.00 0.00 H new ATOM 1933 N SER A 123 0.721 -11.115 12.725 1.00 0.00 N ATOM 1934 CA SER A 123 -0.569 -11.411 13.337 1.00 0.00 C ATOM 1935 C SER A 123 -1.714 -10.979 12.426 1.00 0.00 C ATOM 1936 O SER A 123 -2.763 -11.621 12.384 1.00 0.00 O ATOM 1937 CB SER A 123 -0.688 -10.710 14.692 1.00 0.00 C ATOM 1938 OG SER A 123 -1.551 -11.423 15.561 1.00 0.00 O ATOM 0 H SER A 123 1.318 -10.500 13.277 1.00 0.00 H new ATOM 0 HA SER A 123 -0.633 -12.489 13.487 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.299 -10.621 15.147 1.00 0.00 H new ATOM 0 HB3 SER A 123 -1.066 -9.698 14.549 1.00 0.00 H new ATOM 0 HG SER A 123 -1.609 -10.956 16.420 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.504 -9.885 11.700 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.519 -9.367 10.790 1.00 0.00 C ATOM 1946 C GLU A 124 -2.541 -10.163 9.488 1.00 0.00 C ATOM 1947 O GLU A 124 -3.606 -10.530 8.990 1.00 0.00 O ATOM 1948 CB GLU A 124 -2.260 -7.888 10.492 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.865 -6.945 11.518 1.00 0.00 C ATOM 1950 CD GLU A 124 -2.164 -7.017 12.861 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -2.572 -7.847 13.700 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -1.208 -6.242 13.072 1.00 0.00 O ATOM 0 H GLU A 124 -0.641 -9.341 11.724 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.490 -9.469 11.274 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.184 -7.719 10.445 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.664 -7.648 9.508 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.816 -5.924 11.141 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.920 -7.186 11.650 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.358 -10.426 8.942 1.00 0.00 N ATOM 1960 CA VAL A 125 -1.241 -11.179 7.699 1.00 0.00 C ATOM 1961 C VAL A 125 -1.986 -12.506 7.788 1.00 0.00 C ATOM 1962 O VAL A 125 -2.736 -12.869 6.882 1.00 0.00 O ATOM 1963 CB VAL A 125 0.233 -11.453 7.346 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.337 -12.177 6.012 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.025 -10.155 7.321 1.00 0.00 C ATOM 0 H VAL A 125 -0.467 -10.129 9.341 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.687 -10.567 6.915 1.00 0.00 H new ATOM 0 HB VAL A 125 0.659 -12.097 8.115 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.386 -12.362 5.779 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -0.195 -13.127 6.071 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -0.105 -11.562 5.229 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.064 -10.368 7.070 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.601 -9.484 6.574 1.00 0.00 H new ATOM 0 HG23 VAL A 125 0.978 -9.681 8.302 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.775 -13.225 8.885 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.427 -14.513 9.092 1.00 0.00 C ATOM 1977 C GLN A 126 -3.939 -14.345 9.204 1.00 0.00 C ATOM 1978 O GLN A 126 -4.692 -14.837 8.364 1.00 0.00 O ATOM 1979 CB GLN A 126 -1.882 -15.188 10.352 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.364 -15.208 10.423 1.00 0.00 C ATOM 1981 CD GLN A 126 0.234 -16.439 9.769 1.00 0.00 C ATOM 1982 OE1 GLN A 126 -0.449 -17.442 9.566 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.518 -16.367 9.435 1.00 0.00 N ATOM 0 H GLN A 126 -1.158 -12.938 9.645 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.212 -15.144 8.229 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.272 -14.671 11.229 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -2.253 -16.212 10.395 1.00 0.00 H new ATOM 0 HG2 GLN A 126 0.031 -14.315 9.938 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.052 -15.168 11.467 1.00 0.00 H new ATOM 0 HE21 GLN A 126 2.047 -15.515 9.622 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.975 -17.164 8.992 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.376 -13.648 10.248 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.798 -13.415 10.469 1.00 0.00 C ATOM 1994 C ALA A 127 -6.516 -13.119 9.156 1.00 0.00 C ATOM 1995 O ALA A 127 -7.611 -13.627 8.909 1.00 0.00 O ATOM 1996 CB ALA A 127 -5.998 -12.270 11.451 1.00 0.00 C ATOM 0 H ALA A 127 -3.766 -13.235 10.954 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.229 -14.322 10.892 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -7.064 -12.107 11.607 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.526 -12.519 12.401 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.547 -11.363 11.049 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.895 -12.296 8.319 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.476 -11.934 7.032 1.00 0.00 C ATOM 2004 C ILE A 128 -6.562 -13.144 6.109 1.00 0.00 C ATOM 2005 O ILE A 128 -7.643 -13.509 5.644 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.659 -10.829 6.337 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.693 -9.542 7.164 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -6.194 -10.578 4.935 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -4.525 -8.620 6.895 1.00 0.00 C ATOM 0 H ILE A 128 -4.989 -11.867 8.509 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.480 -11.560 7.232 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.623 -11.159 6.257 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.621 -9.010 6.955 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.705 -9.800 8.223 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.607 -9.794 4.456 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -6.123 -11.494 4.349 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.236 -10.265 4.994 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.615 -7.728 7.516 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.593 -9.134 7.131 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.524 -8.332 5.844 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.417 -13.765 5.848 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.363 -14.937 4.981 1.00 0.00 C ATOM 2023 C LEU A 129 -6.562 -15.849 5.221 1.00 0.00 C ATOM 2024 O LEU A 129 -7.270 -16.219 4.285 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.064 -15.711 5.216 1.00 0.00 C ATOM 2026 CG LEU A 129 -2.808 -15.127 4.569 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -1.561 -15.804 5.116 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -2.874 -15.268 3.055 1.00 0.00 C ATOM 0 H LEU A 129 -4.514 -13.477 6.224 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.393 -14.594 3.947 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.896 -15.781 6.291 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.199 -16.728 4.848 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.756 -14.066 4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.677 -15.375 4.644 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.507 -15.651 6.194 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.604 -16.872 4.903 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.972 -14.847 2.611 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.951 -16.323 2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -3.747 -14.735 2.678 1.00 0.00 H new ATOM 2040 N ALA A 130 -6.784 -16.205 6.482 1.00 0.00 N ATOM 2041 CA ALA A 130 -7.900 -17.070 6.846 1.00 0.00 C ATOM 2042 C ALA A 130 -9.234 -16.360 6.640 1.00 0.00 C ATOM 2043 O ALA A 130 -10.087 -16.829 5.886 1.00 0.00 O ATOM 2044 CB ALA A 130 -7.762 -17.529 8.290 1.00 0.00 C ATOM 0 H ALA A 130 -6.206 -15.908 7.268 1.00 0.00 H new ATOM 0 HA ALA A 130 -7.879 -17.944 6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -8.602 -18.174 8.549 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -6.830 -18.082 8.409 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.755 -16.661 8.949 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.408 -15.229 7.315 1.00 0.00 N ATOM 2051 CA PHE A 131 -10.639 -14.456 7.206 1.00 0.00 C ATOM 2052 C PHE A 131 -11.147 -14.440 5.767 1.00 0.00 C ATOM 2053 O PHE A 131 -12.293 -14.801 5.497 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.412 -13.023 7.695 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.538 -12.089 7.357 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -12.800 -12.279 7.898 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.336 -11.021 6.497 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -13.838 -11.421 7.589 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.371 -10.160 6.185 1.00 0.00 C ATOM 2060 CZ PHE A 131 -13.624 -10.360 6.731 1.00 0.00 C ATOM 0 H PHE A 131 -8.712 -14.827 7.943 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.393 -14.932 7.833 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -10.272 -13.034 8.776 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.490 -12.640 7.258 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -12.974 -13.107 8.569 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.359 -10.860 6.066 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.816 -11.580 8.018 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.200 -9.331 5.514 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.434 -9.689 6.488 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.286 -14.019 4.848 1.00 0.00 N ATOM 2071 CA LEU A 132 -10.646 -13.955 3.435 1.00 0.00 C ATOM 2072 C LEU A 132 -11.225 -15.283 2.960 1.00 0.00 C ATOM 2073 O LEU A 132 -12.266 -15.319 2.303 1.00 0.00 O ATOM 2074 CB LEU A 132 -9.422 -13.588 2.593 1.00 0.00 C ATOM 2075 CG LEU A 132 -8.739 -12.266 2.942 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.373 -12.180 2.280 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.610 -11.089 2.527 1.00 0.00 C ATOM 0 H LEU A 132 -9.334 -13.717 5.055 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.407 -13.184 3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -8.688 -14.389 2.687 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.723 -13.553 1.546 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.600 -12.226 4.022 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -6.902 -11.232 2.540 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -6.748 -13.003 2.627 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.488 -12.243 1.198 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -9.108 -10.156 2.783 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.782 -11.125 1.451 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.566 -11.142 3.049 1.00 0.00 H new ATOM 2089 N SER A 133 -10.545 -16.374 3.299 1.00 0.00 N ATOM 2090 CA SER A 133 -10.991 -17.705 2.905 1.00 0.00 C ATOM 2091 C SER A 133 -12.409 -17.972 3.402 1.00 0.00 C ATOM 2092 O SER A 133 -13.265 -18.441 2.651 1.00 0.00 O ATOM 2093 CB SER A 133 -10.038 -18.769 3.454 1.00 0.00 C ATOM 2094 OG SER A 133 -10.008 -19.910 2.614 1.00 0.00 O ATOM 0 H SER A 133 -9.684 -16.362 3.845 1.00 0.00 H new ATOM 0 HA SER A 133 -10.990 -17.754 1.816 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.035 -18.352 3.542 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.352 -19.060 4.457 1.00 0.00 H new ATOM 0 HG SER A 133 -9.391 -20.574 2.986 1.00 0.00 H new ATOM 2100 N LEU A 134 -12.650 -17.670 4.673 1.00 0.00 N ATOM 2101 CA LEU A 134 -13.964 -17.876 5.272 1.00 0.00 C ATOM 2102 C LEU A 134 -15.066 -17.329 4.371 1.00 0.00 C ATOM 2103 O LEU A 134 -16.109 -17.960 4.198 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.032 -17.204 6.645 1.00 0.00 C ATOM 2105 CG LEU A 134 -12.905 -17.551 7.618 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -13.051 -16.758 8.908 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -12.892 -19.045 7.908 1.00 0.00 C ATOM 0 H LEU A 134 -11.953 -17.282 5.308 1.00 0.00 H new ATOM 0 HA LEU A 134 -14.117 -18.949 5.391 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.039 -16.124 6.499 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -14.981 -17.469 7.110 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.956 -17.282 7.155 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.240 -17.018 9.589 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -13.011 -15.692 8.686 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -14.007 -16.996 9.375 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.083 -19.274 8.602 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -13.844 -19.338 8.350 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -12.739 -19.595 6.979 1.00 0.00 H new ATOM 2119 N GLN A 135 -14.826 -16.155 3.797 1.00 0.00 N ATOM 2120 CA GLN A 135 -15.798 -15.524 2.912 1.00 0.00 C ATOM 2121 C GLN A 135 -16.351 -16.529 1.907 1.00 0.00 C ATOM 2122 O GLN A 135 -17.555 -16.569 1.652 1.00 0.00 O ATOM 2123 CB GLN A 135 -15.159 -14.346 2.175 1.00 0.00 C ATOM 2124 CG GLN A 135 -14.594 -13.282 3.102 1.00 0.00 C ATOM 2125 CD GLN A 135 -15.672 -12.414 3.720 1.00 0.00 C ATOM 2126 OE1 GLN A 135 -16.808 -12.852 3.903 1.00 0.00 O ATOM 2127 NE2 GLN A 135 -15.321 -11.176 4.045 1.00 0.00 N ATOM 0 H GLN A 135 -13.967 -15.621 3.929 1.00 0.00 H new ATOM 0 HA GLN A 135 -16.623 -15.157 3.522 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.360 -14.719 1.535 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -15.903 -13.889 1.523 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.022 -13.763 3.895 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -13.900 -12.652 2.545 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -14.368 -10.855 3.875 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -16.004 -10.546 4.464 1.00 0.00 H new ATOM 2136 N ARG A 136 -15.464 -17.339 1.339 1.00 0.00 N ATOM 2137 CA ARG A 136 -15.863 -18.343 0.360 1.00 0.00 C ATOM 2138 C ARG A 136 -17.092 -19.111 0.839 1.00 0.00 C ATOM 2139 O ARG A 136 -17.316 -19.259 2.041 1.00 0.00 O ATOM 2140 CB ARG A 136 -14.712 -19.316 0.096 1.00 0.00 C ATOM 2141 CG ARG A 136 -13.495 -18.661 -0.536 1.00 0.00 C ATOM 2142 CD ARG A 136 -12.732 -19.637 -1.418 1.00 0.00 C ATOM 2143 NE ARG A 136 -13.530 -20.083 -2.558 1.00 0.00 N ATOM 2144 CZ ARG A 136 -13.142 -21.036 -3.398 1.00 0.00 C ATOM 2145 NH1 ARG A 136 -11.975 -21.641 -3.226 1.00 0.00 N ATOM 2146 NH2 ARG A 136 -13.924 -21.387 -4.411 1.00 0.00 N ATOM 0 H ARG A 136 -14.464 -17.320 1.540 1.00 0.00 H new ATOM 0 HA ARG A 136 -16.115 -17.829 -0.568 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -14.417 -19.780 1.037 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -15.065 -20.114 -0.557 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.810 -17.802 -1.129 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -12.836 -18.284 0.246 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -11.819 -19.163 -1.778 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.431 -20.501 -0.826 1.00 0.00 H new ATOM 0 HE ARG A 136 -14.434 -19.638 -2.717 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -11.373 -21.375 -2.447 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -11.680 -22.372 -3.873 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -14.823 -20.925 -4.545 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -13.626 -22.119 -5.056 1.00 0.00 H new ATOM 2160 N THR A 137 -17.886 -19.599 -0.109 1.00 0.00 N ATOM 2161 CA THR A 137 -19.092 -20.349 0.215 1.00 0.00 C ATOM 2162 C THR A 137 -18.751 -21.677 0.882 1.00 0.00 C ATOM 2163 O THR A 137 -19.299 -22.016 1.931 1.00 0.00 O ATOM 2164 CB THR A 137 -19.939 -20.622 -1.042 1.00 0.00 C ATOM 2165 OG1 THR A 137 -19.125 -21.208 -2.064 1.00 0.00 O ATOM 2166 CG2 THR A 137 -20.566 -19.337 -1.561 1.00 0.00 C ATOM 0 H THR A 137 -17.715 -19.488 -1.108 1.00 0.00 H new ATOM 0 HA THR A 137 -19.669 -19.735 0.907 1.00 0.00 H new ATOM 0 HB THR A 137 -20.737 -21.314 -0.772 1.00 0.00 H new ATOM 0 HG1 THR A 137 -19.672 -21.380 -2.859 1.00 0.00 H new ATOM 0 HG21 THR A 137 -21.159 -19.555 -2.449 1.00 0.00 H new ATOM 0 HG22 THR A 137 -21.208 -18.909 -0.791 1.00 0.00 H new ATOM 0 HG23 THR A 137 -19.780 -18.626 -1.815 1.00 0.00 H new TER 2174 THR A 137