USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 850 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 26 TYR OH : rot 30:sc= -0.363 USER MOD Set 1.2: A 101 GLN : amide:sc= 0 X(o=-0.36,f=-0.36) USER MOD Set 2.1: A 57 HIS : no HD1:sc= -12.3! C(o=-12!,f=-13!) USER MOD Set 2.2: A 86 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 47 GLN : amide:sc= -3.22! C(o=-6.8!,f=-11!) USER MOD Set 3.2: A 51 SER OG : rot 100:sc= -1.21 USER MOD Set 3.3: A 53 THR OG1 : rot 180:sc= -2.33! USER MOD Set 4.1: A 31 GLN :FLIP amide:sc= -1.26 F(o=-4.4!,f=-3.7) USER MOD Set 4.2: A 76 ASN : amide:sc= -2.42! C(o=-3.7!,f=-8.7!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.302 X(o=-0.3,f=-0.4) USER MOD Single : A 5 HIS : no HD1:sc= -0.249 X(o=-0.25,f=-0.5) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0446 X(o=-0.045,f=-0.33) USER MOD Single : A 8 HIS : no HD1:sc= -1.72 X(o=-1.7,f=-1.9) USER MOD Single : A 9 HIS : no HD1:sc= -0.0293 X(o=-0.029,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0218 USER MOD Single : A 18 GLN : amide:sc= -0.191 K(o=-0.19,f=-0.86) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.263 X(o=-0.26,f=-0.45) USER MOD Single : A 27 HIS :FLIP no HD1:sc= -0.254 F(o=-0.83,f=-0.25) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 TYR OH : rot 174:sc= -1.35! USER MOD Single : A 36 SER OG : rot 180:sc= 0.22 USER MOD Single : A 38 SER OG : rot -117:sc= 0.179! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 120:sc= -0.522 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.00859 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -150:sc= -2.82 USER MOD Single : A 50 SER OG : rot -39:sc= 0.636 USER MOD Single : A 52 MET CE :methyl 167:sc= -17.7! (180deg=-18.8!) USER MOD Single : A 55 HIS : no HD1:sc= -7.1! C(o=-7.1!,f=-12!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.811 USER MOD Single : A 61 THR OG1 : rot -171:sc= -2.27! USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.0188 X(o=-0.019,f=-0.089) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN :FLIP amide:sc= -10.4! C(o=-13!,f=-10!) USER MOD Single : A 73 TYR OH : rot 180:sc= -1.68! USER MOD Single : A 82 SER OG : rot 91:sc= -2.09! USER MOD Single : A 87 THR OG1 : rot 96:sc= -2.62! USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.159 X(o=-0.16,f=-0.0031) USER MOD Single : A 96 TYR OH : rot 150:sc= -1.85! USER MOD Single : A 98 ASN : amide:sc= -3.99! C(o=-4!,f=-8.9!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0078 USER MOD Single : A 113 SER OG : rot 29:sc= 0.836 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -0.0113 X(o=-0.011,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 20.818 -6.441 -6.759 1.00 0.00 N ATOM 2 CA ALA A 1 20.672 -5.571 -5.555 1.00 0.00 C ATOM 3 C ALA A 1 19.550 -4.551 -5.771 1.00 0.00 C ATOM 4 O ALA A 1 19.769 -3.473 -6.287 1.00 0.00 O ATOM 5 CB ALA A 1 22.020 -4.864 -5.412 1.00 0.00 C ATOM 0 H1 ALA A 1 21.582 -7.128 -6.600 1.00 0.00 H new ATOM 0 H2 ALA A 1 19.926 -6.948 -6.931 1.00 0.00 H new ATOM 0 H3 ALA A 1 21.047 -5.854 -7.586 1.00 0.00 H new ATOM 0 HA ALA A 1 20.414 -6.141 -4.662 1.00 0.00 H new ATOM 0 HB1 ALA A 1 21.994 -4.203 -4.546 1.00 0.00 H new ATOM 0 HB2 ALA A 1 22.808 -5.606 -5.279 1.00 0.00 H new ATOM 0 HB3 ALA A 1 22.221 -4.278 -6.309 1.00 0.00 H new ATOM 13 N ARG A 2 18.349 -4.883 -5.380 1.00 0.00 N ATOM 14 CA ARG A 2 17.215 -3.931 -5.562 1.00 0.00 C ATOM 15 C ARG A 2 17.083 -3.543 -7.038 1.00 0.00 C ATOM 16 O ARG A 2 17.970 -3.783 -7.833 1.00 0.00 O ATOM 17 CB ARG A 2 17.582 -2.712 -4.714 1.00 0.00 C ATOM 18 CG ARG A 2 17.689 -3.122 -3.243 1.00 0.00 C ATOM 19 CD ARG A 2 19.155 -3.068 -2.801 1.00 0.00 C ATOM 20 NE ARG A 2 19.110 -2.672 -1.365 1.00 0.00 N ATOM 21 CZ ARG A 2 20.219 -2.448 -0.712 1.00 0.00 C ATOM 22 NH1 ARG A 2 21.003 -1.470 -1.073 1.00 0.00 N ATOM 23 NH2 ARG A 2 20.543 -3.202 0.304 1.00 0.00 N ATOM 0 H ARG A 2 18.104 -5.771 -4.943 1.00 0.00 H new ATOM 0 HA ARG A 2 16.260 -4.362 -5.262 1.00 0.00 H new ATOM 0 HB2 ARG A 2 18.528 -2.291 -5.054 1.00 0.00 H new ATOM 0 HB3 ARG A 2 16.827 -1.934 -4.831 1.00 0.00 H new ATOM 0 HG2 ARG A 2 17.087 -2.456 -2.625 1.00 0.00 H new ATOM 0 HG3 ARG A 2 17.294 -4.129 -3.106 1.00 0.00 H new ATOM 0 HD2 ARG A 2 19.642 -4.035 -2.929 1.00 0.00 H new ATOM 0 HD3 ARG A 2 19.719 -2.347 -3.392 1.00 0.00 H new ATOM 0 HE ARG A 2 18.212 -2.576 -0.891 1.00 0.00 H new ATOM 0 HH11 ARG A 2 20.750 -0.880 -1.865 1.00 0.00 H new ATOM 0 HH12 ARG A 2 21.869 -1.296 -0.563 1.00 0.00 H new ATOM 0 HH21 ARG A 2 19.930 -3.966 0.588 1.00 0.00 H new ATOM 0 HH22 ARG A 2 21.409 -3.027 0.814 1.00 0.00 H new ATOM 37 N ILE A 3 15.983 -2.947 -7.412 1.00 0.00 N ATOM 38 CA ILE A 3 15.797 -2.549 -8.838 1.00 0.00 C ATOM 39 C ILE A 3 16.191 -1.082 -9.041 1.00 0.00 C ATOM 40 O ILE A 3 16.198 -0.297 -8.114 1.00 0.00 O ATOM 41 CB ILE A 3 14.305 -2.744 -9.114 1.00 0.00 C ATOM 42 CG1 ILE A 3 13.984 -4.240 -9.154 1.00 0.00 C ATOM 43 CG2 ILE A 3 13.948 -2.112 -10.461 1.00 0.00 C ATOM 44 CD1 ILE A 3 14.948 -4.944 -10.109 1.00 0.00 C ATOM 0 H ILE A 3 15.205 -2.718 -6.793 1.00 0.00 H new ATOM 0 HA ILE A 3 16.419 -3.139 -9.511 1.00 0.00 H new ATOM 0 HB ILE A 3 13.725 -2.268 -8.323 1.00 0.00 H new ATOM 0 HG12 ILE A 3 14.068 -4.668 -8.155 1.00 0.00 H new ATOM 0 HG13 ILE A 3 12.955 -4.393 -9.480 1.00 0.00 H new ATOM 0 HG21 ILE A 3 12.885 -2.251 -10.658 1.00 0.00 H new ATOM 0 HG22 ILE A 3 14.176 -1.046 -10.435 1.00 0.00 H new ATOM 0 HG23 ILE A 3 14.528 -2.588 -11.251 1.00 0.00 H new ATOM 0 HD11 ILE A 3 14.719 -6.009 -10.137 1.00 0.00 H new ATOM 0 HD12 ILE A 3 14.842 -4.523 -11.109 1.00 0.00 H new ATOM 0 HD13 ILE A 3 15.972 -4.802 -9.763 1.00 0.00 H new ATOM 56 N HIS A 4 16.516 -0.709 -10.249 1.00 0.00 N ATOM 57 CA HIS A 4 16.907 0.706 -10.519 1.00 0.00 C ATOM 58 C HIS A 4 18.154 1.079 -9.714 1.00 0.00 C ATOM 59 O HIS A 4 18.696 0.277 -8.979 1.00 0.00 O ATOM 60 CB HIS A 4 15.710 1.542 -10.068 1.00 0.00 C ATOM 61 CG HIS A 4 14.932 1.992 -11.274 1.00 0.00 C ATOM 62 ND1 HIS A 4 15.549 2.509 -12.402 1.00 0.00 N ATOM 63 CD2 HIS A 4 13.586 2.009 -11.541 1.00 0.00 C ATOM 64 CE1 HIS A 4 14.584 2.813 -13.289 1.00 0.00 C ATOM 65 NE2 HIS A 4 13.368 2.528 -12.815 1.00 0.00 N ATOM 0 H HIS A 4 16.528 -1.324 -11.063 1.00 0.00 H new ATOM 0 HA HIS A 4 17.149 0.871 -11.569 1.00 0.00 H new ATOM 0 HB2 HIS A 4 15.071 0.956 -9.407 1.00 0.00 H new ATOM 0 HB3 HIS A 4 16.050 2.406 -9.498 1.00 0.00 H new ATOM 0 HD2 HIS A 4 12.813 1.671 -10.866 1.00 0.00 H new ATOM 0 HE1 HIS A 4 14.770 3.236 -14.265 1.00 0.00 H new ATOM 0 HE2 HIS A 4 12.473 2.662 -13.285 1.00 0.00 H new ATOM 73 N HIS A 5 18.614 2.294 -9.850 1.00 0.00 N ATOM 74 CA HIS A 5 19.826 2.722 -9.095 1.00 0.00 C ATOM 75 C HIS A 5 19.436 3.676 -7.964 1.00 0.00 C ATOM 76 O HIS A 5 20.270 4.119 -7.198 1.00 0.00 O ATOM 77 CB HIS A 5 20.697 3.443 -10.125 1.00 0.00 C ATOM 78 CG HIS A 5 22.117 2.961 -10.005 1.00 0.00 C ATOM 79 ND1 HIS A 5 22.431 1.623 -9.829 1.00 0.00 N ATOM 80 CD2 HIS A 5 23.317 3.627 -10.035 1.00 0.00 C ATOM 81 CE1 HIS A 5 23.771 1.527 -9.759 1.00 0.00 C ATOM 82 NE2 HIS A 5 24.360 2.720 -9.879 1.00 0.00 N ATOM 0 H HIS A 5 18.203 3.008 -10.451 1.00 0.00 H new ATOM 0 HA HIS A 5 20.345 1.881 -8.636 1.00 0.00 H new ATOM 0 HB2 HIS A 5 20.321 3.255 -11.131 1.00 0.00 H new ATOM 0 HB3 HIS A 5 20.652 4.520 -9.965 1.00 0.00 H new ATOM 0 HD2 HIS A 5 23.434 4.693 -10.161 1.00 0.00 H new ATOM 0 HE1 HIS A 5 24.305 0.599 -9.622 1.00 0.00 H new ATOM 0 HE2 HIS A 5 25.360 2.922 -9.860 1.00 0.00 H new ATOM 90 N HIS A 6 18.177 3.997 -7.851 1.00 0.00 N ATOM 91 CA HIS A 6 17.739 4.923 -6.768 1.00 0.00 C ATOM 92 C HIS A 6 16.483 4.383 -6.081 1.00 0.00 C ATOM 93 O HIS A 6 15.374 4.745 -6.420 1.00 0.00 O ATOM 94 CB HIS A 6 17.439 6.247 -7.471 1.00 0.00 C ATOM 95 CG HIS A 6 18.196 7.354 -6.791 1.00 0.00 C ATOM 96 ND1 HIS A 6 17.641 8.111 -5.771 1.00 0.00 N ATOM 97 CD2 HIS A 6 19.467 7.842 -6.971 1.00 0.00 C ATOM 98 CE1 HIS A 6 18.567 9.005 -5.380 1.00 0.00 C ATOM 99 NE2 HIS A 6 19.699 8.885 -6.079 1.00 0.00 N ATOM 0 H HIS A 6 17.433 3.659 -8.461 1.00 0.00 H new ATOM 0 HA HIS A 6 18.498 5.036 -5.994 1.00 0.00 H new ATOM 0 HB2 HIS A 6 17.725 6.187 -8.521 1.00 0.00 H new ATOM 0 HB3 HIS A 6 16.369 6.452 -7.443 1.00 0.00 H new ATOM 0 HD2 HIS A 6 20.178 7.473 -7.695 1.00 0.00 H new ATOM 0 HE1 HIS A 6 18.414 9.732 -4.596 1.00 0.00 H new ATOM 0 HE2 HIS A 6 20.550 9.438 -5.980 1.00 0.00 H new ATOM 107 N HIS A 7 16.649 3.522 -5.116 1.00 0.00 N ATOM 108 CA HIS A 7 15.465 2.962 -4.406 1.00 0.00 C ATOM 109 C HIS A 7 15.059 3.890 -3.258 1.00 0.00 C ATOM 110 O HIS A 7 15.606 4.962 -3.093 1.00 0.00 O ATOM 111 CB HIS A 7 15.931 1.609 -3.869 1.00 0.00 C ATOM 112 CG HIS A 7 14.974 0.536 -4.312 1.00 0.00 C ATOM 113 ND1 HIS A 7 14.612 0.371 -5.640 1.00 0.00 N ATOM 114 CD2 HIS A 7 14.295 -0.433 -3.616 1.00 0.00 C ATOM 115 CE1 HIS A 7 13.753 -0.663 -5.701 1.00 0.00 C ATOM 116 NE2 HIS A 7 13.525 -1.189 -4.494 1.00 0.00 N ATOM 0 H HIS A 7 17.553 3.182 -4.788 1.00 0.00 H new ATOM 0 HA HIS A 7 14.596 2.861 -5.056 1.00 0.00 H new ATOM 0 HB2 HIS A 7 16.935 1.388 -4.232 1.00 0.00 H new ATOM 0 HB3 HIS A 7 15.984 1.637 -2.781 1.00 0.00 H new ATOM 0 HD2 HIS A 7 14.350 -0.585 -2.548 1.00 0.00 H new ATOM 0 HE1 HIS A 7 13.303 -1.024 -6.614 1.00 0.00 H new ATOM 0 HE2 HIS A 7 12.917 -1.976 -4.266 1.00 0.00 H new ATOM 124 N HIS A 8 14.105 3.490 -2.461 1.00 0.00 N ATOM 125 CA HIS A 8 13.674 4.359 -1.328 1.00 0.00 C ATOM 126 C HIS A 8 14.771 4.415 -0.262 1.00 0.00 C ATOM 127 O HIS A 8 15.945 4.325 -0.562 1.00 0.00 O ATOM 128 CB HIS A 8 12.412 3.699 -0.771 1.00 0.00 C ATOM 129 CG HIS A 8 12.755 2.349 -0.203 1.00 0.00 C ATOM 130 ND1 HIS A 8 12.719 1.194 -0.968 1.00 0.00 N ATOM 131 CD2 HIS A 8 13.138 1.953 1.055 1.00 0.00 C ATOM 132 CE1 HIS A 8 13.069 0.169 -0.171 1.00 0.00 C ATOM 133 NE2 HIS A 8 13.335 0.576 1.073 1.00 0.00 N ATOM 0 H HIS A 8 13.607 2.603 -2.545 1.00 0.00 H new ATOM 0 HA HIS A 8 13.485 5.385 -1.644 1.00 0.00 H new ATOM 0 HB2 HIS A 8 11.972 4.328 0.002 1.00 0.00 H new ATOM 0 HB3 HIS A 8 11.667 3.594 -1.559 1.00 0.00 H new ATOM 0 HD2 HIS A 8 13.267 2.611 1.902 1.00 0.00 H new ATOM 0 HE1 HIS A 8 13.128 -0.859 -0.497 1.00 0.00 H new ATOM 0 HE2 HIS A 8 13.621 0.001 1.865 1.00 0.00 H new ATOM 141 N HIS A 9 14.400 4.563 0.980 1.00 0.00 N ATOM 142 CA HIS A 9 15.428 4.626 2.059 1.00 0.00 C ATOM 143 C HIS A 9 16.307 5.866 1.876 1.00 0.00 C ATOM 144 O HIS A 9 17.509 5.819 2.050 1.00 0.00 O ATOM 145 CB HIS A 9 16.255 3.352 1.892 1.00 0.00 C ATOM 146 CG HIS A 9 16.596 2.796 3.247 1.00 0.00 C ATOM 147 ND1 HIS A 9 17.905 2.661 3.683 1.00 0.00 N ATOM 148 CD2 HIS A 9 15.810 2.339 4.275 1.00 0.00 C ATOM 149 CE1 HIS A 9 17.868 2.141 4.923 1.00 0.00 C ATOM 150 NE2 HIS A 9 16.614 1.925 5.332 1.00 0.00 N ATOM 0 H HIS A 9 13.433 4.643 1.294 1.00 0.00 H new ATOM 0 HA HIS A 9 14.984 4.695 3.052 1.00 0.00 H new ATOM 0 HB2 HIS A 9 15.696 2.616 1.315 1.00 0.00 H new ATOM 0 HB3 HIS A 9 17.167 3.568 1.335 1.00 0.00 H new ATOM 0 HD2 HIS A 9 14.731 2.306 4.265 1.00 0.00 H new ATOM 0 HE1 HIS A 9 18.744 1.924 5.516 1.00 0.00 H new ATOM 0 HE2 HIS A 9 16.312 1.540 6.227 1.00 0.00 H new ATOM 158 N ILE A 10 15.716 6.974 1.523 1.00 0.00 N ATOM 159 CA ILE A 10 16.515 8.217 1.325 1.00 0.00 C ATOM 160 C ILE A 10 16.697 8.949 2.658 1.00 0.00 C ATOM 161 O ILE A 10 16.100 8.599 3.657 1.00 0.00 O ATOM 162 CB ILE A 10 15.693 9.062 0.352 1.00 0.00 C ATOM 163 CG1 ILE A 10 15.710 8.404 -1.030 1.00 0.00 C ATOM 164 CG2 ILE A 10 16.296 10.465 0.256 1.00 0.00 C ATOM 165 CD1 ILE A 10 14.918 9.263 -2.016 1.00 0.00 C ATOM 0 H ILE A 10 14.714 7.073 1.363 1.00 0.00 H new ATOM 0 HA ILE A 10 17.514 8.011 0.941 1.00 0.00 H new ATOM 0 HB ILE A 10 14.666 9.134 0.710 1.00 0.00 H new ATOM 0 HG12 ILE A 10 16.737 8.288 -1.376 1.00 0.00 H new ATOM 0 HG13 ILE A 10 15.278 7.405 -0.974 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.709 11.067 -0.438 1.00 0.00 H new ATOM 0 HG22 ILE A 10 16.286 10.933 1.240 1.00 0.00 H new ATOM 0 HG23 ILE A 10 17.323 10.396 -0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 10 14.931 8.793 -3.000 1.00 0.00 H new ATOM 0 HD12 ILE A 10 13.888 9.356 -1.672 1.00 0.00 H new ATOM 0 HD13 ILE A 10 15.370 10.253 -2.081 1.00 0.00 H new ATOM 177 N GLU A 11 17.519 9.963 2.680 1.00 0.00 N ATOM 178 CA GLU A 11 17.741 10.716 3.949 1.00 0.00 C ATOM 179 C GLU A 11 16.683 11.811 4.107 1.00 0.00 C ATOM 180 O GLU A 11 15.803 11.722 4.940 1.00 0.00 O ATOM 181 CB GLU A 11 19.134 11.329 3.806 1.00 0.00 C ATOM 182 CG GLU A 11 19.329 12.412 4.869 1.00 0.00 C ATOM 183 CD GLU A 11 20.824 12.620 5.116 1.00 0.00 C ATOM 184 OE1 GLU A 11 21.554 11.644 5.065 1.00 0.00 O ATOM 185 OE2 GLU A 11 21.214 13.751 5.353 1.00 0.00 O ATOM 0 H GLU A 11 18.046 10.303 1.876 1.00 0.00 H new ATOM 0 HA GLU A 11 17.666 10.076 4.828 1.00 0.00 H new ATOM 0 HB2 GLU A 11 19.895 10.557 3.915 1.00 0.00 H new ATOM 0 HB3 GLU A 11 19.254 11.756 2.810 1.00 0.00 H new ATOM 0 HG2 GLU A 11 18.870 13.345 4.541 1.00 0.00 H new ATOM 0 HG3 GLU A 11 18.833 12.121 5.795 1.00 0.00 H new ATOM 192 N GLY A 12 16.760 12.843 3.312 1.00 0.00 N ATOM 193 CA GLY A 12 15.757 13.940 3.417 1.00 0.00 C ATOM 194 C GLY A 12 15.660 14.410 4.870 1.00 0.00 C ATOM 195 O GLY A 12 14.783 14.005 5.606 1.00 0.00 O ATOM 0 H GLY A 12 17.474 12.974 2.595 1.00 0.00 H new ATOM 0 HA2 GLY A 12 16.044 14.772 2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 12 14.784 13.591 3.071 1.00 0.00 H new ATOM 199 N ARG A 13 16.553 15.264 5.287 1.00 0.00 N ATOM 200 CA ARG A 13 16.508 15.761 6.692 1.00 0.00 C ATOM 201 C ARG A 13 16.566 17.291 6.712 1.00 0.00 C ATOM 202 O ARG A 13 17.571 17.879 7.060 1.00 0.00 O ATOM 203 CB ARG A 13 17.746 15.166 7.362 1.00 0.00 C ATOM 204 CG ARG A 13 17.332 14.423 8.633 1.00 0.00 C ATOM 205 CD ARG A 13 18.200 14.888 9.803 1.00 0.00 C ATOM 206 NE ARG A 13 18.861 13.651 10.304 1.00 0.00 N ATOM 207 CZ ARG A 13 18.526 13.154 11.464 1.00 0.00 C ATOM 208 NH1 ARG A 13 17.388 12.529 11.603 1.00 0.00 N ATOM 209 NH2 ARG A 13 19.330 13.280 12.484 1.00 0.00 N ATOM 0 H ARG A 13 17.311 15.639 4.717 1.00 0.00 H new ATOM 0 HA ARG A 13 15.591 15.472 7.205 1.00 0.00 H new ATOM 0 HB2 ARG A 13 18.250 14.484 6.678 1.00 0.00 H new ATOM 0 HB3 ARG A 13 18.456 15.956 7.605 1.00 0.00 H new ATOM 0 HG2 ARG A 13 16.280 14.610 8.850 1.00 0.00 H new ATOM 0 HG3 ARG A 13 17.441 13.348 8.490 1.00 0.00 H new ATOM 0 HD2 ARG A 13 18.935 15.626 9.481 1.00 0.00 H new ATOM 0 HD3 ARG A 13 17.597 15.357 10.581 1.00 0.00 H new ATOM 0 HE ARG A 13 19.576 13.192 9.740 1.00 0.00 H new ATOM 0 HH11 ARG A 13 16.760 12.429 10.805 1.00 0.00 H new ATOM 0 HH12 ARG A 13 17.127 12.141 12.509 1.00 0.00 H new ATOM 0 HH21 ARG A 13 20.220 13.767 12.375 1.00 0.00 H new ATOM 0 HH22 ARG A 13 19.069 12.892 13.390 1.00 0.00 H new ATOM 223 N ALA A 14 15.496 17.939 6.340 1.00 0.00 N ATOM 224 CA ALA A 14 15.489 19.431 6.338 1.00 0.00 C ATOM 225 C ALA A 14 14.697 19.957 7.538 1.00 0.00 C ATOM 226 O ALA A 14 13.852 19.268 8.075 1.00 0.00 O ATOM 227 CB ALA A 14 14.804 19.823 5.029 1.00 0.00 C ATOM 0 H ALA A 14 14.626 17.501 6.037 1.00 0.00 H new ATOM 0 HA ALA A 14 16.493 19.849 6.412 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.760 20.909 4.953 1.00 0.00 H new ATOM 0 HB2 ALA A 14 15.370 19.423 4.188 1.00 0.00 H new ATOM 0 HB3 ALA A 14 13.793 19.417 5.012 1.00 0.00 H new ATOM 233 N PRO A 15 15.004 21.166 7.919 1.00 0.00 N ATOM 234 CA PRO A 15 14.319 21.800 9.071 1.00 0.00 C ATOM 235 C PRO A 15 12.904 22.241 8.683 1.00 0.00 C ATOM 236 O PRO A 15 11.963 22.064 9.430 1.00 0.00 O ATOM 237 CB PRO A 15 15.194 23.009 9.385 1.00 0.00 C ATOM 238 CG PRO A 15 15.894 23.331 8.101 1.00 0.00 C ATOM 239 CD PRO A 15 16.010 22.047 7.318 1.00 0.00 C ATOM 0 HA PRO A 15 14.203 21.127 9.921 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.593 23.851 9.728 1.00 0.00 H new ATOM 0 HB3 PRO A 15 15.908 22.783 10.177 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.335 24.077 7.535 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.880 23.752 8.296 1.00 0.00 H new ATOM 0 HD2 PRO A 15 15.815 22.208 6.258 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.010 21.621 7.397 1.00 0.00 H new ATOM 247 N THR A 16 12.748 22.818 7.523 1.00 0.00 N ATOM 248 CA THR A 16 11.394 23.275 7.096 1.00 0.00 C ATOM 249 C THR A 16 10.657 22.155 6.357 1.00 0.00 C ATOM 250 O THR A 16 9.658 22.384 5.706 1.00 0.00 O ATOM 251 CB THR A 16 11.649 24.458 6.161 1.00 0.00 C ATOM 252 OG1 THR A 16 12.541 24.062 5.130 1.00 0.00 O ATOM 253 CG2 THR A 16 12.263 25.613 6.954 1.00 0.00 C ATOM 0 H THR A 16 13.497 22.993 6.853 1.00 0.00 H new ATOM 0 HA THR A 16 10.770 23.553 7.946 1.00 0.00 H new ATOM 0 HB THR A 16 10.707 24.783 5.720 1.00 0.00 H new ATOM 0 HG1 THR A 16 12.704 24.819 4.529 1.00 0.00 H new ATOM 0 HG21 THR A 16 12.445 26.456 6.287 1.00 0.00 H new ATOM 0 HG22 THR A 16 11.577 25.917 7.745 1.00 0.00 H new ATOM 0 HG23 THR A 16 13.206 25.290 7.396 1.00 0.00 H new ATOM 261 N GLU A 17 11.138 20.946 6.452 1.00 0.00 N ATOM 262 CA GLU A 17 10.460 19.823 5.755 1.00 0.00 C ATOM 263 C GLU A 17 9.026 19.679 6.271 1.00 0.00 C ATOM 264 O GLU A 17 8.796 19.494 7.450 1.00 0.00 O ATOM 265 CB GLU A 17 11.285 18.582 6.100 1.00 0.00 C ATOM 266 CG GLU A 17 11.598 17.803 4.821 1.00 0.00 C ATOM 267 CD GLU A 17 11.827 16.329 5.163 1.00 0.00 C ATOM 268 OE1 GLU A 17 12.163 16.050 6.302 1.00 0.00 O ATOM 269 OE2 GLU A 17 11.662 15.504 4.280 1.00 0.00 O ATOM 0 H GLU A 17 11.971 20.690 6.982 1.00 0.00 H new ATOM 0 HA GLU A 17 10.398 19.979 4.678 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.211 18.874 6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.736 17.950 6.798 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.774 17.899 4.113 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.483 18.217 4.338 1.00 0.00 H new ATOM 276 N GLN A 18 8.058 19.764 5.399 1.00 0.00 N ATOM 277 CA GLN A 18 6.649 19.635 5.836 1.00 0.00 C ATOM 278 C GLN A 18 5.773 19.165 4.672 1.00 0.00 C ATOM 279 O GLN A 18 4.966 18.268 4.813 1.00 0.00 O ATOM 280 CB GLN A 18 6.240 21.038 6.287 1.00 0.00 C ATOM 281 CG GLN A 18 4.989 20.948 7.162 1.00 0.00 C ATOM 282 CD GLN A 18 5.184 21.793 8.422 1.00 0.00 C ATOM 283 OE1 GLN A 18 5.871 22.795 8.395 1.00 0.00 O ATOM 284 NE2 GLN A 18 4.605 21.429 9.534 1.00 0.00 N ATOM 0 H GLN A 18 8.189 19.918 4.399 1.00 0.00 H new ATOM 0 HA GLN A 18 6.532 18.903 6.635 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.053 21.504 6.843 1.00 0.00 H new ATOM 0 HB3 GLN A 18 6.045 21.668 5.419 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.119 21.299 6.607 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.797 19.910 7.434 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.028 20.588 9.557 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.729 21.986 10.380 1.00 0.00 H new ATOM 293 N SER A 19 5.928 19.760 3.522 1.00 0.00 N ATOM 294 CA SER A 19 5.104 19.340 2.353 1.00 0.00 C ATOM 295 C SER A 19 5.548 17.957 1.870 1.00 0.00 C ATOM 296 O SER A 19 4.759 17.034 1.818 1.00 0.00 O ATOM 297 CB SER A 19 5.367 20.395 1.279 1.00 0.00 C ATOM 298 OG SER A 19 4.247 21.266 1.194 1.00 0.00 O ATOM 0 H SER A 19 6.587 20.517 3.341 1.00 0.00 H new ATOM 0 HA SER A 19 4.044 19.268 2.597 1.00 0.00 H new ATOM 0 HB2 SER A 19 6.266 20.962 1.522 1.00 0.00 H new ATOM 0 HB3 SER A 19 5.543 19.915 0.316 1.00 0.00 H new ATOM 0 HG SER A 19 4.412 21.945 0.507 1.00 0.00 H new ATOM 304 N PRO A 20 6.806 17.861 1.537 1.00 0.00 N ATOM 305 CA PRO A 20 7.374 16.577 1.057 1.00 0.00 C ATOM 306 C PRO A 20 7.540 15.601 2.226 1.00 0.00 C ATOM 307 O PRO A 20 8.093 15.938 3.253 1.00 0.00 O ATOM 308 CB PRO A 20 8.732 16.976 0.487 1.00 0.00 C ATOM 309 CG PRO A 20 9.097 18.239 1.202 1.00 0.00 C ATOM 310 CD PRO A 20 7.810 18.930 1.574 1.00 0.00 C ATOM 0 HA PRO A 20 6.742 16.074 0.325 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.476 16.197 0.657 1.00 0.00 H new ATOM 0 HB3 PRO A 20 8.677 17.134 -0.590 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.687 18.020 2.092 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.707 18.879 0.565 1.00 0.00 H new ATOM 0 HD2 PRO A 20 7.873 19.384 2.563 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.569 19.728 0.872 1.00 0.00 H new ATOM 318 N GLY A 21 7.066 14.394 2.079 1.00 0.00 N ATOM 319 CA GLY A 21 7.200 13.404 3.184 1.00 0.00 C ATOM 320 C GLY A 21 6.701 12.038 2.712 1.00 0.00 C ATOM 321 O GLY A 21 5.637 11.919 2.138 1.00 0.00 O ATOM 0 H GLY A 21 6.593 14.051 1.243 1.00 0.00 H new ATOM 0 HA2 GLY A 21 8.241 13.333 3.498 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.627 13.732 4.051 1.00 0.00 H new ATOM 325 N VAL A 22 7.461 11.005 2.949 1.00 0.00 N ATOM 326 CA VAL A 22 7.031 9.647 2.513 1.00 0.00 C ATOM 327 C VAL A 22 5.938 9.114 3.443 1.00 0.00 C ATOM 328 O VAL A 22 6.112 9.041 4.643 1.00 0.00 O ATOM 329 CB VAL A 22 8.288 8.783 2.611 1.00 0.00 C ATOM 330 CG1 VAL A 22 7.943 7.335 2.261 1.00 0.00 C ATOM 331 CG2 VAL A 22 9.341 9.308 1.632 1.00 0.00 C ATOM 0 H VAL A 22 8.362 11.043 3.426 1.00 0.00 H new ATOM 0 HA VAL A 22 6.616 9.649 1.505 1.00 0.00 H new ATOM 0 HB VAL A 22 8.680 8.825 3.627 1.00 0.00 H new ATOM 0 HG11 VAL A 22 8.840 6.720 2.331 1.00 0.00 H new ATOM 0 HG12 VAL A 22 7.192 6.962 2.957 1.00 0.00 H new ATOM 0 HG13 VAL A 22 7.551 7.290 1.245 1.00 0.00 H new ATOM 0 HG21 VAL A 22 10.239 8.694 1.700 1.00 0.00 H new ATOM 0 HG22 VAL A 22 8.947 9.265 0.617 1.00 0.00 H new ATOM 0 HG23 VAL A 22 9.588 10.340 1.882 1.00 0.00 H new ATOM 341 N GLN A 23 4.812 8.738 2.898 1.00 0.00 N ATOM 342 CA GLN A 23 3.710 8.209 3.748 1.00 0.00 C ATOM 343 C GLN A 23 2.416 8.104 2.935 1.00 0.00 C ATOM 344 O GLN A 23 1.651 9.043 2.846 1.00 0.00 O ATOM 345 CB GLN A 23 3.548 9.227 4.878 1.00 0.00 C ATOM 346 CG GLN A 23 4.084 8.633 6.183 1.00 0.00 C ATOM 347 CD GLN A 23 4.687 9.748 7.040 1.00 0.00 C ATOM 348 OE1 GLN A 23 4.142 10.831 7.121 1.00 0.00 O ATOM 349 NE2 GLN A 23 5.799 9.528 7.687 1.00 0.00 N ATOM 0 H GLN A 23 4.609 8.775 1.899 1.00 0.00 H new ATOM 0 HA GLN A 23 3.931 7.211 4.128 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.086 10.144 4.636 1.00 0.00 H new ATOM 0 HB3 GLN A 23 2.498 9.495 4.993 1.00 0.00 H new ATOM 0 HG2 GLN A 23 3.280 8.136 6.726 1.00 0.00 H new ATOM 0 HG3 GLN A 23 4.839 7.876 5.968 1.00 0.00 H new ATOM 0 HE21 GLN A 23 6.257 8.619 7.620 1.00 0.00 H new ATOM 0 HE22 GLN A 23 6.210 10.265 8.260 1.00 0.00 H new ATOM 358 N ASP A 24 2.165 6.969 2.344 1.00 0.00 N ATOM 359 CA ASP A 24 0.918 6.808 1.541 1.00 0.00 C ATOM 360 C ASP A 24 -0.310 6.930 2.446 1.00 0.00 C ATOM 361 O ASP A 24 -0.200 7.194 3.627 1.00 0.00 O ATOM 362 CB ASP A 24 1.008 5.404 0.943 1.00 0.00 C ATOM 363 CG ASP A 24 0.912 5.490 -0.581 1.00 0.00 C ATOM 364 OD1 ASP A 24 -0.197 5.457 -1.088 1.00 0.00 O ATOM 365 OD2 ASP A 24 1.949 5.590 -1.215 1.00 0.00 O ATOM 0 H ASP A 24 2.767 6.147 2.381 1.00 0.00 H new ATOM 0 HA ASP A 24 0.822 7.572 0.769 1.00 0.00 H new ATOM 0 HB2 ASP A 24 1.948 4.934 1.233 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.205 4.779 1.334 1.00 0.00 H new ATOM 370 N CYS A 25 -1.480 6.734 1.903 1.00 0.00 N ATOM 371 CA CYS A 25 -2.714 6.832 2.736 1.00 0.00 C ATOM 372 C CYS A 25 -3.886 6.129 2.040 1.00 0.00 C ATOM 373 O CYS A 25 -3.714 5.462 1.038 1.00 0.00 O ATOM 374 CB CYS A 25 -2.985 8.334 2.892 1.00 0.00 C ATOM 375 SG CYS A 25 -3.686 9.007 1.361 1.00 0.00 S ATOM 0 H CYS A 25 -1.636 6.510 0.920 1.00 0.00 H new ATOM 0 HA CYS A 25 -2.593 6.348 3.705 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -3.673 8.503 3.720 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -2.059 8.855 3.136 1.00 0.00 H new ATOM 380 N TYR A 26 -5.079 6.287 2.550 1.00 0.00 N ATOM 381 CA TYR A 26 -6.259 5.641 1.898 1.00 0.00 C ATOM 382 C TYR A 26 -7.534 6.438 2.189 1.00 0.00 C ATOM 383 O TYR A 26 -7.535 7.360 2.981 1.00 0.00 O ATOM 384 CB TYR A 26 -6.347 4.227 2.489 1.00 0.00 C ATOM 385 CG TYR A 26 -6.881 4.266 3.907 1.00 0.00 C ATOM 386 CD1 TYR A 26 -8.217 4.600 4.156 1.00 0.00 C ATOM 387 CD2 TYR A 26 -6.038 3.944 4.974 1.00 0.00 C ATOM 388 CE1 TYR A 26 -8.701 4.617 5.470 1.00 0.00 C ATOM 389 CE2 TYR A 26 -6.520 3.957 6.286 1.00 0.00 C ATOM 390 CZ TYR A 26 -7.853 4.296 6.535 1.00 0.00 C ATOM 391 OH TYR A 26 -8.331 4.310 7.829 1.00 0.00 O ATOM 0 H TYR A 26 -5.288 6.833 3.386 1.00 0.00 H new ATOM 0 HA TYR A 26 -6.151 5.607 0.814 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.996 3.609 1.869 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.361 3.763 2.480 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -8.875 4.845 3.335 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -5.007 3.683 4.784 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.731 4.879 5.661 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -5.864 3.706 7.106 1.00 0.00 H new ATOM 0 HH TYR A 26 -9.285 4.087 7.828 1.00 0.00 H new ATOM 401 N HIS A 27 -8.619 6.089 1.551 1.00 0.00 N ATOM 402 CA HIS A 27 -9.895 6.826 1.785 1.00 0.00 C ATOM 403 C HIS A 27 -11.011 5.851 2.174 1.00 0.00 C ATOM 404 O HIS A 27 -11.654 5.260 1.329 1.00 0.00 O ATOM 405 CB HIS A 27 -10.212 7.494 0.447 1.00 0.00 C ATOM 406 CG HIS A 27 -11.330 8.482 0.630 1.00 0.00 C ATOM 407 ND1 HIS A 27 -12.364 8.542 1.531 1.00 0.00 N flip ATOM 408 CD2 HIS A 27 -11.478 9.589 -0.190 1.00 0.00 C flip ATOM 409 CE1 HIS A 27 -13.142 9.667 1.277 1.00 0.00 C flip ATOM 410 NE2 HIS A 27 -12.565 10.263 0.230 1.00 0.00 N flip ATOM 0 H HIS A 27 -8.677 5.325 0.878 1.00 0.00 H new ATOM 0 HA HIS A 27 -9.811 7.549 2.596 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -9.326 7.999 0.062 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -10.495 6.741 -0.289 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -10.838 9.862 -1.016 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -14.023 9.989 1.812 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -12.906 11.123 -0.199 1.00 0.00 H new ATOM 418 N GLY A 28 -11.249 5.681 3.446 1.00 0.00 N ATOM 419 CA GLY A 28 -12.326 4.745 3.883 1.00 0.00 C ATOM 420 C GLY A 28 -11.710 3.587 4.670 1.00 0.00 C ATOM 421 O GLY A 28 -11.442 3.699 5.849 1.00 0.00 O ATOM 0 H GLY A 28 -10.746 6.148 4.201 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -13.052 5.273 4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -12.864 4.363 3.015 1.00 0.00 H new ATOM 425 N ASP A 29 -11.481 2.477 4.026 1.00 0.00 N ATOM 426 CA ASP A 29 -10.876 1.316 4.738 1.00 0.00 C ATOM 427 C ASP A 29 -9.773 0.704 3.892 1.00 0.00 C ATOM 428 O ASP A 29 -9.636 -0.500 3.801 1.00 0.00 O ATOM 429 CB ASP A 29 -12.020 0.322 4.939 1.00 0.00 C ATOM 430 CG ASP A 29 -13.081 0.940 5.851 1.00 0.00 C ATOM 431 OD1 ASP A 29 -12.926 0.843 7.057 1.00 0.00 O ATOM 432 OD2 ASP A 29 -14.031 1.499 5.328 1.00 0.00 O ATOM 0 H ASP A 29 -11.686 2.323 3.039 1.00 0.00 H new ATOM 0 HA ASP A 29 -10.426 1.604 5.688 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -12.461 0.060 3.977 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -11.641 -0.601 5.378 1.00 0.00 H new ATOM 437 N GLY A 30 -8.999 1.526 3.243 1.00 0.00 N ATOM 438 CA GLY A 30 -7.925 0.990 2.372 1.00 0.00 C ATOM 439 C GLY A 30 -8.575 0.345 1.148 1.00 0.00 C ATOM 440 O GLY A 30 -7.904 -0.154 0.266 1.00 0.00 O ATOM 0 H GLY A 30 -9.065 2.543 3.279 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.250 1.789 2.066 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -7.327 0.258 2.914 1.00 0.00 H new ATOM 444 N GLN A 31 -9.885 0.350 1.087 1.00 0.00 N ATOM 445 CA GLN A 31 -10.577 -0.264 -0.082 1.00 0.00 C ATOM 446 C GLN A 31 -10.440 0.637 -1.311 1.00 0.00 C ATOM 447 O GLN A 31 -10.196 1.822 -1.201 1.00 0.00 O ATOM 448 CB GLN A 31 -12.043 -0.380 0.337 1.00 0.00 C ATOM 449 CG GLN A 31 -12.773 -1.333 -0.613 1.00 0.00 C ATOM 450 CD GLN A 31 -13.238 -2.568 0.161 1.00 0.00 C ATOM 451 OE1 GLN A 31 -12.465 -3.619 0.215 1.00 0.00 O flip ATOM 452 NE2 GLN A 31 -14.315 -2.578 0.722 1.00 0.00 N flip ATOM 0 H GLN A 31 -10.500 0.752 1.795 1.00 0.00 H new ATOM 0 HA GLN A 31 -10.153 -1.232 -0.349 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -12.111 -0.747 1.361 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -12.516 0.602 0.318 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -13.628 -0.830 -1.064 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.112 -1.629 -1.427 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.919 -1.757 0.680 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.615 -3.407 1.235 1.00 0.00 H new ATOM 461 N SER A 32 -10.588 0.079 -2.485 1.00 0.00 N ATOM 462 CA SER A 32 -10.462 0.894 -3.732 1.00 0.00 C ATOM 463 C SER A 32 -8.998 1.279 -3.971 1.00 0.00 C ATOM 464 O SER A 32 -8.670 1.939 -4.937 1.00 0.00 O ATOM 465 CB SER A 32 -11.312 2.142 -3.490 1.00 0.00 C ATOM 466 OG SER A 32 -11.985 2.491 -4.692 1.00 0.00 O ATOM 0 H SER A 32 -10.791 -0.909 -2.635 1.00 0.00 H new ATOM 0 HA SER A 32 -10.794 0.344 -4.613 1.00 0.00 H new ATOM 0 HB2 SER A 32 -12.035 1.956 -2.696 1.00 0.00 H new ATOM 0 HB3 SER A 32 -10.681 2.967 -3.160 1.00 0.00 H new ATOM 0 HG SER A 32 -12.532 3.290 -4.540 1.00 0.00 H new ATOM 472 N TYR A 33 -8.115 0.871 -3.100 1.00 0.00 N ATOM 473 CA TYR A 33 -6.677 1.212 -3.276 1.00 0.00 C ATOM 474 C TYR A 33 -6.090 0.424 -4.453 1.00 0.00 C ATOM 475 O TYR A 33 -5.255 -0.442 -4.280 1.00 0.00 O ATOM 476 CB TYR A 33 -6.027 0.792 -1.957 1.00 0.00 C ATOM 477 CG TYR A 33 -4.646 1.393 -1.830 1.00 0.00 C ATOM 478 CD1 TYR A 33 -4.370 2.666 -2.349 1.00 0.00 C ATOM 479 CD2 TYR A 33 -3.639 0.672 -1.179 1.00 0.00 C ATOM 480 CE1 TYR A 33 -3.087 3.211 -2.219 1.00 0.00 C ATOM 481 CE2 TYR A 33 -2.358 1.218 -1.049 1.00 0.00 C ATOM 482 CZ TYR A 33 -2.082 2.487 -1.569 1.00 0.00 C ATOM 483 OH TYR A 33 -0.818 3.026 -1.439 1.00 0.00 O ATOM 0 H TYR A 33 -8.330 0.315 -2.272 1.00 0.00 H new ATOM 0 HA TYR A 33 -6.513 2.267 -3.497 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -6.648 1.113 -1.121 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -5.963 -0.295 -1.907 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -5.147 3.226 -2.849 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -3.851 -0.307 -0.776 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -2.873 4.190 -2.621 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -1.582 0.660 -0.547 1.00 0.00 H new ATOM 0 HH TYR A 33 -0.268 2.438 -0.881 1.00 0.00 H new ATOM 493 N ARG A 34 -6.526 0.718 -5.648 1.00 0.00 N ATOM 494 CA ARG A 34 -6.003 -0.010 -6.841 1.00 0.00 C ATOM 495 C ARG A 34 -4.489 0.178 -6.963 1.00 0.00 C ATOM 496 O ARG A 34 -3.779 -0.703 -7.405 1.00 0.00 O ATOM 497 CB ARG A 34 -6.718 0.625 -8.034 1.00 0.00 C ATOM 498 CG ARG A 34 -6.338 -0.122 -9.313 1.00 0.00 C ATOM 499 CD ARG A 34 -7.384 0.152 -10.395 1.00 0.00 C ATOM 500 NE ARG A 34 -7.760 -1.193 -10.913 1.00 0.00 N ATOM 501 CZ ARG A 34 -8.851 -1.772 -10.491 1.00 0.00 C ATOM 502 NH1 ARG A 34 -8.855 -2.404 -9.349 1.00 0.00 N ATOM 503 NH2 ARG A 34 -9.937 -1.720 -11.212 1.00 0.00 N ATOM 0 H ARG A 34 -7.224 1.433 -5.851 1.00 0.00 H new ATOM 0 HA ARG A 34 -6.182 -1.083 -6.778 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -7.797 0.589 -7.886 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.443 1.676 -8.119 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -5.354 0.198 -9.655 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -6.275 -1.192 -9.116 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -8.249 0.674 -9.985 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -6.978 0.781 -11.187 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.165 -1.661 -11.597 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -8.005 -2.445 -8.786 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -9.708 -2.856 -9.019 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -9.933 -1.227 -12.105 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -10.790 -2.172 -10.883 1.00 0.00 H new ATOM 517 N GLY A 35 -3.991 1.320 -6.577 1.00 0.00 N ATOM 518 CA GLY A 35 -2.524 1.564 -6.673 1.00 0.00 C ATOM 519 C GLY A 35 -1.766 0.326 -6.189 1.00 0.00 C ATOM 520 O GLY A 35 -2.006 -0.178 -5.109 1.00 0.00 O ATOM 0 H GLY A 35 -4.536 2.095 -6.199 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.249 1.792 -7.703 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -2.249 2.430 -6.071 1.00 0.00 H new ATOM 524 N SER A 36 -0.850 -0.167 -6.977 1.00 0.00 N ATOM 525 CA SER A 36 -0.072 -1.371 -6.562 1.00 0.00 C ATOM 526 C SER A 36 0.846 -1.024 -5.391 1.00 0.00 C ATOM 527 O SER A 36 2.049 -1.174 -5.466 1.00 0.00 O ATOM 528 CB SER A 36 0.749 -1.760 -7.791 1.00 0.00 C ATOM 529 OG SER A 36 0.758 -0.678 -8.714 1.00 0.00 O ATOM 0 H SER A 36 -0.606 0.212 -7.892 1.00 0.00 H new ATOM 0 HA SER A 36 -0.717 -2.186 -6.232 1.00 0.00 H new ATOM 0 HB2 SER A 36 1.768 -2.010 -7.497 1.00 0.00 H new ATOM 0 HB3 SER A 36 0.325 -2.648 -8.259 1.00 0.00 H new ATOM 0 HG SER A 36 1.285 -0.925 -9.502 1.00 0.00 H new ATOM 535 N PHE A 37 0.283 -0.563 -4.311 1.00 0.00 N ATOM 536 CA PHE A 37 1.115 -0.208 -3.128 1.00 0.00 C ATOM 537 C PHE A 37 1.846 -1.443 -2.610 1.00 0.00 C ATOM 538 O PHE A 37 1.493 -2.009 -1.595 1.00 0.00 O ATOM 539 CB PHE A 37 0.119 0.304 -2.091 1.00 0.00 C ATOM 540 CG PHE A 37 0.849 1.107 -1.043 1.00 0.00 C ATOM 541 CD1 PHE A 37 1.740 2.118 -1.427 1.00 0.00 C ATOM 542 CD2 PHE A 37 0.633 0.844 0.314 1.00 0.00 C ATOM 543 CE1 PHE A 37 2.414 2.863 -0.453 1.00 0.00 C ATOM 544 CE2 PHE A 37 1.306 1.589 1.287 1.00 0.00 C ATOM 545 CZ PHE A 37 2.196 2.599 0.905 1.00 0.00 C ATOM 0 H PHE A 37 -0.720 -0.416 -4.195 1.00 0.00 H new ATOM 0 HA PHE A 37 1.878 0.534 -3.362 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.639 0.921 -2.573 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -0.400 -0.534 -1.626 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.906 2.322 -2.474 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -0.054 0.065 0.610 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.102 3.641 -0.748 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.139 1.385 2.334 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.715 3.175 1.657 1.00 0.00 H new ATOM 555 N SER A 38 2.868 -1.863 -3.298 1.00 0.00 N ATOM 556 CA SER A 38 3.638 -3.061 -2.857 1.00 0.00 C ATOM 557 C SER A 38 4.444 -2.768 -1.580 1.00 0.00 C ATOM 558 O SER A 38 5.587 -3.163 -1.462 1.00 0.00 O ATOM 559 CB SER A 38 4.582 -3.349 -4.022 1.00 0.00 C ATOM 560 OG SER A 38 3.876 -3.194 -5.246 1.00 0.00 O ATOM 0 H SER A 38 3.207 -1.425 -4.155 1.00 0.00 H new ATOM 0 HA SER A 38 2.985 -3.901 -2.619 1.00 0.00 H new ATOM 0 HB2 SER A 38 5.434 -2.670 -3.991 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.978 -4.361 -3.943 1.00 0.00 H new ATOM 0 HG SER A 38 3.849 -4.052 -5.719 1.00 0.00 H new ATOM 566 N THR A 39 3.867 -2.089 -0.621 1.00 0.00 N ATOM 567 CA THR A 39 4.615 -1.794 0.635 1.00 0.00 C ATOM 568 C THR A 39 3.776 -2.191 1.854 1.00 0.00 C ATOM 569 O THR A 39 2.564 -2.120 1.834 1.00 0.00 O ATOM 570 CB THR A 39 4.848 -0.282 0.615 1.00 0.00 C ATOM 571 OG1 THR A 39 5.155 0.131 -0.709 1.00 0.00 O ATOM 572 CG2 THR A 39 6.011 0.068 1.543 1.00 0.00 C ATOM 0 H THR A 39 2.914 -1.728 -0.655 1.00 0.00 H new ATOM 0 HA THR A 39 5.551 -2.349 0.697 1.00 0.00 H new ATOM 0 HB THR A 39 3.948 0.229 0.955 1.00 0.00 H new ATOM 0 HG1 THR A 39 5.303 1.100 -0.724 1.00 0.00 H new ATOM 0 HG21 THR A 39 6.177 1.145 1.528 1.00 0.00 H new ATOM 0 HG22 THR A 39 5.774 -0.249 2.559 1.00 0.00 H new ATOM 0 HG23 THR A 39 6.913 -0.442 1.205 1.00 0.00 H new ATOM 580 N THR A 40 4.411 -2.609 2.915 1.00 0.00 N ATOM 581 CA THR A 40 3.647 -3.009 4.133 1.00 0.00 C ATOM 582 C THR A 40 3.669 -1.880 5.167 1.00 0.00 C ATOM 583 O THR A 40 4.363 -0.895 5.009 1.00 0.00 O ATOM 584 CB THR A 40 4.372 -4.243 4.673 1.00 0.00 C ATOM 585 OG1 THR A 40 5.755 -3.953 4.819 1.00 0.00 O ATOM 586 CG2 THR A 40 4.191 -5.411 3.702 1.00 0.00 C ATOM 0 H THR A 40 5.425 -2.691 2.992 1.00 0.00 H new ATOM 0 HA THR A 40 2.600 -3.217 3.911 1.00 0.00 H new ATOM 0 HB THR A 40 3.954 -4.514 5.643 1.00 0.00 H new ATOM 0 HG1 THR A 40 6.015 -4.063 5.757 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.708 -6.289 4.089 1.00 0.00 H new ATOM 0 HG22 THR A 40 3.129 -5.633 3.594 1.00 0.00 H new ATOM 0 HG23 THR A 40 4.606 -5.144 2.730 1.00 0.00 H new ATOM 594 N VAL A 41 2.918 -2.016 6.226 1.00 0.00 N ATOM 595 CA VAL A 41 2.901 -0.951 7.271 1.00 0.00 C ATOM 596 C VAL A 41 4.318 -0.720 7.806 1.00 0.00 C ATOM 597 O VAL A 41 4.798 0.395 7.859 1.00 0.00 O ATOM 598 CB VAL A 41 1.983 -1.493 8.372 1.00 0.00 C ATOM 599 CG1 VAL A 41 2.262 -0.763 9.689 1.00 0.00 C ATOM 600 CG2 VAL A 41 0.524 -1.269 7.971 1.00 0.00 C ATOM 0 H VAL A 41 2.316 -2.818 6.413 1.00 0.00 H new ATOM 0 HA VAL A 41 2.549 0.007 6.887 1.00 0.00 H new ATOM 0 HB VAL A 41 2.171 -2.559 8.504 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.606 -1.153 10.467 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.301 -0.919 9.978 1.00 0.00 H new ATOM 0 HG13 VAL A 41 2.078 0.304 9.560 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -0.131 -1.654 8.752 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.343 -0.202 7.838 1.00 0.00 H new ATOM 0 HG23 VAL A 41 0.319 -1.791 7.036 1.00 0.00 H new ATOM 610 N THR A 42 4.990 -1.766 8.202 1.00 0.00 N ATOM 611 CA THR A 42 6.375 -1.607 8.732 1.00 0.00 C ATOM 612 C THR A 42 7.272 -0.954 7.679 1.00 0.00 C ATOM 613 O THR A 42 8.357 -0.493 7.972 1.00 0.00 O ATOM 614 CB THR A 42 6.849 -3.029 9.032 1.00 0.00 C ATOM 615 OG1 THR A 42 5.894 -3.681 9.857 1.00 0.00 O ATOM 616 CG2 THR A 42 8.198 -2.978 9.751 1.00 0.00 C ATOM 0 H THR A 42 4.640 -2.724 8.182 1.00 0.00 H new ATOM 0 HA THR A 42 6.409 -0.971 9.616 1.00 0.00 H new ATOM 0 HB THR A 42 6.959 -3.580 8.098 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.196 -4.593 10.049 1.00 0.00 H new ATOM 0 HG21 THR A 42 8.535 -3.992 9.964 1.00 0.00 H new ATOM 0 HG22 THR A 42 8.930 -2.478 9.116 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.092 -2.427 10.685 1.00 0.00 H new ATOM 624 N GLY A 43 6.827 -0.911 6.453 1.00 0.00 N ATOM 625 CA GLY A 43 7.655 -0.288 5.382 1.00 0.00 C ATOM 626 C GLY A 43 8.343 -1.383 4.564 1.00 0.00 C ATOM 627 O GLY A 43 9.045 -1.110 3.610 1.00 0.00 O ATOM 0 H GLY A 43 5.927 -1.280 6.147 1.00 0.00 H new ATOM 0 HA2 GLY A 43 7.029 0.325 4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.401 0.374 5.823 1.00 0.00 H new ATOM 631 N ARG A 44 8.147 -2.621 4.927 1.00 0.00 N ATOM 632 CA ARG A 44 8.789 -3.731 4.167 1.00 0.00 C ATOM 633 C ARG A 44 8.049 -3.962 2.847 1.00 0.00 C ATOM 634 O ARG A 44 7.166 -3.213 2.478 1.00 0.00 O ATOM 635 CB ARG A 44 8.661 -4.956 5.073 1.00 0.00 C ATOM 636 CG ARG A 44 10.051 -5.413 5.521 1.00 0.00 C ATOM 637 CD ARG A 44 10.019 -5.756 7.012 1.00 0.00 C ATOM 638 NE ARG A 44 8.860 -6.679 7.169 1.00 0.00 N ATOM 639 CZ ARG A 44 8.036 -6.528 8.172 1.00 0.00 C ATOM 640 NH1 ARG A 44 8.493 -6.517 9.395 1.00 0.00 N ATOM 641 NH2 ARG A 44 6.758 -6.391 7.950 1.00 0.00 N ATOM 0 H ARG A 44 7.570 -2.912 5.717 1.00 0.00 H new ATOM 0 HA ARG A 44 9.828 -3.515 3.917 1.00 0.00 H new ATOM 0 HB2 ARG A 44 8.049 -4.715 5.942 1.00 0.00 H new ATOM 0 HB3 ARG A 44 8.156 -5.763 4.541 1.00 0.00 H new ATOM 0 HG2 ARG A 44 10.363 -6.283 4.943 1.00 0.00 H new ATOM 0 HG3 ARG A 44 10.782 -4.627 5.333 1.00 0.00 H new ATOM 0 HD2 ARG A 44 10.948 -6.231 7.328 1.00 0.00 H new ATOM 0 HD3 ARG A 44 9.896 -4.860 7.621 1.00 0.00 H new ATOM 0 HE ARG A 44 8.710 -7.429 6.494 1.00 0.00 H new ATOM 0 HH11 ARG A 44 9.492 -6.626 9.567 1.00 0.00 H new ATOM 0 HH12 ARG A 44 7.851 -6.399 10.178 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.402 -6.402 6.994 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.114 -6.273 8.732 1.00 0.00 H new ATOM 655 N THR A 45 8.399 -4.998 2.136 1.00 0.00 N ATOM 656 CA THR A 45 7.713 -5.283 0.843 1.00 0.00 C ATOM 657 C THR A 45 6.832 -6.526 0.991 1.00 0.00 C ATOM 658 O THR A 45 7.265 -7.546 1.490 1.00 0.00 O ATOM 659 CB THR A 45 8.843 -5.538 -0.156 1.00 0.00 C ATOM 660 OG1 THR A 45 9.671 -4.387 -0.235 1.00 0.00 O ATOM 661 CG2 THR A 45 8.254 -5.841 -1.534 1.00 0.00 C ATOM 0 H THR A 45 9.131 -5.660 2.394 1.00 0.00 H new ATOM 0 HA THR A 45 7.067 -4.466 0.521 1.00 0.00 H new ATOM 0 HB THR A 45 9.435 -6.391 0.177 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.397 -4.549 -0.873 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.062 -6.022 -2.243 1.00 0.00 H new ATOM 0 HG22 THR A 45 7.620 -6.726 -1.472 1.00 0.00 H new ATOM 0 HG23 THR A 45 7.660 -4.992 -1.870 1.00 0.00 H new ATOM 669 N CYS A 46 5.597 -6.453 0.572 1.00 0.00 N ATOM 670 CA CYS A 46 4.707 -7.630 0.706 1.00 0.00 C ATOM 671 C CYS A 46 5.003 -8.633 -0.419 1.00 0.00 C ATOM 672 O CYS A 46 5.058 -8.281 -1.579 1.00 0.00 O ATOM 673 CB CYS A 46 3.273 -7.053 0.655 1.00 0.00 C ATOM 674 SG CYS A 46 2.386 -7.555 -0.848 1.00 0.00 S ATOM 0 H CYS A 46 5.172 -5.630 0.145 1.00 0.00 H new ATOM 0 HA CYS A 46 4.852 -8.187 1.632 1.00 0.00 H new ATOM 0 HB2 CYS A 46 2.717 -7.387 1.531 1.00 0.00 H new ATOM 0 HB3 CYS A 46 3.319 -5.965 0.702 1.00 0.00 H new ATOM 679 N GLN A 47 5.208 -9.877 -0.079 1.00 0.00 N ATOM 680 CA GLN A 47 5.514 -10.894 -1.124 1.00 0.00 C ATOM 681 C GLN A 47 4.327 -11.066 -2.074 1.00 0.00 C ATOM 682 O GLN A 47 3.206 -11.264 -1.650 1.00 0.00 O ATOM 683 CB GLN A 47 5.764 -12.192 -0.357 1.00 0.00 C ATOM 684 CG GLN A 47 6.119 -13.308 -1.342 1.00 0.00 C ATOM 685 CD GLN A 47 7.564 -13.132 -1.812 1.00 0.00 C ATOM 686 OE1 GLN A 47 8.475 -13.693 -1.237 1.00 0.00 O ATOM 687 NE2 GLN A 47 7.813 -12.369 -2.841 1.00 0.00 N ATOM 0 H GLN A 47 5.177 -10.232 0.877 1.00 0.00 H new ATOM 0 HA GLN A 47 6.369 -10.602 -1.733 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.574 -12.053 0.359 1.00 0.00 H new ATOM 0 HB3 GLN A 47 4.877 -12.466 0.214 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.996 -14.281 -0.866 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.442 -13.283 -2.196 1.00 0.00 H new ATOM 0 HE21 GLN A 47 7.048 -11.898 -3.324 1.00 0.00 H new ATOM 0 HE22 GLN A 47 8.773 -12.244 -3.163 1.00 0.00 H new ATOM 696 N SER A 48 4.565 -11.007 -3.356 1.00 0.00 N ATOM 697 CA SER A 48 3.450 -11.184 -4.323 1.00 0.00 C ATOM 698 C SER A 48 2.583 -12.365 -3.890 1.00 0.00 C ATOM 699 O SER A 48 3.051 -13.288 -3.253 1.00 0.00 O ATOM 700 CB SER A 48 4.129 -11.477 -5.659 1.00 0.00 C ATOM 701 OG SER A 48 4.683 -10.275 -6.178 1.00 0.00 O ATOM 0 H SER A 48 5.482 -10.844 -3.773 1.00 0.00 H new ATOM 0 HA SER A 48 2.802 -10.310 -4.384 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.912 -12.224 -5.526 1.00 0.00 H new ATOM 0 HB3 SER A 48 3.408 -11.892 -6.363 1.00 0.00 H new ATOM 0 HG SER A 48 4.683 -10.311 -7.157 1.00 0.00 H new ATOM 707 N TRP A 49 1.327 -12.351 -4.229 1.00 0.00 N ATOM 708 CA TRP A 49 0.450 -13.489 -3.827 1.00 0.00 C ATOM 709 C TRP A 49 0.859 -14.742 -4.603 1.00 0.00 C ATOM 710 O TRP A 49 0.714 -15.854 -4.135 1.00 0.00 O ATOM 711 CB TRP A 49 -0.979 -13.082 -4.200 1.00 0.00 C ATOM 712 CG TRP A 49 -1.265 -11.679 -3.761 1.00 0.00 C ATOM 713 CD1 TRP A 49 -1.055 -10.573 -4.502 1.00 0.00 C ATOM 714 CD2 TRP A 49 -1.834 -11.219 -2.506 1.00 0.00 C ATOM 715 NE1 TRP A 49 -1.445 -9.469 -3.774 1.00 0.00 N ATOM 716 CE2 TRP A 49 -1.933 -9.815 -2.539 1.00 0.00 C ATOM 717 CE3 TRP A 49 -2.261 -11.880 -1.356 1.00 0.00 C ATOM 718 CZ2 TRP A 49 -2.443 -9.090 -1.466 1.00 0.00 C ATOM 719 CZ3 TRP A 49 -2.778 -11.162 -0.266 1.00 0.00 C ATOM 720 CH2 TRP A 49 -2.869 -9.766 -0.321 1.00 0.00 C ATOM 0 H TRP A 49 0.870 -11.611 -4.761 1.00 0.00 H new ATOM 0 HA TRP A 49 0.531 -13.707 -2.762 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -1.116 -13.165 -5.278 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -1.690 -13.765 -3.735 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -0.648 -10.555 -5.502 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -1.379 -8.509 -4.113 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -2.193 -12.957 -1.303 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -2.509 -8.013 -1.519 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -3.107 -11.688 0.618 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -3.267 -9.215 0.518 1.00 0.00 H new ATOM 731 N SER A 50 1.369 -14.566 -5.792 1.00 0.00 N ATOM 732 CA SER A 50 1.791 -15.736 -6.614 1.00 0.00 C ATOM 733 C SER A 50 3.145 -16.286 -6.143 1.00 0.00 C ATOM 734 O SER A 50 3.766 -17.079 -6.822 1.00 0.00 O ATOM 735 CB SER A 50 1.903 -15.188 -8.035 1.00 0.00 C ATOM 736 OG SER A 50 2.213 -16.251 -8.926 1.00 0.00 O ATOM 0 H SER A 50 1.512 -13.657 -6.231 1.00 0.00 H new ATOM 0 HA SER A 50 1.084 -16.562 -6.538 1.00 0.00 H new ATOM 0 HB2 SER A 50 0.967 -14.713 -8.329 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.677 -14.422 -8.082 1.00 0.00 H new ATOM 0 HG SER A 50 2.852 -16.859 -8.500 1.00 0.00 H new ATOM 742 N SER A 51 3.610 -15.880 -4.993 1.00 0.00 N ATOM 743 CA SER A 51 4.920 -16.393 -4.501 1.00 0.00 C ATOM 744 C SER A 51 4.715 -17.709 -3.749 1.00 0.00 C ATOM 745 O SER A 51 4.154 -17.737 -2.672 1.00 0.00 O ATOM 746 CB SER A 51 5.440 -15.311 -3.557 1.00 0.00 C ATOM 747 OG SER A 51 6.592 -15.796 -2.879 1.00 0.00 O ATOM 0 H SER A 51 3.141 -15.218 -4.375 1.00 0.00 H new ATOM 0 HA SER A 51 5.620 -16.593 -5.312 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.686 -14.410 -4.118 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.668 -15.038 -2.838 1.00 0.00 H new ATOM 0 HG SER A 51 7.398 -15.443 -3.310 1.00 0.00 H new ATOM 753 N MET A 52 5.158 -18.801 -4.309 1.00 0.00 N ATOM 754 CA MET A 52 4.975 -20.109 -3.619 1.00 0.00 C ATOM 755 C MET A 52 6.290 -20.574 -2.992 1.00 0.00 C ATOM 756 O MET A 52 6.513 -21.753 -2.797 1.00 0.00 O ATOM 757 CB MET A 52 4.524 -21.085 -4.712 1.00 0.00 C ATOM 758 CG MET A 52 3.393 -20.468 -5.541 1.00 0.00 C ATOM 759 SD MET A 52 1.808 -21.092 -4.954 1.00 0.00 S ATOM 760 CE MET A 52 1.970 -20.428 -3.288 1.00 0.00 C ATOM 0 H MET A 52 5.636 -18.845 -5.209 1.00 0.00 H new ATOM 0 HA MET A 52 4.248 -20.043 -2.810 1.00 0.00 H new ATOM 0 HB2 MET A 52 5.366 -21.331 -5.359 1.00 0.00 H new ATOM 0 HB3 MET A 52 4.186 -22.017 -4.260 1.00 0.00 H new ATOM 0 HG2 MET A 52 3.420 -19.381 -5.461 1.00 0.00 H new ATOM 0 HG3 MET A 52 3.525 -20.713 -6.595 1.00 0.00 H new ATOM 0 HE1 MET A 52 1.007 -20.481 -2.780 1.00 0.00 H new ATOM 0 HE2 MET A 52 2.706 -21.011 -2.734 1.00 0.00 H new ATOM 0 HE3 MET A 52 2.295 -19.389 -3.340 1.00 0.00 H new ATOM 770 N THR A 53 7.160 -19.660 -2.667 1.00 0.00 N ATOM 771 CA THR A 53 8.454 -20.055 -2.044 1.00 0.00 C ATOM 772 C THR A 53 8.382 -19.879 -0.520 1.00 0.00 C ATOM 773 O THR A 53 8.439 -20.848 0.211 1.00 0.00 O ATOM 774 CB THR A 53 9.503 -19.128 -2.660 1.00 0.00 C ATOM 775 OG1 THR A 53 8.851 -18.057 -3.332 1.00 0.00 O ATOM 776 CG2 THR A 53 10.359 -19.917 -3.654 1.00 0.00 C ATOM 0 H THR A 53 7.032 -18.658 -2.805 1.00 0.00 H new ATOM 0 HA THR A 53 8.698 -21.102 -2.226 1.00 0.00 H new ATOM 0 HB THR A 53 10.142 -18.725 -1.874 1.00 0.00 H new ATOM 0 HG1 THR A 53 9.522 -17.461 -3.726 1.00 0.00 H new ATOM 0 HG21 THR A 53 11.107 -19.257 -4.094 1.00 0.00 H new ATOM 0 HG22 THR A 53 10.857 -20.736 -3.135 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.723 -20.320 -4.442 1.00 0.00 H new ATOM 784 N PRO A 54 8.252 -18.649 -0.080 1.00 0.00 N ATOM 785 CA PRO A 54 8.166 -18.378 1.376 1.00 0.00 C ATOM 786 C PRO A 54 6.781 -18.771 1.910 1.00 0.00 C ATOM 787 O PRO A 54 6.546 -19.908 2.268 1.00 0.00 O ATOM 788 CB PRO A 54 8.386 -16.872 1.476 1.00 0.00 C ATOM 789 CG PRO A 54 7.964 -16.326 0.148 1.00 0.00 C ATOM 790 CD PRO A 54 8.178 -17.414 -0.874 1.00 0.00 C ATOM 0 HA PRO A 54 8.889 -18.945 1.963 1.00 0.00 H new ATOM 0 HB2 PRO A 54 7.796 -16.441 2.285 1.00 0.00 H new ATOM 0 HB3 PRO A 54 9.430 -16.639 1.684 1.00 0.00 H new ATOM 0 HG2 PRO A 54 6.917 -16.023 0.173 1.00 0.00 H new ATOM 0 HG3 PRO A 54 8.547 -15.441 -0.106 1.00 0.00 H new ATOM 0 HD2 PRO A 54 7.359 -17.452 -1.592 1.00 0.00 H new ATOM 0 HD3 PRO A 54 9.094 -17.251 -1.443 1.00 0.00 H new ATOM 798 N HIS A 55 5.863 -17.840 1.971 1.00 0.00 N ATOM 799 CA HIS A 55 4.495 -18.170 2.488 1.00 0.00 C ATOM 800 C HIS A 55 3.610 -18.696 1.354 1.00 0.00 C ATOM 801 O HIS A 55 3.252 -17.972 0.446 1.00 0.00 O ATOM 802 CB HIS A 55 3.921 -16.855 3.037 1.00 0.00 C ATOM 803 CG HIS A 55 5.024 -16.014 3.618 1.00 0.00 C ATOM 804 ND1 HIS A 55 5.763 -15.139 2.841 1.00 0.00 N ATOM 805 CD2 HIS A 55 5.541 -15.919 4.885 1.00 0.00 C ATOM 806 CE1 HIS A 55 6.678 -14.565 3.636 1.00 0.00 C ATOM 807 NE2 HIS A 55 6.588 -15.002 4.895 1.00 0.00 N ATOM 0 H HIS A 55 5.998 -16.870 1.687 1.00 0.00 H new ATOM 0 HA HIS A 55 4.536 -18.943 3.256 1.00 0.00 H new ATOM 0 HB2 HIS A 55 3.417 -16.308 2.240 1.00 0.00 H new ATOM 0 HB3 HIS A 55 3.173 -17.066 3.801 1.00 0.00 H new ATOM 0 HD2 HIS A 55 5.189 -16.471 5.744 1.00 0.00 H new ATOM 0 HE1 HIS A 55 7.401 -13.837 3.299 1.00 0.00 H new ATOM 0 HE2 HIS A 55 7.162 -14.724 5.691 1.00 0.00 H new ATOM 815 N TRP A 56 3.255 -19.951 1.397 1.00 0.00 N ATOM 816 CA TRP A 56 2.397 -20.523 0.321 1.00 0.00 C ATOM 817 C TRP A 56 0.916 -20.440 0.699 1.00 0.00 C ATOM 818 O TRP A 56 0.536 -20.668 1.831 1.00 0.00 O ATOM 819 CB TRP A 56 2.828 -21.983 0.206 1.00 0.00 C ATOM 820 CG TRP A 56 2.392 -22.519 -1.117 1.00 0.00 C ATOM 821 CD1 TRP A 56 1.125 -22.519 -1.579 1.00 0.00 C ATOM 822 CD2 TRP A 56 3.201 -23.106 -2.166 1.00 0.00 C ATOM 823 NE1 TRP A 56 1.102 -23.084 -2.834 1.00 0.00 N ATOM 824 CE2 TRP A 56 2.358 -23.465 -3.242 1.00 0.00 C ATOM 825 CE3 TRP A 56 4.566 -23.363 -2.282 1.00 0.00 C ATOM 826 CZ2 TRP A 56 2.858 -24.059 -4.395 1.00 0.00 C ATOM 827 CZ3 TRP A 56 5.076 -23.955 -3.440 1.00 0.00 C ATOM 828 CH2 TRP A 56 4.226 -24.306 -4.497 1.00 0.00 C ATOM 0 H TRP A 56 3.523 -20.606 2.132 1.00 0.00 H new ATOM 0 HA TRP A 56 2.512 -19.979 -0.617 1.00 0.00 H new ATOM 0 HB2 TRP A 56 3.910 -22.064 0.306 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.388 -22.569 1.013 1.00 0.00 H new ATOM 0 HD1 TRP A 56 0.265 -22.137 -1.049 1.00 0.00 H new ATOM 0 HE1 TRP A 56 0.257 -23.205 -3.392 1.00 0.00 H new ATOM 0 HE3 TRP A 56 5.232 -23.103 -1.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 2.193 -24.326 -5.203 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 6.136 -24.144 -3.521 1.00 0.00 H new ATOM 0 HH2 TRP A 56 4.629 -24.766 -5.387 1.00 0.00 H new ATOM 839 N HIS A 57 0.078 -20.126 -0.250 1.00 0.00 N ATOM 840 CA HIS A 57 -1.381 -20.036 0.030 1.00 0.00 C ATOM 841 C HIS A 57 -2.157 -19.994 -1.289 1.00 0.00 C ATOM 842 O HIS A 57 -1.590 -20.130 -2.355 1.00 0.00 O ATOM 843 CB HIS A 57 -1.553 -18.728 0.800 1.00 0.00 C ATOM 844 CG HIS A 57 -0.841 -17.629 0.063 1.00 0.00 C ATOM 845 ND1 HIS A 57 -1.295 -17.144 -1.152 1.00 0.00 N ATOM 846 CD2 HIS A 57 0.299 -16.920 0.349 1.00 0.00 C ATOM 847 CE1 HIS A 57 -0.439 -16.186 -1.551 1.00 0.00 C ATOM 848 NE2 HIS A 57 0.551 -16.009 -0.672 1.00 0.00 N ATOM 0 H HIS A 57 0.344 -19.927 -1.214 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.755 -20.889 0.596 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -2.611 -18.488 0.903 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -1.150 -18.828 1.808 1.00 0.00 H new ATOM 0 HD2 HIS A 57 0.907 -17.050 1.232 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -0.540 -15.628 -2.470 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.325 -15.348 -0.736 1.00 0.00 H new ATOM 856 N GLN A 58 -3.447 -19.806 -1.232 1.00 0.00 N ATOM 857 CA GLN A 58 -4.244 -19.758 -2.491 1.00 0.00 C ATOM 858 C GLN A 58 -5.358 -18.714 -2.375 1.00 0.00 C ATOM 859 O GLN A 58 -6.375 -18.803 -3.033 1.00 0.00 O ATOM 860 CB GLN A 58 -4.831 -21.161 -2.646 1.00 0.00 C ATOM 861 CG GLN A 58 -4.534 -21.684 -4.053 1.00 0.00 C ATOM 862 CD GLN A 58 -4.964 -23.149 -4.159 1.00 0.00 C ATOM 863 OE1 GLN A 58 -5.972 -23.539 -3.605 1.00 0.00 O ATOM 864 NE2 GLN A 58 -4.237 -23.982 -4.853 1.00 0.00 N ATOM 0 H GLN A 58 -3.982 -19.684 -0.372 1.00 0.00 H new ATOM 0 HA GLN A 58 -3.638 -19.476 -3.352 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -4.403 -21.830 -1.900 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -5.907 -21.138 -2.474 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -5.064 -21.085 -4.794 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -3.470 -21.591 -4.269 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -3.390 -23.655 -5.318 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -4.516 -24.960 -4.930 1.00 0.00 H new ATOM 873 N ARG A 59 -5.171 -17.723 -1.548 1.00 0.00 N ATOM 874 CA ARG A 59 -6.217 -16.672 -1.397 1.00 0.00 C ATOM 875 C ARG A 59 -5.911 -15.491 -2.326 1.00 0.00 C ATOM 876 O ARG A 59 -6.580 -14.477 -2.300 1.00 0.00 O ATOM 877 CB ARG A 59 -6.141 -16.242 0.069 1.00 0.00 C ATOM 878 CG ARG A 59 -7.446 -15.549 0.469 1.00 0.00 C ATOM 879 CD ARG A 59 -7.987 -16.175 1.757 1.00 0.00 C ATOM 880 NE ARG A 59 -8.868 -15.131 2.352 1.00 0.00 N ATOM 881 CZ ARG A 59 -10.143 -15.364 2.511 1.00 0.00 C ATOM 882 NH1 ARG A 59 -10.540 -16.267 3.366 1.00 0.00 N ATOM 883 NH2 ARG A 59 -11.020 -14.694 1.816 1.00 0.00 N ATOM 0 H ARG A 59 -4.340 -17.595 -0.971 1.00 0.00 H new ATOM 0 HA ARG A 59 -7.211 -17.034 -1.660 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -5.969 -17.110 0.705 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.298 -15.567 0.217 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -7.273 -14.483 0.616 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -8.181 -15.646 -0.330 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -8.543 -17.089 1.548 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -7.178 -16.442 2.436 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.475 -14.233 2.635 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -9.854 -16.791 3.910 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -11.536 -16.449 3.490 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.710 -13.988 1.148 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -12.016 -14.876 1.940 1.00 0.00 H new ATOM 897 N THR A 60 -4.904 -15.620 -3.148 1.00 0.00 N ATOM 898 CA THR A 60 -4.548 -14.512 -4.084 1.00 0.00 C ATOM 899 C THR A 60 -5.775 -14.044 -4.851 1.00 0.00 C ATOM 900 O THR A 60 -6.875 -14.513 -4.641 1.00 0.00 O ATOM 901 CB THR A 60 -3.562 -15.125 -5.074 1.00 0.00 C ATOM 902 OG1 THR A 60 -3.148 -14.134 -6.004 1.00 0.00 O ATOM 903 CG2 THR A 60 -4.240 -16.274 -5.821 1.00 0.00 C ATOM 0 H THR A 60 -4.310 -16.447 -3.212 1.00 0.00 H new ATOM 0 HA THR A 60 -4.140 -13.657 -3.545 1.00 0.00 H new ATOM 0 HB THR A 60 -2.693 -15.504 -4.536 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.513 -14.526 -6.639 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.537 -16.713 -6.529 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.559 -17.034 -5.108 1.00 0.00 H new ATOM 0 HG23 THR A 60 -5.108 -15.895 -6.360 1.00 0.00 H new ATOM 911 N THR A 61 -5.580 -13.151 -5.776 1.00 0.00 N ATOM 912 CA THR A 61 -6.721 -12.688 -6.597 1.00 0.00 C ATOM 913 C THR A 61 -7.074 -13.791 -7.588 1.00 0.00 C ATOM 914 O THR A 61 -8.109 -13.761 -8.223 1.00 0.00 O ATOM 915 CB THR A 61 -6.240 -11.441 -7.333 1.00 0.00 C ATOM 916 OG1 THR A 61 -7.279 -10.980 -8.186 1.00 0.00 O ATOM 917 CG2 THR A 61 -5.008 -11.782 -8.169 1.00 0.00 C ATOM 0 H THR A 61 -4.680 -12.724 -5.997 1.00 0.00 H new ATOM 0 HA THR A 61 -7.604 -12.461 -6.000 1.00 0.00 H new ATOM 0 HB THR A 61 -5.980 -10.665 -6.613 1.00 0.00 H new ATOM 0 HG1 THR A 61 -6.936 -10.265 -8.762 1.00 0.00 H new ATOM 0 HG21 THR A 61 -4.666 -10.890 -8.694 1.00 0.00 H new ATOM 0 HG22 THR A 61 -4.214 -12.145 -7.516 1.00 0.00 H new ATOM 0 HG23 THR A 61 -5.263 -12.554 -8.895 1.00 0.00 H new ATOM 925 N GLU A 62 -6.226 -14.783 -7.718 1.00 0.00 N ATOM 926 CA GLU A 62 -6.535 -15.884 -8.654 1.00 0.00 C ATOM 927 C GLU A 62 -7.854 -16.498 -8.230 1.00 0.00 C ATOM 928 O GLU A 62 -8.599 -17.034 -9.026 1.00 0.00 O ATOM 929 CB GLU A 62 -5.389 -16.886 -8.506 1.00 0.00 C ATOM 930 CG GLU A 62 -5.525 -17.979 -9.566 1.00 0.00 C ATOM 931 CD GLU A 62 -5.441 -17.353 -10.959 1.00 0.00 C ATOM 932 OE1 GLU A 62 -4.704 -16.392 -11.112 1.00 0.00 O ATOM 933 OE2 GLU A 62 -6.114 -17.844 -11.849 1.00 0.00 O ATOM 0 H GLU A 62 -5.342 -14.869 -7.216 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.625 -15.560 -9.691 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.431 -16.377 -8.614 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.405 -17.327 -7.510 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.737 -18.721 -9.441 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.475 -18.500 -9.447 1.00 0.00 H new ATOM 940 N TYR A 63 -8.154 -16.390 -6.970 1.00 0.00 N ATOM 941 CA TYR A 63 -9.433 -16.929 -6.468 1.00 0.00 C ATOM 942 C TYR A 63 -10.452 -15.791 -6.372 1.00 0.00 C ATOM 943 O TYR A 63 -11.543 -15.957 -5.864 1.00 0.00 O ATOM 944 CB TYR A 63 -9.117 -17.493 -5.083 1.00 0.00 C ATOM 945 CG TYR A 63 -9.084 -19.001 -5.145 1.00 0.00 C ATOM 946 CD1 TYR A 63 -7.994 -19.655 -5.733 1.00 0.00 C ATOM 947 CD2 TYR A 63 -10.141 -19.746 -4.609 1.00 0.00 C ATOM 948 CE1 TYR A 63 -7.963 -21.054 -5.785 1.00 0.00 C ATOM 949 CE2 TYR A 63 -10.110 -21.145 -4.663 1.00 0.00 C ATOM 950 CZ TYR A 63 -9.020 -21.799 -5.250 1.00 0.00 C ATOM 951 OH TYR A 63 -8.989 -23.178 -5.302 1.00 0.00 O ATOM 0 H TYR A 63 -7.562 -15.949 -6.266 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.855 -17.695 -7.119 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.157 -17.112 -4.735 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -9.869 -17.165 -4.366 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.178 -19.081 -6.146 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -10.981 -19.242 -4.154 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.123 -21.559 -6.238 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -10.927 -21.719 -4.252 1.00 0.00 H new ATOM 0 HH TYR A 63 -9.799 -23.539 -4.885 1.00 0.00 H new ATOM 961 N TYR A 64 -10.092 -14.629 -6.853 1.00 0.00 N ATOM 962 CA TYR A 64 -11.024 -13.467 -6.790 1.00 0.00 C ATOM 963 C TYR A 64 -11.024 -12.708 -8.120 1.00 0.00 C ATOM 964 O TYR A 64 -9.987 -12.299 -8.600 1.00 0.00 O ATOM 965 CB TYR A 64 -10.469 -12.580 -5.676 1.00 0.00 C ATOM 966 CG TYR A 64 -11.414 -12.595 -4.499 1.00 0.00 C ATOM 967 CD1 TYR A 64 -12.551 -11.778 -4.505 1.00 0.00 C ATOM 968 CD2 TYR A 64 -11.154 -13.425 -3.402 1.00 0.00 C ATOM 969 CE1 TYR A 64 -13.428 -11.791 -3.413 1.00 0.00 C ATOM 970 CE2 TYR A 64 -12.030 -13.437 -2.310 1.00 0.00 C ATOM 971 CZ TYR A 64 -13.167 -12.620 -2.316 1.00 0.00 C ATOM 972 OH TYR A 64 -14.032 -12.632 -1.240 1.00 0.00 O ATOM 0 H TYR A 64 -9.190 -14.436 -7.288 1.00 0.00 H new ATOM 0 HA TYR A 64 -12.052 -13.776 -6.601 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.485 -12.936 -5.370 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -10.340 -11.560 -6.039 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -12.752 -11.138 -5.351 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -10.278 -14.056 -3.398 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -14.305 -11.161 -3.418 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -11.829 -14.076 -1.463 1.00 0.00 H new ATOM 0 HH TYR A 64 -13.705 -13.263 -0.565 1.00 0.00 H new ATOM 982 N PRO A 65 -12.197 -12.539 -8.668 1.00 0.00 N ATOM 983 CA PRO A 65 -12.335 -11.813 -9.952 1.00 0.00 C ATOM 984 C PRO A 65 -12.148 -10.310 -9.727 1.00 0.00 C ATOM 985 O PRO A 65 -12.133 -9.528 -10.657 1.00 0.00 O ATOM 986 CB PRO A 65 -13.763 -12.126 -10.389 1.00 0.00 C ATOM 987 CG PRO A 65 -14.497 -12.443 -9.124 1.00 0.00 C ATOM 988 CD PRO A 65 -13.490 -13.000 -8.149 1.00 0.00 C ATOM 0 HA PRO A 65 -11.596 -12.107 -10.698 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -14.213 -11.277 -10.904 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -13.788 -12.968 -11.081 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -14.969 -11.548 -8.719 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -15.291 -13.166 -9.311 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -13.668 -12.632 -7.138 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -13.537 -14.088 -8.105 1.00 0.00 H new ATOM 996 N ASN A 66 -12.004 -9.903 -8.494 1.00 0.00 N ATOM 997 CA ASN A 66 -11.816 -8.454 -8.202 1.00 0.00 C ATOM 998 C ASN A 66 -10.549 -8.242 -7.367 1.00 0.00 C ATOM 999 O ASN A 66 -10.493 -7.378 -6.514 1.00 0.00 O ATOM 1000 CB ASN A 66 -13.058 -8.045 -7.410 1.00 0.00 C ATOM 1001 CG ASN A 66 -13.253 -6.532 -7.511 1.00 0.00 C ATOM 1002 OD1 ASN A 66 -13.357 -5.993 -8.595 1.00 0.00 O ATOM 1003 ND2 ASN A 66 -13.306 -5.818 -6.421 1.00 0.00 N ATOM 0 H ASN A 66 -12.009 -10.513 -7.676 1.00 0.00 H new ATOM 0 HA ASN A 66 -11.699 -7.861 -9.109 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -13.936 -8.562 -7.798 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -12.950 -8.339 -6.366 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.435 -4.808 -6.479 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.219 -6.270 -5.511 1.00 0.00 H new ATOM 1010 N GLY A 67 -9.529 -9.019 -7.611 1.00 0.00 N ATOM 1011 CA GLY A 67 -8.267 -8.863 -6.847 1.00 0.00 C ATOM 1012 C GLY A 67 -7.221 -8.221 -7.754 1.00 0.00 C ATOM 1013 O GLY A 67 -6.356 -8.881 -8.292 1.00 0.00 O ATOM 0 H GLY A 67 -9.520 -9.759 -8.313 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -8.433 -8.244 -5.965 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -7.917 -9.833 -6.494 1.00 0.00 H new ATOM 1017 N GLY A 68 -7.285 -6.934 -7.919 1.00 0.00 N ATOM 1018 CA GLY A 68 -6.293 -6.238 -8.781 1.00 0.00 C ATOM 1019 C GLY A 68 -5.001 -6.042 -7.993 1.00 0.00 C ATOM 1020 O GLY A 68 -4.382 -4.998 -8.039 1.00 0.00 O ATOM 0 H GLY A 68 -7.986 -6.329 -7.492 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.100 -6.822 -9.681 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.686 -5.274 -9.105 1.00 0.00 H new ATOM 1024 N LEU A 69 -4.585 -7.046 -7.274 1.00 0.00 N ATOM 1025 CA LEU A 69 -3.335 -6.934 -6.489 1.00 0.00 C ATOM 1026 C LEU A 69 -2.326 -7.942 -7.024 1.00 0.00 C ATOM 1027 O LEU A 69 -1.378 -8.314 -6.362 1.00 0.00 O ATOM 1028 CB LEU A 69 -3.725 -7.265 -5.049 1.00 0.00 C ATOM 1029 CG LEU A 69 -4.716 -8.437 -5.020 1.00 0.00 C ATOM 1030 CD1 LEU A 69 -4.099 -9.649 -5.719 1.00 0.00 C ATOM 1031 CD2 LEU A 69 -5.026 -8.803 -3.567 1.00 0.00 C ATOM 0 H LEU A 69 -5.064 -7.944 -7.199 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.882 -5.945 -6.552 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.835 -7.519 -4.473 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.172 -6.390 -4.576 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.633 -8.146 -5.533 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.804 -10.480 -5.697 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.870 -9.395 -6.754 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.182 -9.938 -5.205 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.730 -9.635 -3.544 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.105 -9.092 -3.060 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.464 -7.943 -3.061 1.00 0.00 H new ATOM 1043 N THR A 70 -2.546 -8.393 -8.224 1.00 0.00 N ATOM 1044 CA THR A 70 -1.622 -9.395 -8.829 1.00 0.00 C ATOM 1045 C THR A 70 -0.175 -8.955 -8.618 1.00 0.00 C ATOM 1046 O THR A 70 0.096 -7.805 -8.331 1.00 0.00 O ATOM 1047 CB THR A 70 -1.967 -9.406 -10.319 1.00 0.00 C ATOM 1048 OG1 THR A 70 -1.112 -10.320 -10.992 1.00 0.00 O ATOM 1049 CG2 THR A 70 -1.776 -8.004 -10.898 1.00 0.00 C ATOM 0 H THR A 70 -3.328 -8.112 -8.816 1.00 0.00 H new ATOM 0 HA THR A 70 -1.728 -10.384 -8.383 1.00 0.00 H new ATOM 0 HB THR A 70 -3.005 -9.712 -10.452 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.332 -10.331 -11.947 1.00 0.00 H new ATOM 0 HG21 THR A 70 -2.022 -8.012 -11.960 1.00 0.00 H new ATOM 0 HG22 THR A 70 -2.431 -7.304 -10.379 1.00 0.00 H new ATOM 0 HG23 THR A 70 -0.739 -7.695 -10.768 1.00 0.00 H new ATOM 1057 N ARG A 71 0.758 -9.861 -8.727 1.00 0.00 N ATOM 1058 CA ARG A 71 2.179 -9.483 -8.497 1.00 0.00 C ATOM 1059 C ARG A 71 2.348 -9.109 -7.025 1.00 0.00 C ATOM 1060 O ARG A 71 1.767 -9.726 -6.154 1.00 0.00 O ATOM 1061 CB ARG A 71 2.426 -8.269 -9.394 1.00 0.00 C ATOM 1062 CG ARG A 71 3.858 -8.311 -9.927 1.00 0.00 C ATOM 1063 CD ARG A 71 4.433 -6.894 -9.950 1.00 0.00 C ATOM 1064 NE ARG A 71 5.870 -7.069 -10.297 1.00 0.00 N ATOM 1065 CZ ARG A 71 6.487 -6.158 -10.997 1.00 0.00 C ATOM 1066 NH1 ARG A 71 6.298 -4.894 -10.733 1.00 0.00 N ATOM 1067 NH2 ARG A 71 7.291 -6.509 -11.963 1.00 0.00 N ATOM 0 H ARG A 71 0.598 -10.840 -8.964 1.00 0.00 H new ATOM 0 HA ARG A 71 2.879 -10.287 -8.725 1.00 0.00 H new ATOM 0 HB2 ARG A 71 1.718 -8.266 -10.223 1.00 0.00 H new ATOM 0 HB3 ARG A 71 2.263 -7.349 -8.832 1.00 0.00 H new ATOM 0 HG2 ARG A 71 4.473 -8.955 -9.298 1.00 0.00 H new ATOM 0 HG3 ARG A 71 3.872 -8.737 -10.930 1.00 0.00 H new ATOM 0 HD2 ARG A 71 3.922 -6.272 -10.685 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.317 -6.405 -8.983 1.00 0.00 H new ATOM 0 HE ARG A 71 6.372 -7.901 -9.987 1.00 0.00 H new ATOM 0 HH11 ARG A 71 5.668 -4.619 -9.979 1.00 0.00 H new ATOM 0 HH12 ARG A 71 6.780 -4.181 -11.280 1.00 0.00 H new ATOM 0 HH21 ARG A 71 7.437 -7.497 -12.171 1.00 0.00 H new ATOM 0 HH22 ARG A 71 7.773 -5.796 -12.510 1.00 0.00 H new ATOM 1081 N ASN A 72 3.108 -8.096 -6.730 1.00 0.00 N ATOM 1082 CA ASN A 72 3.267 -7.692 -5.321 1.00 0.00 C ATOM 1083 C ASN A 72 2.500 -6.382 -5.099 1.00 0.00 C ATOM 1084 O ASN A 72 3.074 -5.344 -4.841 1.00 0.00 O ATOM 1085 CB ASN A 72 4.775 -7.508 -5.127 1.00 0.00 C ATOM 1086 CG ASN A 72 5.033 -6.663 -3.885 1.00 0.00 C ATOM 1087 OD1 ASN A 72 4.097 -6.555 -2.987 1.00 0.00 O flip ATOM 1088 ND2 ASN A 72 6.097 -6.100 -3.727 1.00 0.00 N flip ATOM 0 H ASN A 72 3.624 -7.534 -7.407 1.00 0.00 H new ATOM 0 HA ASN A 72 2.875 -8.419 -4.610 1.00 0.00 H new ATOM 0 HB2 ASN A 72 5.260 -8.479 -5.025 1.00 0.00 H new ATOM 0 HB3 ASN A 72 5.208 -7.026 -6.003 1.00 0.00 H new ATOM 0 HD21 ASN A 72 6.829 -6.186 -4.432 1.00 0.00 H new ATOM 0 HD22 ASN A 72 6.259 -5.541 -2.889 1.00 0.00 H new ATOM 1095 N TYR A 73 1.200 -6.433 -5.192 1.00 0.00 N ATOM 1096 CA TYR A 73 0.385 -5.204 -4.979 1.00 0.00 C ATOM 1097 C TYR A 73 -0.520 -5.390 -3.758 1.00 0.00 C ATOM 1098 O TYR A 73 -1.195 -6.390 -3.615 1.00 0.00 O ATOM 1099 CB TYR A 73 -0.455 -5.050 -6.249 1.00 0.00 C ATOM 1100 CG TYR A 73 0.447 -4.883 -7.452 1.00 0.00 C ATOM 1101 CD1 TYR A 73 1.760 -4.416 -7.295 1.00 0.00 C ATOM 1102 CD2 TYR A 73 -0.034 -5.195 -8.730 1.00 0.00 C ATOM 1103 CE1 TYR A 73 2.587 -4.261 -8.414 1.00 0.00 C ATOM 1104 CE2 TYR A 73 0.794 -5.040 -9.848 1.00 0.00 C ATOM 1105 CZ TYR A 73 2.104 -4.573 -9.690 1.00 0.00 C ATOM 1106 OH TYR A 73 2.920 -4.420 -10.793 1.00 0.00 O ATOM 0 H TYR A 73 0.666 -7.275 -5.407 1.00 0.00 H new ATOM 0 HA TYR A 73 1.002 -4.324 -4.797 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -1.092 -5.924 -6.381 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -1.114 -4.187 -6.156 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.133 -4.176 -6.310 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -1.045 -5.555 -8.853 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.598 -3.901 -8.293 1.00 0.00 H new ATOM 0 HE2 TYR A 73 0.422 -5.281 -10.833 1.00 0.00 H new ATOM 0 HH TYR A 73 2.431 -4.682 -11.601 1.00 0.00 H new ATOM 1116 N CYS A 74 -0.530 -4.434 -2.876 1.00 0.00 N ATOM 1117 CA CYS A 74 -1.379 -4.539 -1.650 1.00 0.00 C ATOM 1118 C CYS A 74 -2.867 -4.446 -2.009 1.00 0.00 C ATOM 1119 O CYS A 74 -3.248 -3.785 -2.954 1.00 0.00 O ATOM 1120 CB CYS A 74 -0.972 -3.345 -0.787 1.00 0.00 C ATOM 1121 SG CYS A 74 0.201 -3.882 0.482 1.00 0.00 S ATOM 0 H CYS A 74 0.016 -3.576 -2.948 1.00 0.00 H new ATOM 0 HA CYS A 74 -1.237 -5.491 -1.139 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -0.521 -2.571 -1.409 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -1.853 -2.905 -0.319 1.00 0.00 H new ATOM 1126 N ARG A 75 -3.710 -5.100 -1.253 1.00 0.00 N ATOM 1127 CA ARG A 75 -5.176 -5.047 -1.542 1.00 0.00 C ATOM 1128 C ARG A 75 -5.979 -5.254 -0.253 1.00 0.00 C ATOM 1129 O ARG A 75 -5.494 -5.813 0.711 1.00 0.00 O ATOM 1130 CB ARG A 75 -5.425 -6.195 -2.522 1.00 0.00 C ATOM 1131 CG ARG A 75 -6.188 -5.698 -3.764 1.00 0.00 C ATOM 1132 CD ARG A 75 -5.562 -4.405 -4.300 1.00 0.00 C ATOM 1133 NE ARG A 75 -6.248 -4.156 -5.598 1.00 0.00 N ATOM 1134 CZ ARG A 75 -7.148 -3.215 -5.690 1.00 0.00 C ATOM 1135 NH1 ARG A 75 -7.013 -2.109 -5.009 1.00 0.00 N ATOM 1136 NH2 ARG A 75 -8.185 -3.378 -6.467 1.00 0.00 N ATOM 0 H ARG A 75 -3.448 -5.669 -0.448 1.00 0.00 H new ATOM 0 HA ARG A 75 -5.483 -4.085 -1.953 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -4.474 -6.633 -2.825 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -5.996 -6.982 -2.030 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -6.172 -6.465 -4.539 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -7.234 -5.524 -3.510 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.713 -3.577 -3.608 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -4.486 -4.514 -4.436 1.00 0.00 H new ATOM 0 HE ARG A 75 -6.015 -4.721 -6.415 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -6.203 -1.979 -4.403 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -7.718 -1.375 -5.083 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -8.291 -4.240 -7.001 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -8.889 -2.643 -6.539 1.00 0.00 H new ATOM 1150 N ASN A 76 -7.205 -4.801 -0.227 1.00 0.00 N ATOM 1151 CA ASN A 76 -8.039 -4.965 1.000 1.00 0.00 C ATOM 1152 C ASN A 76 -9.415 -5.533 0.641 1.00 0.00 C ATOM 1153 O ASN A 76 -10.411 -4.841 0.712 1.00 0.00 O ATOM 1154 CB ASN A 76 -8.178 -3.555 1.576 1.00 0.00 C ATOM 1155 CG ASN A 76 -9.301 -3.532 2.616 1.00 0.00 C ATOM 1156 OD1 ASN A 76 -9.138 -4.026 3.714 1.00 0.00 O ATOM 1157 ND2 ASN A 76 -10.441 -2.974 2.314 1.00 0.00 N ATOM 0 H ASN A 76 -7.665 -4.324 -1.003 1.00 0.00 H new ATOM 0 HA ASN A 76 -7.588 -5.657 1.712 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -7.239 -3.244 2.034 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -8.394 -2.845 0.778 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -11.196 -2.952 3.000 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -10.577 -2.559 1.392 1.00 0.00 H new ATOM 1164 N PRO A 77 -9.423 -6.784 0.272 1.00 0.00 N ATOM 1165 CA PRO A 77 -10.687 -7.463 -0.095 1.00 0.00 C ATOM 1166 C PRO A 77 -11.449 -7.897 1.164 1.00 0.00 C ATOM 1167 O PRO A 77 -12.392 -8.660 1.094 1.00 0.00 O ATOM 1168 CB PRO A 77 -10.219 -8.682 -0.880 1.00 0.00 C ATOM 1169 CG PRO A 77 -8.829 -8.960 -0.393 1.00 0.00 C ATOM 1170 CD PRO A 77 -8.263 -7.672 0.156 1.00 0.00 C ATOM 0 HA PRO A 77 -11.366 -6.825 -0.660 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -10.874 -9.536 -0.707 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -10.228 -8.486 -1.952 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -8.842 -9.730 0.378 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -8.207 -9.334 -1.207 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -7.784 -7.829 1.123 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -7.508 -7.254 -0.510 1.00 0.00 H new ATOM 1178 N ASP A 78 -11.048 -7.423 2.314 1.00 0.00 N ATOM 1179 CA ASP A 78 -11.749 -7.817 3.568 1.00 0.00 C ATOM 1180 C ASP A 78 -12.493 -6.617 4.157 1.00 0.00 C ATOM 1181 O ASP A 78 -13.203 -6.734 5.136 1.00 0.00 O ATOM 1182 CB ASP A 78 -10.638 -8.275 4.514 1.00 0.00 C ATOM 1183 CG ASP A 78 -11.077 -9.549 5.238 1.00 0.00 C ATOM 1184 OD1 ASP A 78 -11.201 -10.569 4.579 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -11.281 -9.484 6.439 1.00 0.00 O ATOM 0 H ASP A 78 -10.266 -6.780 2.438 1.00 0.00 H new ATOM 0 HA ASP A 78 -12.490 -8.598 3.399 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -9.722 -8.460 3.953 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -10.416 -7.491 5.238 1.00 0.00 H new ATOM 1190 N ALA A 79 -12.340 -5.462 3.565 1.00 0.00 N ATOM 1191 CA ALA A 79 -13.043 -4.254 4.088 1.00 0.00 C ATOM 1192 C ALA A 79 -12.460 -3.839 5.443 1.00 0.00 C ATOM 1193 O ALA A 79 -13.138 -3.264 6.271 1.00 0.00 O ATOM 1194 CB ALA A 79 -14.502 -4.680 4.239 1.00 0.00 C ATOM 0 H ALA A 79 -11.759 -5.303 2.742 1.00 0.00 H new ATOM 0 HA ALA A 79 -12.934 -3.396 3.424 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -15.088 -3.844 4.621 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -14.894 -4.985 3.269 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -14.567 -5.516 4.936 1.00 0.00 H new ATOM 1200 N GLU A 80 -11.208 -4.122 5.672 1.00 0.00 N ATOM 1201 CA GLU A 80 -10.580 -3.739 6.970 1.00 0.00 C ATOM 1202 C GLU A 80 -10.066 -2.301 6.895 1.00 0.00 C ATOM 1203 O GLU A 80 -9.939 -1.736 5.827 1.00 0.00 O ATOM 1204 CB GLU A 80 -9.412 -4.710 7.141 1.00 0.00 C ATOM 1205 CG GLU A 80 -9.510 -5.409 8.499 1.00 0.00 C ATOM 1206 CD GLU A 80 -9.808 -4.382 9.593 1.00 0.00 C ATOM 1207 OE1 GLU A 80 -8.923 -3.601 9.901 1.00 0.00 O ATOM 1208 OE2 GLU A 80 -10.915 -4.395 10.104 1.00 0.00 O ATOM 0 H GLU A 80 -10.591 -4.602 5.017 1.00 0.00 H new ATOM 0 HA GLU A 80 -11.281 -3.789 7.803 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -9.422 -5.449 6.340 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.467 -4.172 7.066 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.296 -6.164 8.473 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.577 -5.927 8.719 1.00 0.00 H new ATOM 1215 N ILE A 81 -9.757 -1.709 8.017 1.00 0.00 N ATOM 1216 CA ILE A 81 -9.237 -0.314 8.003 1.00 0.00 C ATOM 1217 C ILE A 81 -8.214 -0.172 6.884 1.00 0.00 C ATOM 1218 O ILE A 81 -8.154 0.827 6.195 1.00 0.00 O ATOM 1219 CB ILE A 81 -8.568 -0.137 9.363 1.00 0.00 C ATOM 1220 CG1 ILE A 81 -8.222 1.343 9.581 1.00 0.00 C ATOM 1221 CG2 ILE A 81 -7.294 -0.984 9.422 1.00 0.00 C ATOM 1222 CD1 ILE A 81 -6.976 1.724 8.771 1.00 0.00 C ATOM 0 H ILE A 81 -9.842 -2.132 8.941 1.00 0.00 H new ATOM 0 HA ILE A 81 -10.015 0.430 7.833 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.251 -0.462 10.147 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -9.063 1.968 9.282 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -8.047 1.530 10.640 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.817 -0.857 10.394 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.548 -2.034 9.277 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.608 -0.665 8.637 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -6.743 2.776 8.935 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -6.133 1.111 9.090 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.166 1.556 7.711 1.00 0.00 H new ATOM 1234 N SER A 82 -7.410 -1.178 6.700 1.00 0.00 N ATOM 1235 CA SER A 82 -6.382 -1.127 5.624 1.00 0.00 C ATOM 1236 C SER A 82 -6.187 -2.522 5.027 1.00 0.00 C ATOM 1237 O SER A 82 -6.599 -3.507 5.606 1.00 0.00 O ATOM 1238 CB SER A 82 -5.107 -0.646 6.311 1.00 0.00 C ATOM 1239 OG SER A 82 -4.765 -1.546 7.356 1.00 0.00 O ATOM 0 H SER A 82 -7.419 -2.037 7.250 1.00 0.00 H new ATOM 0 HA SER A 82 -6.667 -0.467 4.805 1.00 0.00 H new ATOM 0 HB2 SER A 82 -4.293 -0.584 5.589 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.254 0.356 6.713 1.00 0.00 H new ATOM 0 HG SER A 82 -4.163 -2.237 7.009 1.00 0.00 H new ATOM 1245 N PRO A 83 -5.572 -2.556 3.879 1.00 0.00 N ATOM 1246 CA PRO A 83 -5.328 -3.841 3.187 1.00 0.00 C ATOM 1247 C PRO A 83 -4.261 -4.661 3.908 1.00 0.00 C ATOM 1248 O PRO A 83 -3.793 -4.309 4.973 1.00 0.00 O ATOM 1249 CB PRO A 83 -4.846 -3.418 1.801 1.00 0.00 C ATOM 1250 CG PRO A 83 -4.284 -2.049 1.991 1.00 0.00 C ATOM 1251 CD PRO A 83 -5.048 -1.414 3.124 1.00 0.00 C ATOM 0 HA PRO A 83 -6.214 -4.475 3.153 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -4.091 -4.105 1.418 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -5.666 -3.412 1.082 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -3.220 -2.097 2.222 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -4.385 -1.460 1.079 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -4.402 -0.790 3.741 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -5.851 -0.776 2.756 1.00 0.00 H new ATOM 1259 N TRP A 84 -3.885 -5.759 3.325 1.00 0.00 N ATOM 1260 CA TRP A 84 -2.851 -6.633 3.948 1.00 0.00 C ATOM 1261 C TRP A 84 -2.205 -7.510 2.876 1.00 0.00 C ATOM 1262 O TRP A 84 -2.738 -7.672 1.798 1.00 0.00 O ATOM 1263 CB TRP A 84 -3.617 -7.495 4.953 1.00 0.00 C ATOM 1264 CG TRP A 84 -4.835 -8.062 4.295 1.00 0.00 C ATOM 1265 CD1 TRP A 84 -6.029 -7.433 4.197 1.00 0.00 C ATOM 1266 CD2 TRP A 84 -5.000 -9.355 3.642 1.00 0.00 C ATOM 1267 NE1 TRP A 84 -6.915 -8.256 3.525 1.00 0.00 N ATOM 1268 CE2 TRP A 84 -6.327 -9.452 3.163 1.00 0.00 C ATOM 1269 CE3 TRP A 84 -4.134 -10.442 3.422 1.00 0.00 C ATOM 1270 CZ2 TRP A 84 -6.780 -10.587 2.488 1.00 0.00 C ATOM 1271 CZ3 TRP A 84 -4.587 -11.585 2.744 1.00 0.00 C ATOM 1272 CH2 TRP A 84 -5.907 -11.657 2.277 1.00 0.00 C ATOM 0 H TRP A 84 -4.251 -6.095 2.434 1.00 0.00 H new ATOM 0 HA TRP A 84 -2.054 -6.064 4.426 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -2.980 -8.300 5.318 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -3.903 -6.897 5.818 1.00 0.00 H new ATOM 0 HD1 TRP A 84 -6.254 -6.449 4.581 1.00 0.00 H new ATOM 0 HE1 TRP A 84 -7.884 -8.010 3.322 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -3.115 -10.397 3.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -7.798 -10.637 2.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.914 -12.414 2.581 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -6.248 -12.539 1.755 1.00 0.00 H new ATOM 1283 N CYS A 85 -1.064 -8.075 3.155 1.00 0.00 N ATOM 1284 CA CYS A 85 -0.406 -8.939 2.130 1.00 0.00 C ATOM 1285 C CYS A 85 0.796 -9.678 2.725 1.00 0.00 C ATOM 1286 O CYS A 85 1.390 -9.245 3.693 1.00 0.00 O ATOM 1287 CB CYS A 85 0.051 -7.975 1.035 1.00 0.00 C ATOM 1288 SG CYS A 85 1.010 -8.885 -0.201 1.00 0.00 S ATOM 0 H CYS A 85 -0.561 -7.979 4.037 1.00 0.00 H new ATOM 0 HA CYS A 85 -1.084 -9.704 1.752 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -0.813 -7.503 0.567 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.656 -7.177 1.466 1.00 0.00 H new ATOM 1293 N TYR A 86 1.163 -10.789 2.142 1.00 0.00 N ATOM 1294 CA TYR A 86 2.332 -11.557 2.659 1.00 0.00 C ATOM 1295 C TYR A 86 3.597 -10.701 2.554 1.00 0.00 C ATOM 1296 O TYR A 86 3.656 -9.770 1.779 1.00 0.00 O ATOM 1297 CB TYR A 86 2.428 -12.785 1.750 1.00 0.00 C ATOM 1298 CG TYR A 86 1.115 -13.534 1.778 1.00 0.00 C ATOM 1299 CD1 TYR A 86 0.715 -14.197 2.944 1.00 0.00 C ATOM 1300 CD2 TYR A 86 0.296 -13.565 0.641 1.00 0.00 C ATOM 1301 CE1 TYR A 86 -0.501 -14.889 2.976 1.00 0.00 C ATOM 1302 CE2 TYR A 86 -0.921 -14.258 0.674 1.00 0.00 C ATOM 1303 CZ TYR A 86 -1.319 -14.919 1.842 1.00 0.00 C ATOM 1304 OH TYR A 86 -2.518 -15.601 1.875 1.00 0.00 O ATOM 0 H TYR A 86 0.702 -11.198 1.329 1.00 0.00 H new ATOM 0 HA TYR A 86 2.223 -11.839 3.706 1.00 0.00 H new ATOM 0 HB2 TYR A 86 2.663 -12.479 0.731 1.00 0.00 H new ATOM 0 HB3 TYR A 86 3.237 -13.435 2.083 1.00 0.00 H new ATOM 0 HD1 TYR A 86 1.346 -14.175 3.820 1.00 0.00 H new ATOM 0 HD2 TYR A 86 0.603 -13.055 -0.260 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -0.808 -15.400 3.877 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -1.552 -14.282 -0.202 1.00 0.00 H new ATOM 0 HH TYR A 86 -2.964 -15.522 1.006 1.00 0.00 H new ATOM 1314 N THR A 87 4.607 -10.998 3.330 1.00 0.00 N ATOM 1315 CA THR A 87 5.858 -10.182 3.266 1.00 0.00 C ATOM 1316 C THR A 87 6.873 -10.816 2.315 1.00 0.00 C ATOM 1317 O THR A 87 7.092 -12.011 2.332 1.00 0.00 O ATOM 1318 CB THR A 87 6.416 -10.183 4.688 1.00 0.00 C ATOM 1319 OG1 THR A 87 5.858 -11.265 5.412 1.00 0.00 O ATOM 1320 CG2 THR A 87 6.072 -8.867 5.381 1.00 0.00 C ATOM 0 H THR A 87 4.621 -11.765 4.002 1.00 0.00 H new ATOM 0 HA THR A 87 5.657 -9.176 2.898 1.00 0.00 H new ATOM 0 HB THR A 87 7.500 -10.292 4.650 1.00 0.00 H new ATOM 0 HG1 THR A 87 6.470 -12.029 5.381 1.00 0.00 H new ATOM 0 HG21 THR A 87 6.473 -8.874 6.395 1.00 0.00 H new ATOM 0 HG22 THR A 87 6.508 -8.038 4.824 1.00 0.00 H new ATOM 0 HG23 THR A 87 4.989 -8.748 5.420 1.00 0.00 H new ATOM 1328 N MET A 88 7.508 -10.017 1.501 1.00 0.00 N ATOM 1329 CA MET A 88 8.528 -10.557 0.556 1.00 0.00 C ATOM 1330 C MET A 88 9.542 -11.437 1.298 1.00 0.00 C ATOM 1331 O MET A 88 10.272 -12.195 0.690 1.00 0.00 O ATOM 1332 CB MET A 88 9.215 -9.320 -0.026 1.00 0.00 C ATOM 1333 CG MET A 88 9.973 -8.583 1.079 1.00 0.00 C ATOM 1334 SD MET A 88 11.497 -7.882 0.399 1.00 0.00 S ATOM 1335 CE MET A 88 12.517 -8.070 1.882 1.00 0.00 C ATOM 0 H MET A 88 7.364 -9.009 1.449 1.00 0.00 H new ATOM 0 HA MET A 88 8.081 -11.183 -0.217 1.00 0.00 H new ATOM 0 HB2 MET A 88 9.903 -9.614 -0.819 1.00 0.00 H new ATOM 0 HB3 MET A 88 8.474 -8.659 -0.476 1.00 0.00 H new ATOM 0 HG2 MET A 88 9.350 -7.792 1.497 1.00 0.00 H new ATOM 0 HG3 MET A 88 10.207 -9.268 1.894 1.00 0.00 H new ATOM 0 HE1 MET A 88 13.520 -7.693 1.684 1.00 0.00 H new ATOM 0 HE2 MET A 88 12.073 -7.506 2.703 1.00 0.00 H new ATOM 0 HE3 MET A 88 12.573 -9.124 2.154 1.00 0.00 H new ATOM 1345 N ASP A 89 9.599 -11.353 2.604 1.00 0.00 N ATOM 1346 CA ASP A 89 10.564 -12.193 3.353 1.00 0.00 C ATOM 1347 C ASP A 89 9.809 -13.247 4.160 1.00 0.00 C ATOM 1348 O ASP A 89 8.780 -12.969 4.743 1.00 0.00 O ATOM 1349 CB ASP A 89 11.298 -11.227 4.284 1.00 0.00 C ATOM 1350 CG ASP A 89 12.802 -11.302 4.012 1.00 0.00 C ATOM 1351 OD1 ASP A 89 13.167 -11.565 2.879 1.00 0.00 O ATOM 1352 OD2 ASP A 89 13.563 -11.095 4.944 1.00 0.00 O ATOM 0 H ASP A 89 9.019 -10.739 3.176 1.00 0.00 H new ATOM 0 HA ASP A 89 11.255 -12.721 2.696 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.939 -10.210 4.127 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.092 -11.480 5.324 1.00 0.00 H new ATOM 1357 N PRO A 90 10.355 -14.424 4.164 1.00 0.00 N ATOM 1358 CA PRO A 90 9.741 -15.549 4.905 1.00 0.00 C ATOM 1359 C PRO A 90 9.851 -15.302 6.408 1.00 0.00 C ATOM 1360 O PRO A 90 9.223 -15.968 7.206 1.00 0.00 O ATOM 1361 CB PRO A 90 10.569 -16.757 4.473 1.00 0.00 C ATOM 1362 CG PRO A 90 11.882 -16.182 4.044 1.00 0.00 C ATOM 1363 CD PRO A 90 11.589 -14.814 3.488 1.00 0.00 C ATOM 0 HA PRO A 90 8.679 -15.684 4.698 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.695 -17.464 5.293 1.00 0.00 H new ATOM 0 HB3 PRO A 90 10.087 -17.296 3.658 1.00 0.00 H new ATOM 0 HG2 PRO A 90 12.571 -16.119 4.886 1.00 0.00 H new ATOM 0 HG3 PRO A 90 12.355 -16.813 3.292 1.00 0.00 H new ATOM 0 HD2 PRO A 90 12.399 -14.115 3.697 1.00 0.00 H new ATOM 0 HD3 PRO A 90 11.462 -14.840 2.406 1.00 0.00 H new ATOM 1371 N ASN A 91 10.634 -14.334 6.796 1.00 0.00 N ATOM 1372 CA ASN A 91 10.771 -14.028 8.245 1.00 0.00 C ATOM 1373 C ASN A 91 9.490 -13.360 8.743 1.00 0.00 C ATOM 1374 O ASN A 91 9.209 -13.332 9.924 1.00 0.00 O ATOM 1375 CB ASN A 91 11.954 -13.064 8.341 1.00 0.00 C ATOM 1376 CG ASN A 91 13.263 -13.854 8.297 1.00 0.00 C ATOM 1377 OD1 ASN A 91 14.131 -13.570 7.496 1.00 0.00 O ATOM 1378 ND2 ASN A 91 13.442 -14.842 9.131 1.00 0.00 N ATOM 0 H ASN A 91 11.184 -13.743 6.172 1.00 0.00 H new ATOM 0 HA ASN A 91 10.933 -14.920 8.851 1.00 0.00 H new ATOM 0 HB2 ASN A 91 11.921 -12.349 7.519 1.00 0.00 H new ATOM 0 HB3 ASN A 91 11.895 -12.490 9.266 1.00 0.00 H new ATOM 0 HD21 ASN A 91 14.311 -15.376 9.110 1.00 0.00 H new ATOM 0 HD22 ASN A 91 12.713 -15.080 9.803 1.00 0.00 H new ATOM 1385 N VAL A 92 8.710 -12.821 7.843 1.00 0.00 N ATOM 1386 CA VAL A 92 7.447 -12.155 8.256 1.00 0.00 C ATOM 1387 C VAL A 92 6.241 -12.921 7.705 1.00 0.00 C ATOM 1388 O VAL A 92 6.187 -13.254 6.538 1.00 0.00 O ATOM 1389 CB VAL A 92 7.524 -10.758 7.638 1.00 0.00 C ATOM 1390 CG1 VAL A 92 6.221 -10.009 7.923 1.00 0.00 C ATOM 1391 CG2 VAL A 92 8.694 -9.992 8.261 1.00 0.00 C ATOM 0 H VAL A 92 8.896 -12.815 6.840 1.00 0.00 H new ATOM 0 HA VAL A 92 7.330 -12.119 9.339 1.00 0.00 H new ATOM 0 HB VAL A 92 7.673 -10.841 6.561 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.271 -9.012 7.484 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.384 -10.556 7.488 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.078 -9.925 9.000 1.00 0.00 H new ATOM 0 HG21 VAL A 92 8.751 -8.996 7.822 1.00 0.00 H new ATOM 0 HG22 VAL A 92 8.541 -9.907 9.337 1.00 0.00 H new ATOM 0 HG23 VAL A 92 9.624 -10.528 8.068 1.00 0.00 H new ATOM 1401 N ARG A 93 5.274 -13.204 8.533 1.00 0.00 N ATOM 1402 CA ARG A 93 4.078 -13.941 8.052 1.00 0.00 C ATOM 1403 C ARG A 93 3.261 -13.044 7.120 1.00 0.00 C ATOM 1404 O ARG A 93 3.066 -13.345 5.959 1.00 0.00 O ATOM 1405 CB ARG A 93 3.281 -14.273 9.315 1.00 0.00 C ATOM 1406 CG ARG A 93 2.827 -15.732 9.264 1.00 0.00 C ATOM 1407 CD ARG A 93 2.112 -15.998 7.939 1.00 0.00 C ATOM 1408 NE ARG A 93 2.852 -17.134 7.325 1.00 0.00 N ATOM 1409 CZ ARG A 93 2.215 -18.224 6.999 1.00 0.00 C ATOM 1410 NH1 ARG A 93 0.984 -18.155 6.569 1.00 0.00 N ATOM 1411 NH2 ARG A 93 2.806 -19.383 7.104 1.00 0.00 N ATOM 0 H ARG A 93 5.263 -12.955 9.522 1.00 0.00 H new ATOM 0 HA ARG A 93 4.337 -14.839 7.491 1.00 0.00 H new ATOM 0 HB2 ARG A 93 3.894 -14.103 10.200 1.00 0.00 H new ATOM 0 HB3 ARG A 93 2.416 -13.615 9.395 1.00 0.00 H new ATOM 0 HG2 ARG A 93 3.686 -16.395 9.365 1.00 0.00 H new ATOM 0 HG3 ARG A 93 2.160 -15.946 10.099 1.00 0.00 H new ATOM 0 HD2 ARG A 93 1.064 -16.250 8.100 1.00 0.00 H new ATOM 0 HD3 ARG A 93 2.133 -15.119 7.295 1.00 0.00 H new ATOM 0 HE ARG A 93 3.856 -17.060 7.160 1.00 0.00 H new ATOM 0 HH11 ARG A 93 0.522 -17.249 6.488 1.00 0.00 H new ATOM 0 HH12 ARG A 93 0.484 -19.007 6.314 1.00 0.00 H new ATOM 0 HH21 ARG A 93 3.767 -19.437 7.441 1.00 0.00 H new ATOM 0 HH22 ARG A 93 2.307 -20.235 6.849 1.00 0.00 H new ATOM 1425 N TRP A 94 2.794 -11.938 7.625 1.00 0.00 N ATOM 1426 CA TRP A 94 1.998 -10.997 6.788 1.00 0.00 C ATOM 1427 C TRP A 94 2.005 -9.616 7.442 1.00 0.00 C ATOM 1428 O TRP A 94 2.521 -9.442 8.528 1.00 0.00 O ATOM 1429 CB TRP A 94 0.583 -11.574 6.760 1.00 0.00 C ATOM 1430 CG TRP A 94 0.007 -11.544 8.138 1.00 0.00 C ATOM 1431 CD1 TRP A 94 0.006 -12.585 8.999 1.00 0.00 C ATOM 1432 CD2 TRP A 94 -0.650 -10.440 8.828 1.00 0.00 C ATOM 1433 NE1 TRP A 94 -0.608 -12.193 10.176 1.00 0.00 N ATOM 1434 CE2 TRP A 94 -1.028 -10.878 10.119 1.00 0.00 C ATOM 1435 CE3 TRP A 94 -0.950 -9.114 8.464 1.00 0.00 C ATOM 1436 CZ2 TRP A 94 -1.681 -10.032 11.017 1.00 0.00 C ATOM 1437 CZ3 TRP A 94 -1.607 -8.260 9.365 1.00 0.00 C ATOM 1438 CH2 TRP A 94 -1.971 -8.718 10.639 1.00 0.00 C ATOM 0 H TRP A 94 2.931 -11.642 8.591 1.00 0.00 H new ATOM 0 HA TRP A 94 2.399 -10.888 5.780 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.043 -10.997 6.080 1.00 0.00 H new ATOM 0 HB3 TRP A 94 0.603 -12.597 6.385 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.417 -13.564 8.801 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.735 -12.800 10.986 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -0.673 -8.751 7.485 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -1.960 -10.390 11.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -1.833 -7.245 9.075 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -2.475 -8.056 11.328 1.00 0.00 H new ATOM 1449 N GLU A 95 1.443 -8.631 6.802 1.00 0.00 N ATOM 1450 CA GLU A 95 1.435 -7.273 7.414 1.00 0.00 C ATOM 1451 C GLU A 95 0.583 -6.311 6.582 1.00 0.00 C ATOM 1452 O GLU A 95 0.520 -6.408 5.373 1.00 0.00 O ATOM 1453 CB GLU A 95 2.900 -6.836 7.409 1.00 0.00 C ATOM 1454 CG GLU A 95 3.111 -5.736 8.451 1.00 0.00 C ATOM 1455 CD GLU A 95 3.736 -6.338 9.711 1.00 0.00 C ATOM 1456 OE1 GLU A 95 4.410 -7.348 9.589 1.00 0.00 O ATOM 1457 OE2 GLU A 95 3.529 -5.780 10.775 1.00 0.00 O ATOM 0 H GLU A 95 0.992 -8.705 5.890 1.00 0.00 H new ATOM 0 HA GLU A 95 1.009 -7.276 8.417 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.545 -7.687 7.628 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.178 -6.472 6.420 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.759 -4.958 8.047 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.159 -5.264 8.695 1.00 0.00 H new ATOM 1464 N TYR A 96 -0.068 -5.379 7.223 1.00 0.00 N ATOM 1465 CA TYR A 96 -0.912 -4.405 6.473 1.00 0.00 C ATOM 1466 C TYR A 96 -0.025 -3.510 5.604 1.00 0.00 C ATOM 1467 O TYR A 96 1.183 -3.640 5.598 1.00 0.00 O ATOM 1468 CB TYR A 96 -1.609 -3.572 7.552 1.00 0.00 C ATOM 1469 CG TYR A 96 -2.912 -4.224 7.968 1.00 0.00 C ATOM 1470 CD1 TYR A 96 -3.204 -5.542 7.588 1.00 0.00 C ATOM 1471 CD2 TYR A 96 -3.831 -3.502 8.741 1.00 0.00 C ATOM 1472 CE1 TYR A 96 -4.412 -6.132 7.980 1.00 0.00 C ATOM 1473 CE2 TYR A 96 -5.038 -4.093 9.132 1.00 0.00 C ATOM 1474 CZ TYR A 96 -5.328 -5.408 8.751 1.00 0.00 C ATOM 1475 OH TYR A 96 -6.518 -5.992 9.137 1.00 0.00 O ATOM 0 H TYR A 96 -0.052 -5.250 8.235 1.00 0.00 H new ATOM 0 HA TYR A 96 -1.625 -4.897 5.812 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -0.955 -3.468 8.418 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -1.802 -2.567 7.176 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -2.497 -6.102 6.993 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -3.608 -2.487 9.036 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -4.637 -7.147 7.687 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -5.745 -3.535 9.727 1.00 0.00 H new ATOM 0 HH TYR A 96 -6.805 -5.614 9.994 1.00 0.00 H new ATOM 1485 N CYS A 97 -0.610 -2.604 4.868 1.00 0.00 N ATOM 1486 CA CYS A 97 0.212 -1.707 4.003 1.00 0.00 C ATOM 1487 C CYS A 97 0.158 -0.267 4.518 1.00 0.00 C ATOM 1488 O CYS A 97 -0.827 0.165 5.083 1.00 0.00 O ATOM 1489 CB CYS A 97 -0.410 -1.810 2.606 1.00 0.00 C ATOM 1490 SG CYS A 97 -0.769 -3.544 2.221 1.00 0.00 S ATOM 0 H CYS A 97 -1.617 -2.446 4.827 1.00 0.00 H new ATOM 0 HA CYS A 97 1.263 -1.996 3.998 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -1.326 -1.221 2.561 1.00 0.00 H new ATOM 0 HB3 CYS A 97 0.272 -1.396 1.863 1.00 0.00 H new ATOM 1495 N ASN A 98 1.218 0.475 4.328 1.00 0.00 N ATOM 1496 CA ASN A 98 1.245 1.889 4.805 1.00 0.00 C ATOM 1497 C ASN A 98 -0.005 2.632 4.344 1.00 0.00 C ATOM 1498 O ASN A 98 -0.012 3.260 3.303 1.00 0.00 O ATOM 1499 CB ASN A 98 2.483 2.506 4.154 1.00 0.00 C ATOM 1500 CG ASN A 98 3.703 2.272 5.046 1.00 0.00 C ATOM 1501 OD1 ASN A 98 3.674 1.438 5.929 1.00 0.00 O ATOM 1502 ND2 ASN A 98 4.783 2.978 4.850 1.00 0.00 N ATOM 0 H ASN A 98 2.069 0.161 3.861 1.00 0.00 H new ATOM 0 HA ASN A 98 1.274 1.948 5.893 1.00 0.00 H new ATOM 0 HB2 ASN A 98 2.648 2.064 3.172 1.00 0.00 H new ATOM 0 HB3 ASN A 98 2.331 3.575 4.001 1.00 0.00 H new ATOM 0 HD21 ASN A 98 5.603 2.830 5.438 1.00 0.00 H new ATOM 0 HD22 ASN A 98 4.807 3.678 4.109 1.00 0.00 H new ATOM 1509 N LEU A 99 -1.065 2.571 5.097 1.00 0.00 N ATOM 1510 CA LEU A 99 -2.297 3.279 4.673 1.00 0.00 C ATOM 1511 C LEU A 99 -2.991 3.924 5.877 1.00 0.00 C ATOM 1512 O LEU A 99 -2.980 3.406 6.976 1.00 0.00 O ATOM 1513 CB LEU A 99 -3.157 2.192 4.031 1.00 0.00 C ATOM 1514 CG LEU A 99 -2.536 1.797 2.694 1.00 0.00 C ATOM 1515 CD1 LEU A 99 -3.254 0.567 2.144 1.00 0.00 C ATOM 1516 CD2 LEU A 99 -2.680 2.959 1.707 1.00 0.00 C ATOM 0 H LEU A 99 -1.130 2.065 5.980 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.100 4.097 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.221 1.325 4.688 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.174 2.555 3.882 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.480 1.567 2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.811 0.284 1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.154 -0.258 2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.310 0.796 2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.238 2.681 0.750 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -3.736 3.187 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.169 3.837 2.102 1.00 0.00 H new ATOM 1528 N THR A 100 -3.590 5.061 5.659 1.00 0.00 N ATOM 1529 CA THR A 100 -4.294 5.787 6.747 1.00 0.00 C ATOM 1530 C THR A 100 -5.330 6.724 6.129 1.00 0.00 C ATOM 1531 O THR A 100 -5.241 7.077 4.969 1.00 0.00 O ATOM 1532 CB THR A 100 -3.220 6.603 7.456 1.00 0.00 C ATOM 1533 OG1 THR A 100 -2.117 6.798 6.581 1.00 0.00 O ATOM 1534 CG2 THR A 100 -2.759 5.866 8.711 1.00 0.00 C ATOM 0 H THR A 100 -3.620 5.526 4.752 1.00 0.00 H new ATOM 0 HA THR A 100 -4.805 5.112 7.434 1.00 0.00 H new ATOM 0 HB THR A 100 -3.630 7.572 7.741 1.00 0.00 H new ATOM 0 HG1 THR A 100 -1.427 7.324 7.037 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.991 6.452 9.216 1.00 0.00 H new ATOM 0 HG22 THR A 100 -3.606 5.724 9.382 1.00 0.00 H new ATOM 0 HG23 THR A 100 -2.350 4.895 8.433 1.00 0.00 H new ATOM 1542 N GLN A 101 -6.302 7.138 6.882 1.00 0.00 N ATOM 1543 CA GLN A 101 -7.325 8.060 6.313 1.00 0.00 C ATOM 1544 C GLN A 101 -6.633 9.294 5.734 1.00 0.00 C ATOM 1545 O GLN A 101 -6.247 10.194 6.454 1.00 0.00 O ATOM 1546 CB GLN A 101 -8.223 8.441 7.490 1.00 0.00 C ATOM 1547 CG GLN A 101 -9.467 7.550 7.485 1.00 0.00 C ATOM 1548 CD GLN A 101 -10.270 7.781 8.766 1.00 0.00 C ATOM 1549 OE1 GLN A 101 -10.843 8.835 8.957 1.00 0.00 O ATOM 1550 NE2 GLN A 101 -10.337 6.831 9.658 1.00 0.00 N ATOM 0 H GLN A 101 -6.436 6.883 7.860 1.00 0.00 H new ATOM 0 HA GLN A 101 -7.900 7.604 5.507 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.681 8.324 8.429 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -8.512 9.489 7.417 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -10.082 7.773 6.613 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -9.176 6.502 7.411 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -9.856 5.946 9.498 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -10.871 6.973 10.516 1.00 0.00 H new ATOM 1559 N CYS A 102 -6.460 9.339 4.438 1.00 0.00 N ATOM 1560 CA CYS A 102 -5.778 10.514 3.820 1.00 0.00 C ATOM 1561 C CYS A 102 -6.272 11.808 4.474 1.00 0.00 C ATOM 1562 O CYS A 102 -7.455 11.979 4.695 1.00 0.00 O ATOM 1563 CB CYS A 102 -6.165 10.476 2.339 1.00 0.00 C ATOM 1564 SG CYS A 102 -5.691 8.880 1.626 1.00 0.00 S ATOM 0 H CYS A 102 -6.760 8.616 3.784 1.00 0.00 H new ATOM 0 HA CYS A 102 -4.697 10.480 3.952 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -7.239 10.630 2.230 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -5.671 11.286 1.803 1.00 0.00 H new ATOM 1569 N PRO A 103 -5.343 12.675 4.771 1.00 0.00 N ATOM 1570 CA PRO A 103 -5.683 13.966 5.418 1.00 0.00 C ATOM 1571 C PRO A 103 -6.400 14.894 4.433 1.00 0.00 C ATOM 1572 O PRO A 103 -6.839 15.970 4.786 1.00 0.00 O ATOM 1573 CB PRO A 103 -4.324 14.535 5.817 1.00 0.00 C ATOM 1574 CG PRO A 103 -3.349 13.895 4.883 1.00 0.00 C ATOM 1575 CD PRO A 103 -3.902 12.538 4.532 1.00 0.00 C ATOM 0 HA PRO A 103 -6.358 13.853 6.266 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -4.307 15.621 5.722 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -4.088 14.302 6.855 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -3.218 14.502 3.987 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -2.369 13.803 5.352 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -3.692 12.276 3.495 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -3.466 11.755 5.153 1.00 0.00 H new ATOM 1583 N VAL A 104 -6.526 14.484 3.201 1.00 0.00 N ATOM 1584 CA VAL A 104 -7.219 15.340 2.197 1.00 0.00 C ATOM 1585 C VAL A 104 -8.721 15.039 2.199 1.00 0.00 C ATOM 1586 O VAL A 104 -9.479 15.602 1.434 1.00 0.00 O ATOM 1587 CB VAL A 104 -6.595 14.958 0.855 1.00 0.00 C ATOM 1588 CG1 VAL A 104 -7.366 15.633 -0.280 1.00 0.00 C ATOM 1589 CG2 VAL A 104 -5.137 15.420 0.823 1.00 0.00 C ATOM 0 H VAL A 104 -6.179 13.593 2.846 1.00 0.00 H new ATOM 0 HA VAL A 104 -7.107 16.403 2.408 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.639 13.876 0.730 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.920 15.359 -1.236 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -8.406 15.306 -0.258 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.323 16.715 -0.156 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.690 15.148 -0.133 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.095 16.502 0.949 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.585 14.939 1.631 1.00 0.00 H new ATOM 1599 N THR A 105 -9.155 14.153 3.054 1.00 0.00 N ATOM 1600 CA THR A 105 -10.607 13.813 3.107 1.00 0.00 C ATOM 1601 C THR A 105 -11.411 15.000 3.642 1.00 0.00 C ATOM 1602 O THR A 105 -11.593 15.154 4.834 1.00 0.00 O ATOM 1603 CB THR A 105 -10.700 12.627 4.069 1.00 0.00 C ATOM 1604 OG1 THR A 105 -12.047 12.180 4.136 1.00 0.00 O ATOM 1605 CG2 THR A 105 -10.233 13.058 5.460 1.00 0.00 C ATOM 0 H THR A 105 -8.567 13.650 3.718 1.00 0.00 H new ATOM 0 HA THR A 105 -11.011 13.575 2.123 1.00 0.00 H new ATOM 0 HB THR A 105 -10.065 11.817 3.711 1.00 0.00 H new ATOM 0 HG1 THR A 105 -12.109 11.419 4.751 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.300 12.212 6.144 1.00 0.00 H new ATOM 0 HG22 THR A 105 -9.200 13.401 5.407 1.00 0.00 H new ATOM 0 HG23 THR A 105 -10.866 13.868 5.822 1.00 0.00 H new ATOM 1613 N GLU A 106 -11.894 15.841 2.770 1.00 0.00 N ATOM 1614 CA GLU A 106 -12.686 17.018 3.225 1.00 0.00 C ATOM 1615 C GLU A 106 -13.657 16.610 4.337 1.00 0.00 C ATOM 1616 O GLU A 106 -14.139 15.495 4.374 1.00 0.00 O ATOM 1617 CB GLU A 106 -13.454 17.479 1.987 1.00 0.00 C ATOM 1618 CG GLU A 106 -14.437 16.387 1.561 1.00 0.00 C ATOM 1619 CD GLU A 106 -14.505 16.328 0.034 1.00 0.00 C ATOM 1620 OE1 GLU A 106 -13.677 15.648 -0.550 1.00 0.00 O ATOM 1621 OE2 GLU A 106 -15.383 16.963 -0.525 1.00 0.00 O ATOM 0 H GLU A 106 -11.774 15.764 1.760 1.00 0.00 H new ATOM 0 HA GLU A 106 -12.054 17.807 3.632 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -13.991 18.403 2.202 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -12.760 17.695 1.175 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -14.121 15.423 1.959 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -15.425 16.592 1.972 1.00 0.00 H new ATOM 1628 N SER A 107 -13.949 17.505 5.241 1.00 0.00 N ATOM 1629 CA SER A 107 -14.890 17.170 6.350 1.00 0.00 C ATOM 1630 C SER A 107 -16.315 17.015 5.809 1.00 0.00 C ATOM 1631 O SER A 107 -16.539 17.017 4.615 1.00 0.00 O ATOM 1632 CB SER A 107 -14.808 18.356 7.310 1.00 0.00 C ATOM 1633 OG SER A 107 -14.748 17.875 8.646 1.00 0.00 O ATOM 0 H SER A 107 -13.577 18.455 5.260 1.00 0.00 H new ATOM 0 HA SER A 107 -14.633 16.230 6.839 1.00 0.00 H new ATOM 0 HB2 SER A 107 -13.927 18.958 7.088 1.00 0.00 H new ATOM 0 HB3 SER A 107 -15.676 19.003 7.183 1.00 0.00 H new ATOM 0 HG SER A 107 -14.694 18.633 9.265 1.00 0.00 H new ATOM 1639 N SER A 108 -17.279 16.881 6.680 1.00 0.00 N ATOM 1640 CA SER A 108 -18.688 16.726 6.215 1.00 0.00 C ATOM 1641 C SER A 108 -19.251 18.080 5.771 1.00 0.00 C ATOM 1642 O SER A 108 -20.401 18.191 5.394 1.00 0.00 O ATOM 1643 CB SER A 108 -19.450 16.199 7.431 1.00 0.00 C ATOM 1644 OG SER A 108 -19.997 14.923 7.126 1.00 0.00 O ATOM 0 H SER A 108 -17.152 16.872 7.692 1.00 0.00 H new ATOM 0 HA SER A 108 -18.770 16.054 5.361 1.00 0.00 H new ATOM 0 HB2 SER A 108 -18.782 16.125 8.289 1.00 0.00 H new ATOM 0 HB3 SER A 108 -20.245 16.892 7.705 1.00 0.00 H new ATOM 0 HG SER A 108 -20.485 14.582 7.904 1.00 0.00 H new ATOM 1650 N VAL A 109 -18.450 19.109 5.813 1.00 0.00 N ATOM 1651 CA VAL A 109 -18.939 20.454 5.391 1.00 0.00 C ATOM 1652 C VAL A 109 -19.623 20.360 4.024 1.00 0.00 C ATOM 1653 O VAL A 109 -19.323 19.492 3.228 1.00 0.00 O ATOM 1654 CB VAL A 109 -17.685 21.324 5.307 1.00 0.00 C ATOM 1655 CG1 VAL A 109 -16.816 20.854 4.140 1.00 0.00 C ATOM 1656 CG2 VAL A 109 -18.089 22.784 5.083 1.00 0.00 C ATOM 0 H VAL A 109 -17.478 19.078 6.121 1.00 0.00 H new ATOM 0 HA VAL A 109 -19.672 20.865 6.085 1.00 0.00 H new ATOM 0 HB VAL A 109 -17.123 21.240 6.237 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -15.922 21.474 4.080 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -16.527 19.815 4.297 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -17.379 20.938 3.210 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -17.194 23.404 5.023 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -18.651 22.867 4.153 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -18.709 23.121 5.913 1.00 0.00 H new ATOM 1666 N LEU A 110 -20.541 21.244 3.747 1.00 0.00 N ATOM 1667 CA LEU A 110 -21.245 21.201 2.433 1.00 0.00 C ATOM 1668 C LEU A 110 -20.672 22.260 1.487 1.00 0.00 C ATOM 1669 O LEU A 110 -21.317 23.242 1.174 1.00 0.00 O ATOM 1670 CB LEU A 110 -22.706 21.505 2.760 1.00 0.00 C ATOM 1671 CG LEU A 110 -23.386 20.241 3.287 1.00 0.00 C ATOM 1672 CD1 LEU A 110 -23.457 20.296 4.815 1.00 0.00 C ATOM 1673 CD2 LEU A 110 -24.802 20.152 2.715 1.00 0.00 C ATOM 0 H LEU A 110 -20.835 21.994 4.373 1.00 0.00 H new ATOM 0 HA LEU A 110 -21.130 20.239 1.934 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -22.765 22.299 3.504 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -23.222 21.863 1.869 1.00 0.00 H new ATOM 0 HG LEU A 110 -22.812 19.366 2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -23.942 19.394 5.189 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -22.449 20.362 5.224 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -24.031 21.171 5.121 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -25.290 19.252 3.089 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -25.374 21.028 3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -24.753 20.113 1.627 1.00 0.00 H new ATOM 1685 N ALA A 111 -19.466 22.067 1.027 1.00 0.00 N ATOM 1686 CA ALA A 111 -18.852 23.061 0.101 1.00 0.00 C ATOM 1687 C ALA A 111 -19.305 22.791 -1.337 1.00 0.00 C ATOM 1688 O ALA A 111 -19.629 21.678 -1.697 1.00 0.00 O ATOM 1689 CB ALA A 111 -17.345 22.849 0.238 1.00 0.00 C ATOM 0 H ALA A 111 -18.879 21.264 1.252 1.00 0.00 H new ATOM 0 HA ALA A 111 -19.142 24.084 0.339 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -16.819 23.546 -0.415 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -17.046 23.023 1.271 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -17.094 21.827 -0.045 1.00 0.00 H new ATOM 1695 N THR A 112 -19.330 23.803 -2.160 1.00 0.00 N ATOM 1696 CA THR A 112 -19.763 23.603 -3.573 1.00 0.00 C ATOM 1697 C THR A 112 -18.571 23.780 -4.519 1.00 0.00 C ATOM 1698 O THR A 112 -17.520 24.247 -4.127 1.00 0.00 O ATOM 1699 CB THR A 112 -20.817 24.685 -3.828 1.00 0.00 C ATOM 1700 OG1 THR A 112 -21.083 25.387 -2.621 1.00 0.00 O ATOM 1701 CG2 THR A 112 -22.105 24.035 -4.334 1.00 0.00 C ATOM 0 H THR A 112 -19.070 24.759 -1.916 1.00 0.00 H new ATOM 0 HA THR A 112 -20.161 22.603 -3.744 1.00 0.00 H new ATOM 0 HB THR A 112 -20.443 25.383 -4.577 1.00 0.00 H new ATOM 0 HG1 THR A 112 -21.756 26.080 -2.787 1.00 0.00 H new ATOM 0 HG21 THR A 112 -22.854 24.805 -4.515 1.00 0.00 H new ATOM 0 HG22 THR A 112 -21.902 23.500 -5.262 1.00 0.00 H new ATOM 0 HG23 THR A 112 -22.478 23.335 -3.586 1.00 0.00 H new ATOM 1709 N SER A 113 -18.727 23.409 -5.761 1.00 0.00 N ATOM 1710 CA SER A 113 -17.602 23.555 -6.729 1.00 0.00 C ATOM 1711 C SER A 113 -17.465 25.017 -7.162 1.00 0.00 C ATOM 1712 O SER A 113 -18.273 25.532 -7.908 1.00 0.00 O ATOM 1713 CB SER A 113 -17.987 22.678 -7.919 1.00 0.00 C ATOM 1714 OG SER A 113 -19.065 23.284 -8.619 1.00 0.00 O ATOM 0 H SER A 113 -19.583 23.012 -6.147 1.00 0.00 H new ATOM 0 HA SER A 113 -16.645 23.260 -6.298 1.00 0.00 H new ATOM 0 HB2 SER A 113 -17.132 22.551 -8.583 1.00 0.00 H new ATOM 0 HB3 SER A 113 -18.274 21.684 -7.575 1.00 0.00 H new ATOM 0 HG SER A 113 -19.018 24.257 -8.513 1.00 0.00 H new ATOM 1720 N THR A 114 -16.447 25.688 -6.699 1.00 0.00 N ATOM 1721 CA THR A 114 -16.259 27.116 -7.084 1.00 0.00 C ATOM 1722 C THR A 114 -14.911 27.300 -7.786 1.00 0.00 C ATOM 1723 O THR A 114 -13.922 26.696 -7.421 1.00 0.00 O ATOM 1724 CB THR A 114 -16.291 27.887 -5.763 1.00 0.00 C ATOM 1725 OG1 THR A 114 -17.539 27.669 -5.122 1.00 0.00 O ATOM 1726 CG2 THR A 114 -16.109 29.380 -6.036 1.00 0.00 C ATOM 0 H THR A 114 -15.737 25.310 -6.071 1.00 0.00 H new ATOM 0 HA THR A 114 -17.025 27.464 -7.777 1.00 0.00 H new ATOM 0 HB THR A 114 -15.484 27.539 -5.118 1.00 0.00 H new ATOM 0 HG1 THR A 114 -17.562 28.160 -4.274 1.00 0.00 H new ATOM 0 HG21 THR A 114 -16.132 29.928 -5.094 1.00 0.00 H new ATOM 0 HG22 THR A 114 -15.151 29.546 -6.529 1.00 0.00 H new ATOM 0 HG23 THR A 114 -16.914 29.733 -6.681 1.00 0.00 H new ATOM 1734 N ALA A 115 -14.865 28.129 -8.793 1.00 0.00 N ATOM 1735 CA ALA A 115 -13.581 28.350 -9.521 1.00 0.00 C ATOM 1736 C ALA A 115 -12.572 29.065 -8.619 1.00 0.00 C ATOM 1737 O ALA A 115 -12.723 30.228 -8.301 1.00 0.00 O ATOM 1738 CB ALA A 115 -13.951 29.231 -10.714 1.00 0.00 C ATOM 0 H ALA A 115 -15.660 28.663 -9.144 1.00 0.00 H new ATOM 0 HA ALA A 115 -13.117 27.413 -9.831 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -13.058 29.440 -11.303 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -14.682 28.714 -11.335 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -14.377 30.168 -10.356 1.00 0.00 H new ATOM 1744 N VAL A 116 -11.540 28.379 -8.207 1.00 0.00 N ATOM 1745 CA VAL A 116 -10.520 29.020 -7.329 1.00 0.00 C ATOM 1746 C VAL A 116 -9.674 30.009 -8.138 1.00 0.00 C ATOM 1747 O VAL A 116 -9.068 30.911 -7.595 1.00 0.00 O ATOM 1748 CB VAL A 116 -9.653 27.869 -6.820 1.00 0.00 C ATOM 1749 CG1 VAL A 116 -8.400 28.431 -6.145 1.00 0.00 C ATOM 1750 CG2 VAL A 116 -10.448 27.042 -5.807 1.00 0.00 C ATOM 0 H VAL A 116 -11.360 27.403 -8.441 1.00 0.00 H new ATOM 0 HA VAL A 116 -10.974 29.581 -6.512 1.00 0.00 H new ATOM 0 HB VAL A 116 -9.361 27.237 -7.659 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -7.782 27.609 -5.782 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -7.833 29.021 -6.865 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -8.691 29.064 -5.306 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -9.831 26.221 -5.443 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -10.740 27.675 -4.969 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -11.341 26.640 -6.286 1.00 0.00 H new ATOM 1760 N SER A 117 -9.629 29.845 -9.433 1.00 0.00 N ATOM 1761 CA SER A 117 -8.821 30.774 -10.275 1.00 0.00 C ATOM 1762 C SER A 117 -9.731 31.552 -11.230 1.00 0.00 C ATOM 1763 O SER A 117 -10.627 31.000 -11.836 1.00 0.00 O ATOM 1764 CB SER A 117 -7.870 29.872 -11.060 1.00 0.00 C ATOM 1765 OG SER A 117 -6.563 29.980 -10.513 1.00 0.00 O ATOM 0 H SER A 117 -10.116 29.109 -9.944 1.00 0.00 H new ATOM 0 HA SER A 117 -8.285 31.511 -9.677 1.00 0.00 H new ATOM 0 HB2 SER A 117 -8.211 28.838 -11.015 1.00 0.00 H new ATOM 0 HB3 SER A 117 -7.862 30.160 -12.111 1.00 0.00 H new ATOM 0 HG SER A 117 -5.950 29.401 -11.013 1.00 0.00 H new ATOM 1771 N GLU A 118 -9.506 32.830 -11.370 1.00 0.00 N ATOM 1772 CA GLU A 118 -10.358 33.642 -12.287 1.00 0.00 C ATOM 1773 C GLU A 118 -9.479 34.504 -13.199 1.00 0.00 C ATOM 1774 O GLU A 118 -8.298 34.667 -12.966 1.00 0.00 O ATOM 1775 CB GLU A 118 -11.202 34.523 -11.367 1.00 0.00 C ATOM 1776 CG GLU A 118 -10.300 35.167 -10.313 1.00 0.00 C ATOM 1777 CD GLU A 118 -10.398 34.378 -9.007 1.00 0.00 C ATOM 1778 OE1 GLU A 118 -11.442 34.438 -8.379 1.00 0.00 O ATOM 1779 OE2 GLU A 118 -9.427 33.727 -8.657 1.00 0.00 O ATOM 0 H GLU A 118 -8.770 33.347 -10.890 1.00 0.00 H new ATOM 0 HA GLU A 118 -10.976 33.021 -12.935 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -11.709 35.294 -11.948 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -11.976 33.927 -10.884 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -9.268 35.184 -10.663 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -10.598 36.203 -10.148 1.00 0.00 H new ATOM 1786 N GLN A 119 -10.048 35.058 -14.234 1.00 0.00 N ATOM 1787 CA GLN A 119 -9.246 35.909 -15.160 1.00 0.00 C ATOM 1788 C GLN A 119 -10.164 36.854 -15.939 1.00 0.00 C ATOM 1789 O GLN A 119 -10.365 37.966 -15.479 1.00 0.00 O ATOM 1790 CB GLN A 119 -8.558 34.927 -16.108 1.00 0.00 C ATOM 1791 CG GLN A 119 -7.042 35.121 -16.032 1.00 0.00 C ATOM 1792 CD GLN A 119 -6.530 35.669 -17.365 1.00 0.00 C ATOM 1793 OE1 GLN A 119 -5.659 35.087 -17.980 1.00 0.00 O ATOM 1794 NE2 GLN A 119 -7.039 36.772 -17.840 1.00 0.00 N ATOM 1795 OXT GLN A 119 -10.652 36.448 -16.981 1.00 0.00 O ATOM 0 H GLN A 119 -11.033 34.959 -14.479 1.00 0.00 H new ATOM 0 HA GLN A 119 -8.527 36.532 -14.628 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -8.818 33.903 -15.840 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -8.905 35.087 -17.129 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -6.793 35.809 -15.224 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -6.554 34.173 -15.805 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -7.770 37.260 -17.323 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -6.706 37.146 -18.728 1.00 0.00 H new TER 1804 GLN A 119