USER MOD reduce.3.24.130724 H: found=0, std=0, add=1678, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1678 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 77 GLN :FLIP amide:sc= 0 F(o=-0.92,f=0) USER MOD Set 1.2: B 79 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: B 48 THR OG1 : rot -90:sc= 1.25 USER MOD Set 2.2: B 50 MET CE :methyl 153:sc= -0.144 (180deg=-0.81) USER MOD Set 3.1: A 51 ASN : amide:sc= 0 X(o=-0.33,f=-0.33) USER MOD Set 3.2: A 54 THR OG1 : rot 180:sc= -0.331 USER MOD Set 4.1: A 48 THR OG1 : rot -92:sc= 1.25 USER MOD Set 4.2: A 50 MET CE :methyl -173:sc= -0.531 (180deg=-0.579) USER MOD Set 5.1: A 8 LYS NZ :NH3+ -159:sc= 0.0641 (180deg=-0.757) USER MOD Set 5.2: B 29 GLN : amide:sc= -0.536 K(o=-0.47,f=-2) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0414 (180deg=-0.408) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN :FLIP amide:sc= -0.0119 F(o=-1.1,f=-0.012) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= 0.809 K(o=0.81,f=-6.3!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -3.18! C(o=-3.2!,f=-11!) USER MOD Single : A 29 GLN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 36 GLN :FLIP amide:sc= -0.981 F(o=-2.7!,f=-0.98) USER MOD Single : A 46 THR OG1 : rot 70:sc= 1.17 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0274 USER MOD Single : A 56 SER OG : rot 72:sc= 0.8 USER MOD Single : A 58 ASN : amide:sc= 2.01 K(o=2,f=-7.2!) USER MOD Single : A 60 GLN :FLIP amide:sc=-0.00422 F(o=-1.1,f=-0.0042) USER MOD Single : A 63 LYS NZ :NH3+ -110:sc= 0.881 (180deg=-0.188) USER MOD Single : A 64 SER OG : rot 66:sc= 1.24 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 TYR OH : rot 180:sc= -0.176 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.916 X(o=-0.92,f=-0.9) USER MOD Single : A 103 HIS : no HD1:sc= -0.0376 X(o=-0.038,f=-0.04) USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 105 HIS : no HD1:sc= -0.365 K(o=-0.37,f=-5.2!) USER MOD Single : A 106 HIS : no HD1:sc= -0.0671 X(o=-0.067,f=-0.067) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.137 X(o=-0.14,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 GLN : amide:sc= -0.48 K(o=-0.48,f=-1.6) USER MOD Single : B 5 SER OG : rot -9:sc= 1.13 USER MOD Single : B 8 LYS NZ :NH3+ 154:sc= -0.516 (180deg=-2.33!) USER MOD Single : B 14 GLN :FLIP amide:sc= -0.38 F(o=-1,f=-0.38) USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 ASN : amide:sc= -0.884 K(o=-0.88,f=-1.4) USER MOD Single : B 36 GLN : amide:sc= -0.76 X(o=-0.76,f=-0.97) USER MOD Single : B 46 THR OG1 : rot 91:sc= 1.24 USER MOD Single : B 51 ASN : amide:sc= 0.146 K(o=0.15,f=-3.2!) USER MOD Single : B 53 THR OG1 : rot 180:sc= 0.0192 USER MOD Single : B 54 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 SER OG : rot -79:sc= 1.17 USER MOD Single : B 58 ASN : amide:sc= 2.1 K(o=2.1,f=-6.4!) USER MOD Single : B 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 63 LYS NZ :NH3+ -130:sc= 0.99 (180deg=-0.0657) USER MOD Single : B 64 SER OG : rot 26:sc= 0.745 USER MOD Single : B 75 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 TYR OH : rot 180:sc= -0.125 USER MOD Single : B 94 GLN :FLIP amide:sc=-0.00665 F(o=-1.1,f=-0.0066) USER MOD Single : B 100 HIS : no HD1:sc= -0.303 X(o=-0.3,f=-0.56) USER MOD Single : B 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 104 HIS : no HE2:sc= 0.104 K(o=0.1,f=-3.1!) USER MOD Single : B 105 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.012) USER MOD Single : B 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 107 HIS : no HD1:sc= -0.267 X(o=-0.27,f=-0.27) USER MOD Single : B 108 HIS : no HD1:sc=-0.00618 X(o=-0.0062,f=-0.0062) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.249 3.649 -22.995 1.00 0.00 N ATOM 2 CA MET A 1 0.639 4.681 -23.872 1.00 0.00 C ATOM 3 C MET A 1 -0.600 5.277 -23.219 1.00 0.00 C ATOM 4 O MET A 1 -1.539 4.558 -22.873 1.00 0.00 O ATOM 5 CB MET A 1 0.258 4.089 -25.234 1.00 0.00 C ATOM 6 CG MET A 1 -0.455 5.080 -26.146 1.00 0.00 C ATOM 7 SD MET A 1 -0.949 4.357 -27.724 1.00 0.00 S ATOM 8 CE MET A 1 0.650 3.988 -28.446 1.00 0.00 C ATOM 0 H1 MET A 1 2.093 3.255 -23.458 1.00 0.00 H new ATOM 0 H2 MET A 1 1.521 4.080 -22.089 1.00 0.00 H new ATOM 0 H3 MET A 1 0.561 2.888 -22.823 1.00 0.00 H new ATOM 0 HA MET A 1 1.381 5.466 -24.021 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.160 3.732 -25.732 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.385 3.222 -25.078 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.339 5.464 -25.636 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.200 5.931 -26.332 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.534 3.806 -29.514 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.322 4.832 -28.293 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.068 3.101 -27.971 1.00 0.00 H new ATOM 20 N ALA A 2 -0.597 6.591 -23.060 1.00 0.00 N ATOM 21 CA ALA A 2 -1.725 7.303 -22.485 1.00 0.00 C ATOM 22 C ALA A 2 -1.894 8.652 -23.168 1.00 0.00 C ATOM 23 O ALA A 2 -0.938 9.418 -23.301 1.00 0.00 O ATOM 24 CB ALA A 2 -1.530 7.483 -20.987 1.00 0.00 C ATOM 0 H ALA A 2 0.184 7.191 -23.325 1.00 0.00 H new ATOM 0 HA ALA A 2 -2.630 6.716 -22.644 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -2.383 8.018 -20.571 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.447 6.506 -20.511 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.620 8.054 -20.805 1.00 0.00 H new ATOM 30 N GLY A 3 -3.107 8.929 -23.612 1.00 0.00 N ATOM 31 CA GLY A 3 -3.381 10.177 -24.289 1.00 0.00 C ATOM 32 C GLY A 3 -4.848 10.523 -24.221 1.00 0.00 C ATOM 33 O GLY A 3 -5.676 9.816 -24.803 1.00 0.00 O ATOM 0 H GLY A 3 -3.911 8.309 -23.515 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -2.795 10.976 -23.836 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -3.069 10.105 -25.331 1.00 0.00 H new ATOM 37 N GLN A 4 -5.167 11.596 -23.492 1.00 0.00 N ATOM 38 CA GLN A 4 -6.550 12.016 -23.237 1.00 0.00 C ATOM 39 C GLN A 4 -7.224 11.057 -22.257 1.00 0.00 C ATOM 40 O GLN A 4 -7.789 11.483 -21.252 1.00 0.00 O ATOM 41 CB GLN A 4 -7.357 12.134 -24.537 1.00 0.00 C ATOM 42 CG GLN A 4 -6.818 13.203 -25.474 1.00 0.00 C ATOM 43 CD GLN A 4 -7.565 13.271 -26.791 1.00 0.00 C ATOM 44 OE1 GLN A 4 -8.072 12.139 -27.251 1.00 0.00 O flip ATOM 45 NE2 GLN A 4 -7.670 14.335 -27.396 1.00 0.00 N flip ATOM 0 H GLN A 4 -4.470 12.202 -23.059 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.521 13.008 -22.787 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -7.352 11.172 -25.050 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -8.395 12.361 -24.295 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -6.875 14.173 -24.980 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -5.764 13.007 -25.671 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -7.264 15.186 -27.006 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -8.163 14.368 -28.288 1.00 0.00 H new ATOM 54 N SER A 5 -7.158 9.770 -22.553 1.00 0.00 N ATOM 55 CA SER A 5 -7.575 8.748 -21.615 1.00 0.00 C ATOM 56 C SER A 5 -6.331 8.095 -21.021 1.00 0.00 C ATOM 57 O SER A 5 -5.727 7.208 -21.627 1.00 0.00 O ATOM 58 CB SER A 5 -8.462 7.704 -22.307 1.00 0.00 C ATOM 59 OG SER A 5 -8.984 6.771 -21.375 1.00 0.00 O ATOM 0 H SER A 5 -6.816 9.409 -23.444 1.00 0.00 H new ATOM 0 HA SER A 5 -8.165 9.201 -20.818 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.282 8.205 -22.822 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.883 7.178 -23.066 1.00 0.00 H new ATOM 0 HG SER A 5 -9.546 6.119 -21.844 1.00 0.00 H new ATOM 65 N ASP A 6 -5.918 8.577 -19.857 1.00 0.00 N ATOM 66 CA ASP A 6 -4.724 8.062 -19.199 1.00 0.00 C ATOM 67 C ASP A 6 -5.056 6.804 -18.415 1.00 0.00 C ATOM 68 O ASP A 6 -5.327 6.857 -17.214 1.00 0.00 O ATOM 69 CB ASP A 6 -4.097 9.110 -18.274 1.00 0.00 C ATOM 70 CG ASP A 6 -3.404 10.227 -19.031 1.00 0.00 C ATOM 71 OD1 ASP A 6 -4.077 11.211 -19.400 1.00 0.00 O ATOM 72 OD2 ASP A 6 -2.177 10.134 -19.244 1.00 0.00 O ATOM 0 H ASP A 6 -6.392 9.324 -19.349 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.996 7.820 -19.973 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -4.873 9.536 -17.638 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -3.377 8.623 -17.616 1.00 0.00 H new ATOM 77 N ARG A 7 -5.046 5.674 -19.103 1.00 0.00 N ATOM 78 CA ARG A 7 -5.426 4.407 -18.497 1.00 0.00 C ATOM 79 C ARG A 7 -4.408 3.964 -17.453 1.00 0.00 C ATOM 80 O ARG A 7 -4.774 3.394 -16.423 1.00 0.00 O ATOM 81 CB ARG A 7 -5.596 3.331 -19.566 1.00 0.00 C ATOM 82 CG ARG A 7 -6.678 3.657 -20.582 1.00 0.00 C ATOM 83 CD ARG A 7 -6.991 2.460 -21.460 1.00 0.00 C ATOM 84 NE ARG A 7 -7.438 1.317 -20.663 1.00 0.00 N ATOM 85 CZ ARG A 7 -7.897 0.180 -21.175 1.00 0.00 C ATOM 86 NH1 ARG A 7 -7.991 0.021 -22.488 1.00 0.00 N ATOM 87 NH2 ARG A 7 -8.277 -0.797 -20.364 1.00 0.00 N ATOM 0 H ARG A 7 -4.778 5.608 -20.085 1.00 0.00 H new ATOM 0 HA ARG A 7 -6.381 4.553 -17.993 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -4.648 3.193 -20.087 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -5.835 2.384 -19.083 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -7.582 3.976 -20.063 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -6.356 4.492 -21.204 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -7.764 2.727 -22.181 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -6.104 2.183 -22.031 1.00 0.00 H new ATOM 0 HE ARG A 7 -7.394 1.399 -19.647 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -7.710 0.775 -23.114 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -8.345 -0.856 -22.872 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -8.216 -0.674 -19.353 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -8.630 -1.672 -20.751 1.00 0.00 H new ATOM 101 N LYS A 8 -3.134 4.230 -17.711 1.00 0.00 N ATOM 102 CA LYS A 8 -2.088 3.925 -16.744 1.00 0.00 C ATOM 103 C LYS A 8 -2.305 4.739 -15.471 1.00 0.00 C ATOM 104 O LYS A 8 -2.197 4.213 -14.366 1.00 0.00 O ATOM 105 CB LYS A 8 -0.689 4.183 -17.337 1.00 0.00 C ATOM 106 CG LYS A 8 -0.413 5.633 -17.716 1.00 0.00 C ATOM 107 CD LYS A 8 0.625 6.275 -16.801 1.00 0.00 C ATOM 108 CE LYS A 8 2.022 5.720 -17.050 1.00 0.00 C ATOM 109 NZ LYS A 8 3.057 6.426 -16.245 1.00 0.00 N ATOM 0 H LYS A 8 -2.801 4.654 -18.577 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.143 2.865 -16.494 1.00 0.00 H new ATOM 0 HB2 LYS A 8 0.061 3.862 -16.614 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.565 3.561 -18.223 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -0.064 5.678 -18.748 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -1.341 6.203 -17.668 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.630 7.354 -16.958 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.347 6.105 -15.761 1.00 0.00 H new ATOM 0 HE2 LYS A 8 2.038 4.657 -16.808 1.00 0.00 H new ATOM 0 HE3 LYS A 8 2.264 5.809 -18.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 3.991 6.286 -16.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 2.839 7.442 -16.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 3.065 6.044 -15.278 1.00 0.00 H new ATOM 123 N ALA A 9 -2.668 6.009 -15.636 1.00 0.00 N ATOM 124 CA ALA A 9 -2.924 6.884 -14.500 1.00 0.00 C ATOM 125 C ALA A 9 -4.141 6.403 -13.721 1.00 0.00 C ATOM 126 O ALA A 9 -4.195 6.520 -12.497 1.00 0.00 O ATOM 127 CB ALA A 9 -3.115 8.322 -14.964 1.00 0.00 C ATOM 0 H ALA A 9 -2.791 6.453 -16.546 1.00 0.00 H new ATOM 0 HA ALA A 9 -2.059 6.852 -13.838 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.305 8.960 -14.101 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.215 8.662 -15.476 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -3.962 8.374 -15.648 1.00 0.00 H new ATOM 133 N ALA A 10 -5.109 5.845 -14.440 1.00 0.00 N ATOM 134 CA ALA A 10 -6.285 5.261 -13.814 1.00 0.00 C ATOM 135 C ALA A 10 -5.895 4.036 -12.998 1.00 0.00 C ATOM 136 O ALA A 10 -6.469 3.772 -11.943 1.00 0.00 O ATOM 137 CB ALA A 10 -7.325 4.896 -14.862 1.00 0.00 C ATOM 0 H ALA A 10 -5.100 5.786 -15.458 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.723 6.000 -13.143 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -8.197 4.461 -14.373 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -7.624 5.792 -15.406 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.901 4.173 -15.559 1.00 0.00 H new ATOM 143 N LEU A 11 -4.895 3.302 -13.479 1.00 0.00 N ATOM 144 CA LEU A 11 -4.420 2.117 -12.780 1.00 0.00 C ATOM 145 C LEU A 11 -3.646 2.530 -11.538 1.00 0.00 C ATOM 146 O LEU A 11 -3.744 1.892 -10.492 1.00 0.00 O ATOM 147 CB LEU A 11 -3.543 1.255 -13.692 1.00 0.00 C ATOM 148 CG LEU A 11 -4.258 0.653 -14.903 1.00 0.00 C ATOM 149 CD1 LEU A 11 -3.273 -0.105 -15.777 1.00 0.00 C ATOM 150 CD2 LEU A 11 -5.389 -0.258 -14.453 1.00 0.00 C ATOM 0 H LEU A 11 -4.401 3.508 -14.347 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.283 1.520 -12.484 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.709 1.861 -14.047 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.118 0.444 -13.100 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.686 1.464 -15.493 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.797 -0.527 -16.634 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.497 0.576 -16.126 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.817 -0.909 -15.199 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -5.887 -0.678 -15.327 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.985 -1.066 -13.843 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.107 0.316 -13.867 1.00 0.00 H new ATOM 162 N LEU A 12 -2.891 3.617 -11.661 1.00 0.00 N ATOM 163 CA LEU A 12 -2.175 4.188 -10.528 1.00 0.00 C ATOM 164 C LEU A 12 -3.157 4.609 -9.441 1.00 0.00 C ATOM 165 O LEU A 12 -2.922 4.389 -8.257 1.00 0.00 O ATOM 166 CB LEU A 12 -1.338 5.393 -10.975 1.00 0.00 C ATOM 167 CG LEU A 12 -0.245 5.082 -12.001 1.00 0.00 C ATOM 168 CD1 LEU A 12 0.442 6.362 -12.450 1.00 0.00 C ATOM 169 CD2 LEU A 12 0.770 4.109 -11.420 1.00 0.00 C ATOM 0 H LEU A 12 -2.760 4.121 -12.538 1.00 0.00 H new ATOM 0 HA LEU A 12 -1.506 3.428 -10.124 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -2.007 6.144 -11.396 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.873 5.838 -10.096 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.710 4.617 -12.870 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.216 6.123 -13.179 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -0.291 7.028 -12.904 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.894 6.854 -11.589 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.540 3.899 -12.163 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.230 4.549 -10.535 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.268 3.181 -11.145 1.00 0.00 H new ATOM 181 N ASP A 13 -4.274 5.196 -9.855 1.00 0.00 N ATOM 182 CA ASP A 13 -5.307 5.622 -8.917 1.00 0.00 C ATOM 183 C ASP A 13 -5.948 4.413 -8.239 1.00 0.00 C ATOM 184 O ASP A 13 -6.353 4.477 -7.076 1.00 0.00 O ATOM 185 CB ASP A 13 -6.370 6.450 -9.635 1.00 0.00 C ATOM 186 CG ASP A 13 -7.370 7.055 -8.674 1.00 0.00 C ATOM 187 OD1 ASP A 13 -7.037 8.072 -8.025 1.00 0.00 O ATOM 188 OD2 ASP A 13 -8.493 6.522 -8.556 1.00 0.00 O ATOM 0 H ASP A 13 -4.488 5.388 -10.834 1.00 0.00 H new ATOM 0 HA ASP A 13 -4.840 6.241 -8.151 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -5.887 7.246 -10.202 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -6.895 5.820 -10.353 1.00 0.00 H new ATOM 193 N GLN A 14 -6.026 3.308 -8.971 1.00 0.00 N ATOM 194 CA GLN A 14 -6.525 2.057 -8.412 1.00 0.00 C ATOM 195 C GLN A 14 -5.540 1.506 -7.390 1.00 0.00 C ATOM 196 O GLN A 14 -5.938 1.003 -6.338 1.00 0.00 O ATOM 197 CB GLN A 14 -6.782 1.032 -9.519 1.00 0.00 C ATOM 198 CG GLN A 14 -7.900 1.434 -10.463 1.00 0.00 C ATOM 199 CD GLN A 14 -9.205 1.687 -9.736 1.00 0.00 C ATOM 200 OE1 GLN A 14 -9.484 1.072 -8.708 1.00 0.00 O ATOM 201 NE2 GLN A 14 -10.004 2.602 -10.256 1.00 0.00 N ATOM 0 H GLN A 14 -5.751 3.253 -9.952 1.00 0.00 H new ATOM 0 HA GLN A 14 -7.472 2.257 -7.910 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -5.866 0.889 -10.092 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -7.027 0.072 -9.065 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -7.609 2.334 -11.005 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -8.046 0.648 -11.204 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -9.734 3.089 -11.111 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -10.891 2.822 -9.803 1.00 0.00 H new ATOM 210 N VAL A 15 -4.253 1.622 -7.704 1.00 0.00 N ATOM 211 CA VAL A 15 -3.192 1.275 -6.765 1.00 0.00 C ATOM 212 C VAL A 15 -3.321 2.123 -5.503 1.00 0.00 C ATOM 213 O VAL A 15 -3.187 1.623 -4.385 1.00 0.00 O ATOM 214 CB VAL A 15 -1.791 1.479 -7.392 1.00 0.00 C ATOM 215 CG1 VAL A 15 -0.693 1.292 -6.357 1.00 0.00 C ATOM 216 CG2 VAL A 15 -1.583 0.528 -8.562 1.00 0.00 C ATOM 0 H VAL A 15 -3.919 1.956 -8.608 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.298 0.220 -6.512 1.00 0.00 H new ATOM 0 HB VAL A 15 -1.737 2.503 -7.761 1.00 0.00 H new ATOM 0 HG11 VAL A 15 0.279 1.441 -6.827 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -0.823 2.017 -5.554 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -0.747 0.283 -5.948 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.593 0.687 -8.989 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -1.667 -0.501 -8.213 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -2.340 0.716 -9.323 1.00 0.00 H new ATOM 226 N ALA A 16 -3.605 3.407 -5.700 1.00 0.00 N ATOM 227 CA ALA A 16 -3.815 4.331 -4.595 1.00 0.00 C ATOM 228 C ALA A 16 -4.972 3.877 -3.713 1.00 0.00 C ATOM 229 O ALA A 16 -4.894 3.971 -2.494 1.00 0.00 O ATOM 230 CB ALA A 16 -4.069 5.737 -5.118 1.00 0.00 C ATOM 0 H ALA A 16 -3.695 3.832 -6.623 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.910 4.341 -3.988 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -4.224 6.415 -4.279 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.209 6.070 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.956 5.735 -5.751 1.00 0.00 H new ATOM 236 N ARG A 17 -6.042 3.380 -4.331 1.00 0.00 N ATOM 237 CA ARG A 17 -7.202 2.897 -3.580 1.00 0.00 C ATOM 238 C ARG A 17 -6.799 1.775 -2.628 1.00 0.00 C ATOM 239 O ARG A 17 -7.208 1.756 -1.464 1.00 0.00 O ATOM 240 CB ARG A 17 -8.312 2.422 -4.528 1.00 0.00 C ATOM 241 CG ARG A 17 -9.481 1.758 -3.810 1.00 0.00 C ATOM 242 CD ARG A 17 -10.692 1.576 -4.715 1.00 0.00 C ATOM 243 NE ARG A 17 -10.396 0.798 -5.918 1.00 0.00 N ATOM 244 CZ ARG A 17 -11.009 -0.346 -6.237 1.00 0.00 C ATOM 245 NH1 ARG A 17 -11.878 -0.900 -5.401 1.00 0.00 N ATOM 246 NH2 ARG A 17 -10.744 -0.939 -7.392 1.00 0.00 N ATOM 0 H ARG A 17 -6.131 3.301 -5.344 1.00 0.00 H new ATOM 0 HA ARG A 17 -7.590 3.728 -2.991 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.682 3.275 -5.097 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -7.890 1.719 -5.246 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -9.166 0.786 -3.430 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -9.763 2.361 -2.947 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -11.486 1.081 -4.155 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -11.071 2.556 -5.007 1.00 0.00 H new ATOM 0 HE ARG A 17 -9.678 1.150 -6.552 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -12.082 -0.453 -4.507 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.342 -1.773 -5.652 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -10.073 -0.522 -8.037 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -11.211 -1.812 -7.636 1.00 0.00 H new ATOM 260 N VAL A 18 -5.978 0.857 -3.121 1.00 0.00 N ATOM 261 CA VAL A 18 -5.481 -0.243 -2.306 1.00 0.00 C ATOM 262 C VAL A 18 -4.536 0.285 -1.230 1.00 0.00 C ATOM 263 O VAL A 18 -4.601 -0.125 -0.068 1.00 0.00 O ATOM 264 CB VAL A 18 -4.746 -1.297 -3.169 1.00 0.00 C ATOM 265 CG1 VAL A 18 -4.296 -2.480 -2.323 1.00 0.00 C ATOM 266 CG2 VAL A 18 -5.635 -1.763 -4.316 1.00 0.00 C ATOM 0 H VAL A 18 -5.642 0.853 -4.084 1.00 0.00 H new ATOM 0 HA VAL A 18 -6.340 -0.722 -1.836 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.856 -0.828 -3.590 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -3.783 -3.205 -2.955 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -3.617 -2.133 -1.544 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -5.165 -2.950 -1.864 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.102 -2.504 -4.912 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.545 -2.208 -3.913 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -5.895 -0.911 -4.944 1.00 0.00 H new ATOM 276 N GLY A 19 -3.676 1.219 -1.622 1.00 0.00 N ATOM 277 CA GLY A 19 -2.745 1.822 -0.690 1.00 0.00 C ATOM 278 C GLY A 19 -3.444 2.574 0.427 1.00 0.00 C ATOM 279 O GLY A 19 -3.035 2.492 1.582 1.00 0.00 O ATOM 0 H GLY A 19 -3.608 1.571 -2.577 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -2.112 1.045 -0.260 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -2.089 2.506 -1.228 1.00 0.00 H new ATOM 283 N LYS A 20 -4.503 3.300 0.081 1.00 0.00 N ATOM 284 CA LYS A 20 -5.278 4.055 1.062 1.00 0.00 C ATOM 285 C LYS A 20 -5.890 3.127 2.100 1.00 0.00 C ATOM 286 O LYS A 20 -5.863 3.421 3.292 1.00 0.00 O ATOM 287 CB LYS A 20 -6.385 4.862 0.375 1.00 0.00 C ATOM 288 CG LYS A 20 -5.868 5.986 -0.509 1.00 0.00 C ATOM 289 CD LYS A 20 -7.006 6.713 -1.208 1.00 0.00 C ATOM 290 CE LYS A 20 -6.491 7.827 -2.106 1.00 0.00 C ATOM 291 NZ LYS A 20 -7.600 8.604 -2.723 1.00 0.00 N ATOM 0 H LYS A 20 -4.846 3.382 -0.876 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.597 4.743 1.563 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -6.992 4.187 -0.229 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -7.040 5.284 1.137 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.300 6.693 0.095 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.183 5.579 -1.253 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.582 6.003 -1.802 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.684 7.129 -0.463 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.858 8.498 -1.525 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.867 7.400 -2.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.205 9.353 -3.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.190 7.970 -3.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.181 9.033 -1.975 1.00 0.00 H new ATOM 305 N ALA A 21 -6.425 2.000 1.641 1.00 0.00 N ATOM 306 CA ALA A 21 -7.036 1.025 2.535 1.00 0.00 C ATOM 307 C ALA A 21 -5.982 0.352 3.409 1.00 0.00 C ATOM 308 O ALA A 21 -6.251 -0.039 4.545 1.00 0.00 O ATOM 309 CB ALA A 21 -7.816 -0.008 1.739 1.00 0.00 C ATOM 0 H ALA A 21 -6.447 1.740 0.655 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.730 1.550 3.191 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.266 -0.729 2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.600 0.489 1.167 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -7.142 -0.526 1.057 1.00 0.00 H new ATOM 315 N LEU A 22 -4.772 0.232 2.878 1.00 0.00 N ATOM 316 CA LEU A 22 -3.654 -0.313 3.636 1.00 0.00 C ATOM 317 C LEU A 22 -3.108 0.748 4.594 1.00 0.00 C ATOM 318 O LEU A 22 -2.364 0.451 5.526 1.00 0.00 O ATOM 319 CB LEU A 22 -2.553 -0.793 2.683 1.00 0.00 C ATOM 320 CG LEU A 22 -1.415 -1.577 3.341 1.00 0.00 C ATOM 321 CD1 LEU A 22 -1.930 -2.884 3.925 1.00 0.00 C ATOM 322 CD2 LEU A 22 -0.302 -1.841 2.341 1.00 0.00 C ATOM 0 H LEU A 22 -4.540 0.506 1.923 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.001 -1.166 4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.007 -1.419 1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.129 0.075 2.177 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.011 -0.975 4.155 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.105 -3.426 4.388 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.691 -2.672 4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -2.363 -3.492 3.131 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.498 -2.399 2.826 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.694 -2.421 1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.089 -0.892 1.973 1.00 0.00 H new ATOM 334 N ALA A 23 -3.502 1.992 4.359 1.00 0.00 N ATOM 335 CA ALA A 23 -3.103 3.109 5.203 1.00 0.00 C ATOM 336 C ALA A 23 -4.208 3.438 6.200 1.00 0.00 C ATOM 337 O ALA A 23 -4.272 4.544 6.741 1.00 0.00 O ATOM 338 CB ALA A 23 -2.781 4.321 4.343 1.00 0.00 C ATOM 0 H ALA A 23 -4.106 2.255 3.580 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.209 2.830 5.761 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.483 5.152 4.982 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -1.966 4.077 3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.663 4.603 3.768 1.00 0.00 H new ATOM 344 N ASN A 24 -5.073 2.463 6.443 1.00 0.00 N ATOM 345 CA ASN A 24 -6.201 2.634 7.357 1.00 0.00 C ATOM 346 C ASN A 24 -5.779 2.492 8.819 1.00 0.00 C ATOM 347 O ASN A 24 -6.603 2.616 9.727 1.00 0.00 O ATOM 348 CB ASN A 24 -7.307 1.633 7.020 1.00 0.00 C ATOM 349 CG ASN A 24 -8.286 2.154 5.980 1.00 0.00 C ATOM 350 OD1 ASN A 24 -9.434 1.723 5.929 1.00 0.00 O ATOM 351 ND2 ASN A 24 -7.857 3.095 5.154 1.00 0.00 N ATOM 0 H ASN A 24 -5.017 1.538 6.018 1.00 0.00 H new ATOM 0 HA ASN A 24 -6.581 3.647 7.227 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -6.855 0.711 6.655 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.852 1.383 7.930 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -8.486 3.482 4.451 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -6.897 3.433 5.221 1.00 0.00 H new ATOM 358 N GLY A 25 -4.497 2.219 9.031 1.00 0.00 N ATOM 359 CA GLY A 25 -3.930 2.204 10.370 1.00 0.00 C ATOM 360 C GLY A 25 -4.541 1.161 11.283 1.00 0.00 C ATOM 361 O GLY A 25 -4.148 -0.003 11.261 1.00 0.00 O ATOM 0 H GLY A 25 -3.831 2.005 8.289 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -2.857 2.026 10.298 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -4.060 3.188 10.820 1.00 0.00 H new ATOM 365 N ARG A 26 -5.520 1.581 12.078 1.00 0.00 N ATOM 366 CA ARG A 26 -6.143 0.714 13.074 1.00 0.00 C ATOM 367 C ARG A 26 -6.894 -0.440 12.415 1.00 0.00 C ATOM 368 O ARG A 26 -7.012 -1.523 12.988 1.00 0.00 O ATOM 369 CB ARG A 26 -7.103 1.517 13.955 1.00 0.00 C ATOM 370 CG ARG A 26 -6.430 2.637 14.727 1.00 0.00 C ATOM 371 CD ARG A 26 -7.417 3.378 15.614 1.00 0.00 C ATOM 372 NE ARG A 26 -8.017 2.502 16.618 1.00 0.00 N ATOM 373 CZ ARG A 26 -8.124 2.811 17.908 1.00 0.00 C ATOM 374 NH1 ARG A 26 -7.678 3.979 18.356 1.00 0.00 N ATOM 375 NH2 ARG A 26 -8.685 1.954 18.747 1.00 0.00 N ATOM 0 H ARG A 26 -5.903 2.526 12.051 1.00 0.00 H new ATOM 0 HA ARG A 26 -5.348 0.298 13.692 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -7.889 1.940 13.329 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -7.587 0.841 14.660 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -5.627 2.226 15.339 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -5.972 3.337 14.028 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -6.908 4.204 16.111 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -8.203 3.813 14.997 1.00 0.00 H new ATOM 0 HE ARG A 26 -8.376 1.598 16.311 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -7.251 4.644 17.710 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -7.762 4.211 19.346 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.034 1.059 18.404 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -8.768 2.189 19.736 1.00 0.00 H new ATOM 389 N ARG A 27 -7.383 -0.212 11.203 1.00 0.00 N ATOM 390 CA ARG A 27 -8.137 -1.233 10.486 1.00 0.00 C ATOM 391 C ARG A 27 -7.224 -2.362 10.021 1.00 0.00 C ATOM 392 O ARG A 27 -7.695 -3.441 9.664 1.00 0.00 O ATOM 393 CB ARG A 27 -8.880 -0.624 9.298 1.00 0.00 C ATOM 394 CG ARG A 27 -9.932 0.395 9.703 1.00 0.00 C ATOM 395 CD ARG A 27 -10.683 0.930 8.496 1.00 0.00 C ATOM 396 NE ARG A 27 -11.685 1.928 8.869 1.00 0.00 N ATOM 397 CZ ARG A 27 -12.077 2.932 8.079 1.00 0.00 C ATOM 398 NH1 ARG A 27 -11.532 3.094 6.882 1.00 0.00 N ATOM 399 NH2 ARG A 27 -13.015 3.780 8.488 1.00 0.00 N ATOM 0 H ARG A 27 -7.272 0.667 10.697 1.00 0.00 H new ATOM 0 HA ARG A 27 -8.871 -1.651 11.175 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -8.159 -0.147 8.634 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -9.358 -1.422 8.730 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -10.636 -0.064 10.397 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -9.456 1.221 10.232 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -9.975 1.373 7.796 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -11.170 0.104 7.977 1.00 0.00 H new ATOM 0 HE ARG A 27 -12.112 1.853 9.792 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -10.809 2.451 6.559 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -11.835 3.862 6.283 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -13.439 3.666 9.409 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -13.311 4.545 7.881 1.00 0.00 H new ATOM 413 N LEU A 28 -5.915 -2.121 10.053 1.00 0.00 N ATOM 414 CA LEU A 28 -4.946 -3.148 9.693 1.00 0.00 C ATOM 415 C LEU A 28 -4.918 -4.238 10.758 1.00 0.00 C ATOM 416 O LEU A 28 -4.474 -5.357 10.503 1.00 0.00 O ATOM 417 CB LEU A 28 -3.546 -2.551 9.526 1.00 0.00 C ATOM 418 CG LEU A 28 -3.405 -1.500 8.426 1.00 0.00 C ATOM 419 CD1 LEU A 28 -1.966 -1.022 8.338 1.00 0.00 C ATOM 420 CD2 LEU A 28 -3.859 -2.059 7.088 1.00 0.00 C ATOM 0 H LEU A 28 -5.505 -1.227 10.323 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.251 -3.580 8.740 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.246 -2.103 10.473 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.847 -3.362 9.321 1.00 0.00 H new ATOM 0 HG LEU A 28 -4.042 -0.652 8.676 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.879 -0.273 7.551 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.670 -0.583 9.291 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.315 -1.866 8.110 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.750 -1.295 6.319 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.248 -2.924 6.829 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -4.904 -2.360 7.155 1.00 0.00 H new ATOM 432 N GLN A 29 -5.399 -3.902 11.955 1.00 0.00 N ATOM 433 CA GLN A 29 -5.490 -4.866 13.044 1.00 0.00 C ATOM 434 C GLN A 29 -6.443 -5.989 12.655 1.00 0.00 C ATOM 435 O GLN A 29 -6.235 -7.153 13.001 1.00 0.00 O ATOM 436 CB GLN A 29 -5.978 -4.188 14.328 1.00 0.00 C ATOM 437 CG GLN A 29 -5.798 -5.044 15.571 1.00 0.00 C ATOM 438 CD GLN A 29 -6.292 -4.362 16.832 1.00 0.00 C ATOM 439 OE1 GLN A 29 -7.318 -3.531 16.703 1.00 0.00 O flip ATOM 440 NE2 GLN A 29 -5.760 -4.584 17.919 1.00 0.00 N flip ATOM 0 H GLN A 29 -5.731 -2.967 12.192 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.498 -5.279 13.229 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.439 -3.250 14.461 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.033 -3.937 14.219 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.333 -5.985 15.439 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.743 -5.291 15.687 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.973 -5.230 17.979 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.106 -4.122 18.760 1.00 0.00 H new ATOM 449 N ILE A 30 -7.485 -5.624 11.917 1.00 0.00 N ATOM 450 CA ILE A 30 -8.449 -6.590 11.424 1.00 0.00 C ATOM 451 C ILE A 30 -7.788 -7.496 10.392 1.00 0.00 C ATOM 452 O ILE A 30 -7.991 -8.706 10.393 1.00 0.00 O ATOM 453 CB ILE A 30 -9.679 -5.891 10.801 1.00 0.00 C ATOM 454 CG1 ILE A 30 -10.297 -4.910 11.806 1.00 0.00 C ATOM 455 CG2 ILE A 30 -10.708 -6.923 10.355 1.00 0.00 C ATOM 456 CD1 ILE A 30 -11.454 -4.109 11.247 1.00 0.00 C ATOM 0 H ILE A 30 -7.681 -4.660 11.648 1.00 0.00 H new ATOM 0 HA ILE A 30 -8.794 -7.187 12.268 1.00 0.00 H new ATOM 0 HB ILE A 30 -9.356 -5.330 9.924 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -10.640 -5.466 12.678 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -9.524 -4.223 12.150 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -11.568 -6.415 9.919 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.262 -7.584 9.612 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.031 -7.510 11.215 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -11.838 -3.439 12.016 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -11.113 -3.524 10.393 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -12.246 -4.787 10.929 1.00 0.00 H new ATOM 468 N LEU A 31 -6.963 -6.902 9.537 1.00 0.00 N ATOM 469 CA LEU A 31 -6.236 -7.654 8.520 1.00 0.00 C ATOM 470 C LEU A 31 -5.257 -8.631 9.161 1.00 0.00 C ATOM 471 O LEU A 31 -5.074 -9.743 8.669 1.00 0.00 O ATOM 472 CB LEU A 31 -5.489 -6.709 7.576 1.00 0.00 C ATOM 473 CG LEU A 31 -6.376 -5.874 6.652 1.00 0.00 C ATOM 474 CD1 LEU A 31 -5.533 -4.924 5.818 1.00 0.00 C ATOM 475 CD2 LEU A 31 -7.201 -6.779 5.749 1.00 0.00 C ATOM 0 H LEU A 31 -6.780 -5.899 9.528 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.965 -8.222 7.942 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.877 -6.033 8.174 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.807 -7.298 6.963 1.00 0.00 H new ATOM 0 HG LEU A 31 -7.054 -5.284 7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -6.182 -4.338 5.167 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.980 -4.254 6.477 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.832 -5.497 5.211 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.827 -6.170 5.097 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.535 -7.393 5.142 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.833 -7.424 6.360 1.00 0.00 H new ATOM 487 N ASP A 32 -4.636 -8.211 10.257 1.00 0.00 N ATOM 488 CA ASP A 32 -3.706 -9.068 10.993 1.00 0.00 C ATOM 489 C ASP A 32 -4.431 -10.310 11.507 1.00 0.00 C ATOM 490 O ASP A 32 -3.897 -11.418 11.465 1.00 0.00 O ATOM 491 CB ASP A 32 -3.078 -8.288 12.157 1.00 0.00 C ATOM 492 CG ASP A 32 -2.061 -9.094 12.944 1.00 0.00 C ATOM 493 OD1 ASP A 32 -0.928 -9.284 12.453 1.00 0.00 O ATOM 494 OD2 ASP A 32 -2.381 -9.524 14.072 1.00 0.00 O ATOM 0 H ASP A 32 -4.758 -7.281 10.658 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.909 -9.387 10.321 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -2.596 -7.392 11.766 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -3.868 -7.957 12.831 1.00 0.00 H new ATOM 499 N LEU A 33 -5.666 -10.117 11.955 1.00 0.00 N ATOM 500 CA LEU A 33 -6.500 -11.217 12.424 1.00 0.00 C ATOM 501 C LEU A 33 -7.013 -12.047 11.247 1.00 0.00 C ATOM 502 O LEU A 33 -7.086 -13.273 11.323 1.00 0.00 O ATOM 503 CB LEU A 33 -7.683 -10.675 13.237 1.00 0.00 C ATOM 504 CG LEU A 33 -8.657 -11.731 13.772 1.00 0.00 C ATOM 505 CD1 LEU A 33 -7.965 -12.646 14.770 1.00 0.00 C ATOM 506 CD2 LEU A 33 -9.865 -11.061 14.408 1.00 0.00 C ATOM 0 H LEU A 33 -6.114 -9.202 12.003 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.893 -11.859 13.062 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.291 -10.107 14.081 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.240 -9.976 12.613 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.999 -12.340 12.935 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.675 -13.387 15.137 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.131 -13.152 14.283 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -7.592 -12.056 15.607 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.548 -11.823 14.783 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.538 -10.429 15.233 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.376 -10.450 13.664 1.00 0.00 H new ATOM 518 N LEU A 34 -7.353 -11.375 10.152 1.00 0.00 N ATOM 519 CA LEU A 34 -7.876 -12.053 8.968 1.00 0.00 C ATOM 520 C LEU A 34 -6.777 -12.822 8.242 1.00 0.00 C ATOM 521 O LEU A 34 -7.058 -13.710 7.436 1.00 0.00 O ATOM 522 CB LEU A 34 -8.534 -11.050 8.013 1.00 0.00 C ATOM 523 CG LEU A 34 -9.765 -10.332 8.570 1.00 0.00 C ATOM 524 CD1 LEU A 34 -10.369 -9.414 7.520 1.00 0.00 C ATOM 525 CD2 LEU A 34 -10.794 -11.336 9.061 1.00 0.00 C ATOM 0 H LEU A 34 -7.276 -10.362 10.058 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.630 -12.766 9.303 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -7.793 -10.302 7.731 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -8.820 -11.575 7.102 1.00 0.00 H new ATOM 0 HG LEU A 34 -9.452 -9.722 9.418 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.243 -8.912 7.935 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -9.632 -8.669 7.220 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -10.666 -10.001 6.651 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.662 -10.805 9.453 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -11.103 -11.975 8.234 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -10.357 -11.949 9.849 1.00 0.00 H new ATOM 537 N ALA A 35 -5.527 -12.475 8.526 1.00 0.00 N ATOM 538 CA ALA A 35 -4.390 -13.200 7.978 1.00 0.00 C ATOM 539 C ALA A 35 -4.269 -14.563 8.645 1.00 0.00 C ATOM 540 O ALA A 35 -3.621 -15.471 8.124 1.00 0.00 O ATOM 541 CB ALA A 35 -3.110 -12.400 8.160 1.00 0.00 C ATOM 0 H ALA A 35 -5.276 -11.695 9.133 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.550 -13.347 6.910 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -2.270 -12.957 7.745 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -3.202 -11.444 7.644 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -2.939 -12.224 9.222 1.00 0.00 H new ATOM 547 N GLN A 36 -4.895 -14.691 9.808 1.00 0.00 N ATOM 548 CA GLN A 36 -4.957 -15.957 10.519 1.00 0.00 C ATOM 549 C GLN A 36 -6.048 -16.832 9.907 1.00 0.00 C ATOM 550 O GLN A 36 -5.874 -18.044 9.742 1.00 0.00 O ATOM 551 CB GLN A 36 -5.221 -15.696 12.014 1.00 0.00 C ATOM 552 CG GLN A 36 -5.394 -16.943 12.875 1.00 0.00 C ATOM 553 CD GLN A 36 -6.809 -17.497 12.862 1.00 0.00 C ATOM 554 OE1 GLN A 36 -7.794 -16.625 12.693 1.00 0.00 O flip ATOM 555 NE2 GLN A 36 -7.015 -18.700 13.003 1.00 0.00 N flip ATOM 0 H GLN A 36 -5.371 -13.923 10.281 1.00 0.00 H new ATOM 0 HA GLN A 36 -4.007 -16.484 10.428 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -4.394 -15.110 12.415 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.119 -15.084 12.106 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -4.707 -17.714 12.526 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -5.114 -16.708 13.902 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -6.231 -19.340 13.131 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -7.970 -19.059 12.992 1.00 0.00 H new ATOM 564 N GLY A 37 -7.161 -16.201 9.560 1.00 0.00 N ATOM 565 CA GLY A 37 -8.281 -16.908 8.979 1.00 0.00 C ATOM 566 C GLY A 37 -9.527 -16.048 8.946 1.00 0.00 C ATOM 567 O GLY A 37 -9.506 -14.907 9.412 1.00 0.00 O ATOM 0 H GLY A 37 -7.307 -15.198 9.673 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -8.028 -17.222 7.966 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.478 -17.813 9.553 1.00 0.00 H new ATOM 571 N GLU A 38 -10.607 -16.589 8.406 1.00 0.00 N ATOM 572 CA GLU A 38 -11.863 -15.860 8.314 1.00 0.00 C ATOM 573 C GLU A 38 -12.646 -15.972 9.617 1.00 0.00 C ATOM 574 O GLU A 38 -12.577 -16.991 10.311 1.00 0.00 O ATOM 575 CB GLU A 38 -12.717 -16.375 7.144 1.00 0.00 C ATOM 576 CG GLU A 38 -13.086 -17.851 7.228 1.00 0.00 C ATOM 577 CD GLU A 38 -11.989 -18.773 6.732 1.00 0.00 C ATOM 578 OE1 GLU A 38 -11.060 -19.072 7.511 1.00 0.00 O ATOM 579 OE2 GLU A 38 -12.056 -19.202 5.562 1.00 0.00 O ATOM 0 H GLU A 38 -10.640 -17.534 8.023 1.00 0.00 H new ATOM 0 HA GLU A 38 -11.626 -14.812 8.133 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -13.634 -15.787 7.095 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.177 -16.202 6.213 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.321 -18.101 8.263 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.990 -18.026 6.644 1.00 0.00 H new ATOM 586 N ARG A 39 -13.372 -14.917 9.948 1.00 0.00 N ATOM 587 CA ARG A 39 -14.221 -14.901 11.132 1.00 0.00 C ATOM 588 C ARG A 39 -15.469 -14.069 10.867 1.00 0.00 C ATOM 589 O ARG A 39 -15.520 -13.302 9.904 1.00 0.00 O ATOM 590 CB ARG A 39 -13.478 -14.328 12.347 1.00 0.00 C ATOM 591 CG ARG A 39 -12.398 -15.238 12.919 1.00 0.00 C ATOM 592 CD ARG A 39 -11.853 -14.683 14.226 1.00 0.00 C ATOM 593 NE ARG A 39 -10.878 -15.575 14.861 1.00 0.00 N ATOM 594 CZ ARG A 39 -11.077 -16.159 16.043 1.00 0.00 C ATOM 595 NH1 ARG A 39 -12.256 -16.056 16.642 1.00 0.00 N ATOM 596 NH2 ARG A 39 -10.112 -16.873 16.612 1.00 0.00 N ATOM 0 H ARG A 39 -13.391 -14.052 9.409 1.00 0.00 H new ATOM 0 HA ARG A 39 -14.501 -15.931 11.353 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -13.022 -13.379 12.063 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -14.204 -14.111 13.131 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -12.808 -16.234 13.086 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -11.587 -15.343 12.198 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -11.385 -13.717 14.038 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -12.680 -14.508 14.914 1.00 0.00 H new ATOM 0 HE ARG A 39 -10.001 -15.758 14.373 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -13.009 -15.530 16.198 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -12.409 -16.502 17.546 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -9.211 -16.977 16.144 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -10.272 -17.317 17.516 1.00 0.00 H new ATOM 610 N ALA A 40 -16.469 -14.219 11.721 1.00 0.00 N ATOM 611 CA ALA A 40 -17.691 -13.441 11.601 1.00 0.00 C ATOM 612 C ALA A 40 -17.476 -12.035 12.147 1.00 0.00 C ATOM 613 O ALA A 40 -16.648 -11.831 13.039 1.00 0.00 O ATOM 614 CB ALA A 40 -18.838 -14.125 12.330 1.00 0.00 C ATOM 0 H ALA A 40 -16.458 -14.872 12.504 1.00 0.00 H new ATOM 0 HA ALA A 40 -17.953 -13.370 10.545 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -19.743 -13.526 12.228 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -19.006 -15.112 11.899 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -18.588 -14.227 13.386 1.00 0.00 H new ATOM 620 N VAL A 41 -18.227 -11.078 11.609 1.00 0.00 N ATOM 621 CA VAL A 41 -18.132 -9.677 12.028 1.00 0.00 C ATOM 622 C VAL A 41 -18.222 -9.538 13.546 1.00 0.00 C ATOM 623 O VAL A 41 -17.474 -8.775 14.153 1.00 0.00 O ATOM 624 CB VAL A 41 -19.245 -8.822 11.383 1.00 0.00 C ATOM 625 CG1 VAL A 41 -19.106 -7.358 11.778 1.00 0.00 C ATOM 626 CG2 VAL A 41 -19.224 -8.969 9.871 1.00 0.00 C ATOM 0 H VAL A 41 -18.915 -11.247 10.875 1.00 0.00 H new ATOM 0 HA VAL A 41 -17.159 -9.318 11.693 1.00 0.00 H new ATOM 0 HB VAL A 41 -20.204 -9.184 11.753 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -19.902 -6.778 11.311 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -19.178 -7.265 12.862 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -18.139 -6.982 11.445 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -20.015 -8.359 9.435 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -18.259 -8.640 9.487 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -19.383 -10.014 9.605 1.00 0.00 H new ATOM 636 N GLU A 42 -19.130 -10.297 14.148 1.00 0.00 N ATOM 637 CA GLU A 42 -19.355 -10.241 15.588 1.00 0.00 C ATOM 638 C GLU A 42 -18.083 -10.590 16.357 1.00 0.00 C ATOM 639 O GLU A 42 -17.709 -9.898 17.306 1.00 0.00 O ATOM 640 CB GLU A 42 -20.482 -11.197 15.978 1.00 0.00 C ATOM 641 CG GLU A 42 -20.886 -11.100 17.440 1.00 0.00 C ATOM 642 CD GLU A 42 -21.975 -12.080 17.810 1.00 0.00 C ATOM 643 OE1 GLU A 42 -23.147 -11.829 17.472 1.00 0.00 O ATOM 644 OE2 GLU A 42 -21.659 -13.110 18.442 1.00 0.00 O ATOM 0 H GLU A 42 -19.726 -10.963 13.657 1.00 0.00 H new ATOM 0 HA GLU A 42 -19.641 -9.222 15.849 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -21.353 -10.992 15.355 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -20.170 -12.219 15.763 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -20.013 -11.280 18.067 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -21.227 -10.087 17.652 1.00 0.00 H new ATOM 651 N ALA A 43 -17.413 -11.654 15.933 1.00 0.00 N ATOM 652 CA ALA A 43 -16.197 -12.101 16.595 1.00 0.00 C ATOM 653 C ALA A 43 -15.074 -11.094 16.396 1.00 0.00 C ATOM 654 O ALA A 43 -14.322 -10.800 17.325 1.00 0.00 O ATOM 655 CB ALA A 43 -15.782 -13.470 16.080 1.00 0.00 C ATOM 0 H ALA A 43 -17.692 -12.223 15.134 1.00 0.00 H new ATOM 0 HA ALA A 43 -16.399 -12.180 17.663 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -14.871 -13.788 16.586 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -16.577 -14.189 16.277 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -15.601 -13.415 15.007 1.00 0.00 H new ATOM 661 N ILE A 44 -14.974 -10.562 15.181 1.00 0.00 N ATOM 662 CA ILE A 44 -13.956 -9.569 14.860 1.00 0.00 C ATOM 663 C ILE A 44 -14.167 -8.304 15.684 1.00 0.00 C ATOM 664 O ILE A 44 -13.228 -7.778 16.285 1.00 0.00 O ATOM 665 CB ILE A 44 -13.969 -9.207 13.357 1.00 0.00 C ATOM 666 CG1 ILE A 44 -13.736 -10.457 12.504 1.00 0.00 C ATOM 667 CG2 ILE A 44 -12.918 -8.148 13.052 1.00 0.00 C ATOM 668 CD1 ILE A 44 -13.835 -10.204 11.013 1.00 0.00 C ATOM 0 H ILE A 44 -15.587 -10.803 14.402 1.00 0.00 H new ATOM 0 HA ILE A 44 -12.988 -10.008 15.102 1.00 0.00 H new ATOM 0 HB ILE A 44 -14.949 -8.798 13.110 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -12.750 -10.862 12.730 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.465 -11.218 12.784 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -12.943 -7.906 11.989 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -13.127 -7.250 13.633 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -11.931 -8.529 13.315 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -13.659 -11.135 10.474 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.830 -9.828 10.773 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -13.088 -9.467 10.719 1.00 0.00 H new ATOM 680 N ALA A 45 -15.409 -7.837 15.720 1.00 0.00 N ATOM 681 CA ALA A 45 -15.770 -6.636 16.460 1.00 0.00 C ATOM 682 C ALA A 45 -15.435 -6.777 17.939 1.00 0.00 C ATOM 683 O ALA A 45 -14.775 -5.916 18.523 1.00 0.00 O ATOM 684 CB ALA A 45 -17.252 -6.343 16.282 1.00 0.00 C ATOM 0 H ALA A 45 -16.192 -8.279 15.238 1.00 0.00 H new ATOM 0 HA ALA A 45 -15.189 -5.804 16.063 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -17.514 -5.443 16.838 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -17.469 -6.192 15.224 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -17.837 -7.184 16.655 1.00 0.00 H new ATOM 690 N THR A 46 -15.882 -7.872 18.533 1.00 0.00 N ATOM 691 CA THR A 46 -15.670 -8.115 19.952 1.00 0.00 C ATOM 692 C THR A 46 -14.179 -8.146 20.293 1.00 0.00 C ATOM 693 O THR A 46 -13.734 -7.487 21.239 1.00 0.00 O ATOM 694 CB THR A 46 -16.324 -9.443 20.388 1.00 0.00 C ATOM 695 OG1 THR A 46 -17.697 -9.469 19.974 1.00 0.00 O ATOM 696 CG2 THR A 46 -16.247 -9.617 21.897 1.00 0.00 C ATOM 0 H THR A 46 -16.396 -8.610 18.052 1.00 0.00 H new ATOM 0 HA THR A 46 -16.137 -7.292 20.493 1.00 0.00 H new ATOM 0 HB THR A 46 -15.781 -10.261 19.915 1.00 0.00 H new ATOM 0 HG1 THR A 46 -17.743 -9.541 18.998 1.00 0.00 H new ATOM 0 HG21 THR A 46 -16.715 -10.560 22.179 1.00 0.00 H new ATOM 0 HG22 THR A 46 -15.203 -9.622 22.210 1.00 0.00 H new ATOM 0 HG23 THR A 46 -16.768 -8.794 22.385 1.00 0.00 H new ATOM 704 N ALA A 47 -13.407 -8.879 19.496 1.00 0.00 N ATOM 705 CA ALA A 47 -11.985 -9.063 19.762 1.00 0.00 C ATOM 706 C ALA A 47 -11.206 -7.756 19.631 1.00 0.00 C ATOM 707 O ALA A 47 -10.194 -7.560 20.305 1.00 0.00 O ATOM 708 CB ALA A 47 -11.410 -10.111 18.826 1.00 0.00 C ATOM 0 H ALA A 47 -13.744 -9.356 18.659 1.00 0.00 H new ATOM 0 HA ALA A 47 -11.884 -9.403 20.793 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -10.348 -10.240 19.033 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -11.927 -11.058 18.978 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -11.541 -9.788 17.793 1.00 0.00 H new ATOM 714 N THR A 48 -11.674 -6.864 18.767 1.00 0.00 N ATOM 715 CA THR A 48 -10.994 -5.598 18.546 1.00 0.00 C ATOM 716 C THR A 48 -11.552 -4.492 19.446 1.00 0.00 C ATOM 717 O THR A 48 -10.972 -3.408 19.546 1.00 0.00 O ATOM 718 CB THR A 48 -11.095 -5.163 17.072 1.00 0.00 C ATOM 719 OG1 THR A 48 -12.455 -5.251 16.625 1.00 0.00 O ATOM 720 CG2 THR A 48 -10.202 -6.024 16.189 1.00 0.00 C ATOM 0 H THR A 48 -12.519 -6.995 18.211 1.00 0.00 H new ATOM 0 HA THR A 48 -9.946 -5.755 18.800 1.00 0.00 H new ATOM 0 HB THR A 48 -10.758 -4.129 16.998 1.00 0.00 H new ATOM 0 HG1 THR A 48 -12.612 -6.132 16.226 1.00 0.00 H new ATOM 0 HG21 THR A 48 -10.291 -5.697 15.153 1.00 0.00 H new ATOM 0 HG22 THR A 48 -9.166 -5.925 16.513 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.509 -7.067 16.268 1.00 0.00 H new ATOM 728 N GLY A 49 -12.677 -4.769 20.098 1.00 0.00 N ATOM 729 CA GLY A 49 -13.275 -3.795 20.995 1.00 0.00 C ATOM 730 C GLY A 49 -14.126 -2.772 20.264 1.00 0.00 C ATOM 731 O GLY A 49 -14.160 -1.596 20.640 1.00 0.00 O ATOM 0 H GLY A 49 -13.185 -5.650 20.022 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -13.889 -4.314 21.731 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -12.486 -3.280 21.544 1.00 0.00 H new ATOM 735 N MET A 50 -14.801 -3.211 19.213 1.00 0.00 N ATOM 736 CA MET A 50 -15.677 -2.338 18.442 1.00 0.00 C ATOM 737 C MET A 50 -17.064 -2.962 18.326 1.00 0.00 C ATOM 738 O MET A 50 -17.232 -4.154 18.569 1.00 0.00 O ATOM 739 CB MET A 50 -15.090 -2.073 17.048 1.00 0.00 C ATOM 740 CG MET A 50 -13.853 -1.181 17.070 1.00 0.00 C ATOM 741 SD MET A 50 -13.169 -0.855 15.427 1.00 0.00 S ATOM 742 CE MET A 50 -12.496 -2.460 14.995 1.00 0.00 C ATOM 0 H MET A 50 -14.759 -4.171 18.872 1.00 0.00 H new ATOM 0 HA MET A 50 -15.762 -1.384 18.962 1.00 0.00 H new ATOM 0 HB2 MET A 50 -14.834 -3.025 16.583 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.853 -1.608 16.423 1.00 0.00 H new ATOM 0 HG2 MET A 50 -14.107 -0.233 17.544 1.00 0.00 H new ATOM 0 HG3 MET A 50 -13.087 -1.651 17.687 1.00 0.00 H new ATOM 0 HE1 MET A 50 -11.934 -2.380 14.064 1.00 0.00 H new ATOM 0 HE2 MET A 50 -11.834 -2.803 15.790 1.00 0.00 H new ATOM 0 HE3 MET A 50 -13.310 -3.174 14.868 1.00 0.00 H new ATOM 752 N ASN A 51 -18.056 -2.153 17.982 1.00 0.00 N ATOM 753 CA ASN A 51 -19.424 -2.646 17.828 1.00 0.00 C ATOM 754 C ASN A 51 -19.576 -3.370 16.496 1.00 0.00 C ATOM 755 O ASN A 51 -18.804 -3.132 15.569 1.00 0.00 O ATOM 756 CB ASN A 51 -20.439 -1.498 17.904 1.00 0.00 C ATOM 757 CG ASN A 51 -20.432 -0.782 19.244 1.00 0.00 C ATOM 758 OD1 ASN A 51 -19.729 0.213 19.426 1.00 0.00 O ATOM 759 ND2 ASN A 51 -21.218 -1.276 20.188 1.00 0.00 N ATOM 0 H ASN A 51 -17.943 -1.155 17.804 1.00 0.00 H new ATOM 0 HA ASN A 51 -19.622 -3.339 18.645 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -20.224 -0.779 17.114 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -21.438 -1.891 17.714 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -21.256 -0.830 21.105 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -21.785 -2.102 19.998 1.00 0.00 H new ATOM 766 N LEU A 52 -20.577 -4.241 16.394 1.00 0.00 N ATOM 767 CA LEU A 52 -20.822 -4.984 15.158 1.00 0.00 C ATOM 768 C LEU A 52 -21.074 -4.038 13.990 1.00 0.00 C ATOM 769 O LEU A 52 -20.530 -4.220 12.899 1.00 0.00 O ATOM 770 CB LEU A 52 -22.004 -5.945 15.317 1.00 0.00 C ATOM 771 CG LEU A 52 -21.671 -7.321 15.905 1.00 0.00 C ATOM 772 CD1 LEU A 52 -21.202 -7.204 17.346 1.00 0.00 C ATOM 773 CD2 LEU A 52 -22.878 -8.242 15.807 1.00 0.00 C ATOM 0 H LEU A 52 -21.230 -4.450 17.149 1.00 0.00 H new ATOM 0 HA LEU A 52 -19.926 -5.567 14.946 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -22.751 -5.470 15.953 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -22.464 -6.090 14.339 1.00 0.00 H new ATOM 0 HG LEU A 52 -20.855 -7.750 15.324 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -20.973 -8.196 17.736 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -20.308 -6.582 17.388 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -21.988 -6.750 17.949 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.628 -9.216 16.228 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.711 -7.810 16.361 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -23.161 -8.361 14.761 1.00 0.00 H new ATOM 785 N THR A 53 -21.893 -3.021 14.226 1.00 0.00 N ATOM 786 CA THR A 53 -22.174 -2.014 13.217 1.00 0.00 C ATOM 787 C THR A 53 -20.903 -1.268 12.824 1.00 0.00 C ATOM 788 O THR A 53 -20.630 -1.055 11.640 1.00 0.00 O ATOM 789 CB THR A 53 -23.222 -1.016 13.731 1.00 0.00 C ATOM 790 OG1 THR A 53 -22.972 -0.727 15.115 1.00 0.00 O ATOM 791 CG2 THR A 53 -24.622 -1.578 13.570 1.00 0.00 C ATOM 0 H THR A 53 -22.375 -2.874 15.113 1.00 0.00 H new ATOM 0 HA THR A 53 -22.567 -2.523 12.337 1.00 0.00 H new ATOM 0 HB THR A 53 -23.148 -0.100 13.146 1.00 0.00 H new ATOM 0 HG1 THR A 53 -23.640 -0.089 15.442 1.00 0.00 H new ATOM 0 HG21 THR A 53 -25.349 -0.855 13.940 1.00 0.00 H new ATOM 0 HG22 THR A 53 -24.814 -1.779 12.516 1.00 0.00 H new ATOM 0 HG23 THR A 53 -24.710 -2.504 14.138 1.00 0.00 H new ATOM 799 N THR A 54 -20.127 -0.894 13.831 1.00 0.00 N ATOM 800 CA THR A 54 -18.859 -0.211 13.626 1.00 0.00 C ATOM 801 C THR A 54 -17.893 -1.078 12.819 1.00 0.00 C ATOM 802 O THR A 54 -17.282 -0.612 11.857 1.00 0.00 O ATOM 803 CB THR A 54 -18.219 0.155 14.977 1.00 0.00 C ATOM 804 OG1 THR A 54 -19.166 0.878 15.773 1.00 0.00 O ATOM 805 CG2 THR A 54 -16.967 0.994 14.783 1.00 0.00 C ATOM 0 H THR A 54 -20.358 -1.055 14.811 1.00 0.00 H new ATOM 0 HA THR A 54 -19.060 0.702 13.065 1.00 0.00 H new ATOM 0 HB THR A 54 -17.934 -0.767 15.484 1.00 0.00 H new ATOM 0 HG1 THR A 54 -18.760 1.110 16.634 1.00 0.00 H new ATOM 0 HG21 THR A 54 -16.538 1.237 15.755 1.00 0.00 H new ATOM 0 HG22 THR A 54 -16.241 0.433 14.195 1.00 0.00 H new ATOM 0 HG23 THR A 54 -17.224 1.915 14.259 1.00 0.00 H new ATOM 813 N ALA A 55 -17.771 -2.341 13.208 1.00 0.00 N ATOM 814 CA ALA A 55 -16.902 -3.278 12.511 1.00 0.00 C ATOM 815 C ALA A 55 -17.325 -3.424 11.059 1.00 0.00 C ATOM 816 O ALA A 55 -16.490 -3.403 10.160 1.00 0.00 O ATOM 817 CB ALA A 55 -16.906 -4.629 13.211 1.00 0.00 C ATOM 0 H ALA A 55 -18.265 -2.740 14.006 1.00 0.00 H new ATOM 0 HA ALA A 55 -15.886 -2.884 12.530 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -16.251 -5.318 12.677 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -16.550 -4.510 14.234 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -17.920 -5.029 13.224 1.00 0.00 H new ATOM 823 N SER A 56 -18.628 -3.542 10.834 1.00 0.00 N ATOM 824 CA SER A 56 -19.163 -3.677 9.486 1.00 0.00 C ATOM 825 C SER A 56 -18.796 -2.466 8.629 1.00 0.00 C ATOM 826 O SER A 56 -18.497 -2.602 7.445 1.00 0.00 O ATOM 827 CB SER A 56 -20.680 -3.845 9.537 1.00 0.00 C ATOM 828 OG SER A 56 -21.044 -4.963 10.333 1.00 0.00 O ATOM 0 H SER A 56 -19.334 -3.547 11.570 1.00 0.00 H new ATOM 0 HA SER A 56 -18.722 -4.564 9.031 1.00 0.00 H new ATOM 0 HB2 SER A 56 -21.136 -2.942 9.943 1.00 0.00 H new ATOM 0 HB3 SER A 56 -21.069 -3.972 8.527 1.00 0.00 H new ATOM 0 HG SER A 56 -20.880 -4.759 11.277 1.00 0.00 H new ATOM 834 N ALA A 57 -18.805 -1.286 9.238 1.00 0.00 N ATOM 835 CA ALA A 57 -18.456 -0.064 8.526 1.00 0.00 C ATOM 836 C ALA A 57 -16.968 -0.046 8.186 1.00 0.00 C ATOM 837 O ALA A 57 -16.580 0.293 7.067 1.00 0.00 O ATOM 838 CB ALA A 57 -18.832 1.155 9.351 1.00 0.00 C ATOM 0 H ALA A 57 -19.049 -1.150 10.219 1.00 0.00 H new ATOM 0 HA ALA A 57 -19.019 -0.036 7.593 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.565 2.060 8.805 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -19.905 1.149 9.541 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.296 1.132 10.300 1.00 0.00 H new ATOM 844 N ASN A 58 -16.143 -0.427 9.152 1.00 0.00 N ATOM 845 CA ASN A 58 -14.699 -0.484 8.947 1.00 0.00 C ATOM 846 C ASN A 58 -14.348 -1.534 7.896 1.00 0.00 C ATOM 847 O ASN A 58 -13.477 -1.317 7.050 1.00 0.00 O ATOM 848 CB ASN A 58 -13.976 -0.792 10.264 1.00 0.00 C ATOM 849 CG ASN A 58 -13.870 0.420 11.175 1.00 0.00 C ATOM 850 OD1 ASN A 58 -12.891 1.161 11.127 1.00 0.00 O ATOM 851 ND2 ASN A 58 -14.874 0.638 12.007 1.00 0.00 N ATOM 0 H ASN A 58 -16.447 -0.702 10.086 1.00 0.00 H new ATOM 0 HA ASN A 58 -14.368 0.491 8.590 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -14.506 -1.588 10.787 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -12.975 -1.165 10.045 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -14.851 1.441 12.635 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -15.672 0.003 12.021 1.00 0.00 H new ATOM 858 N LEU A 59 -15.044 -2.662 7.950 1.00 0.00 N ATOM 859 CA LEU A 59 -14.847 -3.737 6.988 1.00 0.00 C ATOM 860 C LEU A 59 -15.301 -3.318 5.595 1.00 0.00 C ATOM 861 O LEU A 59 -14.681 -3.687 4.600 1.00 0.00 O ATOM 862 CB LEU A 59 -15.601 -4.992 7.433 1.00 0.00 C ATOM 863 CG LEU A 59 -15.029 -5.687 8.669 1.00 0.00 C ATOM 864 CD1 LEU A 59 -15.961 -6.788 9.143 1.00 0.00 C ATOM 865 CD2 LEU A 59 -13.652 -6.253 8.367 1.00 0.00 C ATOM 0 H LEU A 59 -15.755 -2.856 8.655 1.00 0.00 H new ATOM 0 HA LEU A 59 -13.781 -3.959 6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -16.638 -4.722 7.634 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -15.611 -5.703 6.607 1.00 0.00 H new ATOM 0 HG LEU A 59 -14.936 -4.949 9.466 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -15.536 -7.270 10.023 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -16.931 -6.360 9.396 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -16.086 -7.525 8.350 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -13.258 -6.745 9.256 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -13.726 -6.976 7.555 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -12.983 -5.445 8.073 1.00 0.00 H new ATOM 877 N GLN A 60 -16.379 -2.541 5.528 1.00 0.00 N ATOM 878 CA GLN A 60 -16.898 -2.055 4.253 1.00 0.00 C ATOM 879 C GLN A 60 -15.850 -1.214 3.529 1.00 0.00 C ATOM 880 O GLN A 60 -15.693 -1.311 2.308 1.00 0.00 O ATOM 881 CB GLN A 60 -18.167 -1.227 4.466 1.00 0.00 C ATOM 882 CG GLN A 60 -18.796 -0.741 3.167 1.00 0.00 C ATOM 883 CD GLN A 60 -20.037 0.102 3.388 1.00 0.00 C ATOM 884 OE1 GLN A 60 -20.060 0.856 4.474 1.00 0.00 O flip ATOM 885 NE2 GLN A 60 -20.954 0.100 2.569 1.00 0.00 N flip ATOM 0 H GLN A 60 -16.910 -2.234 6.343 1.00 0.00 H new ATOM 0 HA GLN A 60 -17.141 -2.922 3.638 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -18.896 -1.826 5.012 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -17.930 -0.366 5.091 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -18.062 -0.158 2.610 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -19.054 -1.602 2.550 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -20.899 -0.496 1.743 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -21.770 0.695 2.715 1.00 0.00 H new ATOM 894 N ALA A 61 -15.133 -0.395 4.289 1.00 0.00 N ATOM 895 CA ALA A 61 -14.081 0.448 3.733 1.00 0.00 C ATOM 896 C ALA A 61 -12.963 -0.407 3.147 1.00 0.00 C ATOM 897 O ALA A 61 -12.542 -0.203 2.007 1.00 0.00 O ATOM 898 CB ALA A 61 -13.538 1.384 4.801 1.00 0.00 C ATOM 0 H ALA A 61 -15.262 -0.296 5.296 1.00 0.00 H new ATOM 0 HA ALA A 61 -14.505 1.050 2.929 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -12.753 2.008 4.373 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.343 2.018 5.173 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -13.128 0.798 5.624 1.00 0.00 H new ATOM 904 N LEU A 62 -12.508 -1.381 3.926 1.00 0.00 N ATOM 905 CA LEU A 62 -11.449 -2.286 3.492 1.00 0.00 C ATOM 906 C LEU A 62 -11.901 -3.113 2.291 1.00 0.00 C ATOM 907 O LEU A 62 -11.118 -3.392 1.377 1.00 0.00 O ATOM 908 CB LEU A 62 -11.049 -3.220 4.637 1.00 0.00 C ATOM 909 CG LEU A 62 -10.476 -2.530 5.877 1.00 0.00 C ATOM 910 CD1 LEU A 62 -10.221 -3.545 6.980 1.00 0.00 C ATOM 911 CD2 LEU A 62 -9.194 -1.791 5.530 1.00 0.00 C ATOM 0 H LEU A 62 -12.858 -1.565 4.866 1.00 0.00 H new ATOM 0 HA LEU A 62 -10.588 -1.685 3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.924 -3.797 4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.311 -3.930 4.263 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.206 -1.805 6.236 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.814 -3.037 7.854 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.157 -4.034 7.248 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.509 -4.292 6.630 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.800 -1.306 6.423 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.459 -2.498 5.147 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.403 -1.038 4.770 1.00 0.00 H new ATOM 923 N LYS A 63 -13.171 -3.493 2.296 1.00 0.00 N ATOM 924 CA LYS A 63 -13.734 -4.320 1.239 1.00 0.00 C ATOM 925 C LYS A 63 -13.821 -3.532 -0.063 1.00 0.00 C ATOM 926 O LYS A 63 -13.603 -4.073 -1.147 1.00 0.00 O ATOM 927 CB LYS A 63 -15.118 -4.826 1.648 1.00 0.00 C ATOM 928 CG LYS A 63 -15.597 -6.010 0.833 1.00 0.00 C ATOM 929 CD LYS A 63 -16.989 -6.447 1.249 1.00 0.00 C ATOM 930 CE LYS A 63 -17.374 -7.761 0.590 1.00 0.00 C ATOM 931 NZ LYS A 63 -17.415 -7.660 -0.892 1.00 0.00 N ATOM 0 H LYS A 63 -13.835 -3.239 3.027 1.00 0.00 H new ATOM 0 HA LYS A 63 -13.080 -5.178 1.080 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -15.097 -5.106 2.701 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -15.837 -4.013 1.549 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -15.598 -5.748 -0.225 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.902 -6.841 0.955 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -17.030 -6.555 2.333 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -17.711 -5.676 0.978 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.660 -8.532 0.879 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -18.351 -8.076 0.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.401 -7.719 -1.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.007 -6.751 -1.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -16.866 -8.439 -1.308 1.00 0.00 H new ATOM 945 N SER A 64 -14.127 -2.246 0.055 1.00 0.00 N ATOM 946 CA SER A 64 -14.222 -1.370 -1.104 1.00 0.00 C ATOM 947 C SER A 64 -12.833 -1.024 -1.634 1.00 0.00 C ATOM 948 O SER A 64 -12.679 -0.599 -2.780 1.00 0.00 O ATOM 949 CB SER A 64 -14.995 -0.104 -0.735 1.00 0.00 C ATOM 950 OG SER A 64 -16.271 -0.435 -0.213 1.00 0.00 O ATOM 0 H SER A 64 -14.314 -1.786 0.946 1.00 0.00 H new ATOM 0 HA SER A 64 -14.761 -1.890 -1.896 1.00 0.00 H new ATOM 0 HB2 SER A 64 -14.433 0.471 0.001 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.109 0.529 -1.615 1.00 0.00 H new ATOM 0 HG SER A 64 -16.164 -0.899 0.644 1.00 0.00 H new ATOM 956 N GLY A 65 -11.822 -1.207 -0.789 1.00 0.00 N ATOM 957 CA GLY A 65 -10.453 -1.025 -1.222 1.00 0.00 C ATOM 958 C GLY A 65 -9.926 -2.244 -1.954 1.00 0.00 C ATOM 959 O GLY A 65 -8.925 -2.165 -2.663 1.00 0.00 O ATOM 0 H GLY A 65 -11.930 -1.478 0.188 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.391 -0.154 -1.875 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.823 -0.820 -0.357 1.00 0.00 H new ATOM 963 N GLY A 66 -10.613 -3.370 -1.790 1.00 0.00 N ATOM 964 CA GLY A 66 -10.198 -4.597 -2.447 1.00 0.00 C ATOM 965 C GLY A 66 -9.296 -5.443 -1.573 1.00 0.00 C ATOM 966 O GLY A 66 -8.665 -6.387 -2.051 1.00 0.00 O ATOM 0 H GLY A 66 -11.450 -3.455 -1.214 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.080 -5.175 -2.721 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -9.677 -4.352 -3.373 1.00 0.00 H new ATOM 970 N LEU A 67 -9.239 -5.109 -0.290 1.00 0.00 N ATOM 971 CA LEU A 67 -8.371 -5.811 0.646 1.00 0.00 C ATOM 972 C LEU A 67 -9.051 -7.053 1.215 1.00 0.00 C ATOM 973 O LEU A 67 -8.426 -8.105 1.349 1.00 0.00 O ATOM 974 CB LEU A 67 -7.938 -4.881 1.790 1.00 0.00 C ATOM 975 CG LEU A 67 -6.705 -4.009 1.521 1.00 0.00 C ATOM 976 CD1 LEU A 67 -5.470 -4.872 1.333 1.00 0.00 C ATOM 977 CD2 LEU A 67 -6.916 -3.118 0.308 1.00 0.00 C ATOM 0 H LEU A 67 -9.785 -4.355 0.127 1.00 0.00 H new ATOM 0 HA LEU A 67 -7.487 -6.129 0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.774 -4.226 2.035 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.741 -5.491 2.672 1.00 0.00 H new ATOM 0 HG LEU A 67 -6.555 -3.368 2.390 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.606 -4.235 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -5.296 -5.460 2.234 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -5.620 -5.542 0.486 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -6.025 -2.512 0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -7.102 -3.737 -0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -7.772 -2.466 0.480 1.00 0.00 H new ATOM 989 N VAL A 68 -10.332 -6.935 1.543 1.00 0.00 N ATOM 990 CA VAL A 68 -11.053 -8.041 2.159 1.00 0.00 C ATOM 991 C VAL A 68 -12.271 -8.445 1.341 1.00 0.00 C ATOM 992 O VAL A 68 -12.743 -7.692 0.491 1.00 0.00 O ATOM 993 CB VAL A 68 -11.500 -7.711 3.602 1.00 0.00 C ATOM 994 CG1 VAL A 68 -10.299 -7.394 4.476 1.00 0.00 C ATOM 995 CG2 VAL A 68 -12.499 -6.562 3.622 1.00 0.00 C ATOM 0 H VAL A 68 -10.888 -6.093 1.394 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.352 -8.875 2.191 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.998 -8.592 4.007 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.635 -7.165 5.487 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.631 -8.255 4.502 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.768 -6.535 4.067 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -12.794 -6.354 4.651 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.040 -5.673 3.189 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -13.379 -6.835 3.040 1.00 0.00 H new ATOM 1005 N GLU A 69 -12.762 -9.642 1.612 1.00 0.00 N ATOM 1006 CA GLU A 69 -13.952 -10.161 0.965 1.00 0.00 C ATOM 1007 C GLU A 69 -14.869 -10.757 2.020 1.00 0.00 C ATOM 1008 O GLU A 69 -14.411 -11.153 3.095 1.00 0.00 O ATOM 1009 CB GLU A 69 -13.575 -11.220 -0.076 1.00 0.00 C ATOM 1010 CG GLU A 69 -14.050 -10.899 -1.487 1.00 0.00 C ATOM 1011 CD GLU A 69 -15.556 -10.980 -1.641 1.00 0.00 C ATOM 1012 OE1 GLU A 69 -16.268 -10.122 -1.080 1.00 0.00 O ATOM 1013 OE2 GLU A 69 -16.037 -11.897 -2.341 1.00 0.00 O ATOM 0 H GLU A 69 -12.345 -10.282 2.288 1.00 0.00 H new ATOM 0 HA GLU A 69 -14.469 -9.351 0.451 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -12.491 -11.335 -0.086 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -13.994 -12.179 0.228 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.717 -9.897 -1.757 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.582 -11.590 -2.188 1.00 0.00 H new ATOM 1020 N ALA A 70 -16.154 -10.818 1.722 1.00 0.00 N ATOM 1021 CA ALA A 70 -17.129 -11.304 2.684 1.00 0.00 C ATOM 1022 C ALA A 70 -17.949 -12.439 2.100 1.00 0.00 C ATOM 1023 O ALA A 70 -18.539 -12.305 1.028 1.00 0.00 O ATOM 1024 CB ALA A 70 -18.044 -10.175 3.134 1.00 0.00 C ATOM 0 H ALA A 70 -16.547 -10.538 0.824 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.586 -11.683 3.550 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -18.767 -10.558 3.854 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -17.450 -9.389 3.600 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -18.571 -9.768 2.271 1.00 0.00 H new ATOM 1030 N ARG A 71 -17.983 -13.554 2.805 1.00 0.00 N ATOM 1031 CA ARG A 71 -18.794 -14.684 2.391 1.00 0.00 C ATOM 1032 C ARG A 71 -20.104 -14.672 3.160 1.00 0.00 C ATOM 1033 O ARG A 71 -20.109 -14.605 4.393 1.00 0.00 O ATOM 1034 CB ARG A 71 -18.067 -16.006 2.647 1.00 0.00 C ATOM 1035 CG ARG A 71 -16.652 -16.055 2.094 1.00 0.00 C ATOM 1036 CD ARG A 71 -16.041 -17.438 2.264 1.00 0.00 C ATOM 1037 NE ARG A 71 -16.238 -17.962 3.615 1.00 0.00 N ATOM 1038 CZ ARG A 71 -15.304 -18.597 4.318 1.00 0.00 C ATOM 1039 NH1 ARG A 71 -14.075 -18.744 3.836 1.00 0.00 N ATOM 1040 NH2 ARG A 71 -15.609 -19.078 5.512 1.00 0.00 N ATOM 0 H ARG A 71 -17.458 -13.702 3.667 1.00 0.00 H new ATOM 0 HA ARG A 71 -18.985 -14.598 1.321 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -18.032 -16.186 3.721 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -18.646 -16.818 2.206 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -16.662 -15.787 1.038 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -16.034 -15.316 2.604 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -16.486 -18.122 1.541 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -14.974 -17.392 2.045 1.00 0.00 H new ATOM 0 HE ARG A 71 -17.153 -17.832 4.047 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -13.839 -18.368 2.918 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -13.367 -19.233 4.384 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -16.551 -18.960 5.884 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -14.902 -19.567 6.061 1.00 0.00 H new ATOM 1054 N ARG A 72 -21.209 -14.709 2.438 1.00 0.00 N ATOM 1055 CA ARG A 72 -22.514 -14.743 3.069 1.00 0.00 C ATOM 1056 C ARG A 72 -22.855 -16.172 3.464 1.00 0.00 C ATOM 1057 O ARG A 72 -23.349 -16.956 2.650 1.00 0.00 O ATOM 1058 CB ARG A 72 -23.579 -14.174 2.128 1.00 0.00 C ATOM 1059 CG ARG A 72 -24.976 -14.116 2.730 1.00 0.00 C ATOM 1060 CD ARG A 72 -25.053 -13.158 3.908 1.00 0.00 C ATOM 1061 NE ARG A 72 -24.746 -11.777 3.525 1.00 0.00 N ATOM 1062 CZ ARG A 72 -25.508 -10.731 3.855 1.00 0.00 C ATOM 1063 NH1 ARG A 72 -26.686 -10.921 4.438 1.00 0.00 N ATOM 1064 NH2 ARG A 72 -25.117 -9.500 3.551 1.00 0.00 N ATOM 0 H ARG A 72 -21.228 -14.716 1.418 1.00 0.00 H new ATOM 0 HA ARG A 72 -22.491 -14.125 3.967 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -23.283 -13.169 1.828 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -23.610 -14.781 1.223 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -25.687 -13.806 1.964 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -25.272 -15.114 3.055 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -26.052 -13.199 4.341 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -24.357 -13.481 4.682 1.00 0.00 H new ATOM 0 HE ARG A 72 -23.904 -11.605 2.976 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -27.011 -11.868 4.635 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -27.266 -10.120 4.689 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -24.233 -9.351 3.064 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -25.700 -8.702 3.804 1.00 0.00 H new ATOM 1078 N GLU A 73 -22.570 -16.505 4.711 1.00 0.00 N ATOM 1079 CA GLU A 73 -22.846 -17.832 5.232 1.00 0.00 C ATOM 1080 C GLU A 73 -24.001 -17.766 6.216 1.00 0.00 C ATOM 1081 O GLU A 73 -23.860 -17.238 7.323 1.00 0.00 O ATOM 1082 CB GLU A 73 -21.603 -18.419 5.905 1.00 0.00 C ATOM 1083 CG GLU A 73 -20.414 -18.573 4.970 1.00 0.00 C ATOM 1084 CD GLU A 73 -19.233 -19.243 5.640 1.00 0.00 C ATOM 1085 OE1 GLU A 73 -19.327 -20.447 5.948 1.00 0.00 O ATOM 1086 OE2 GLU A 73 -18.201 -18.576 5.863 1.00 0.00 O ATOM 0 H GLU A 73 -22.144 -15.869 5.386 1.00 0.00 H new ATOM 0 HA GLU A 73 -23.121 -18.484 4.403 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -21.317 -17.779 6.739 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.854 -19.394 6.323 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -20.713 -19.157 4.100 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -20.112 -17.591 4.606 1.00 0.00 H new ATOM 1093 N GLY A 74 -25.141 -18.297 5.802 1.00 0.00 N ATOM 1094 CA GLY A 74 -26.340 -18.194 6.602 1.00 0.00 C ATOM 1095 C GLY A 74 -26.800 -16.759 6.723 1.00 0.00 C ATOM 1096 O GLY A 74 -26.978 -16.073 5.716 1.00 0.00 O ATOM 0 H GLY A 74 -25.256 -18.799 4.922 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -27.131 -18.795 6.154 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -26.153 -18.603 7.595 1.00 0.00 H new ATOM 1100 N THR A 75 -26.964 -16.297 7.948 1.00 0.00 N ATOM 1101 CA THR A 75 -27.364 -14.923 8.197 1.00 0.00 C ATOM 1102 C THR A 75 -26.165 -14.120 8.702 1.00 0.00 C ATOM 1103 O THR A 75 -26.295 -12.984 9.159 1.00 0.00 O ATOM 1104 CB THR A 75 -28.511 -14.869 9.229 1.00 0.00 C ATOM 1105 OG1 THR A 75 -29.459 -15.909 8.955 1.00 0.00 O ATOM 1106 CG2 THR A 75 -29.228 -13.526 9.189 1.00 0.00 C ATOM 0 H THR A 75 -26.826 -16.855 8.791 1.00 0.00 H new ATOM 0 HA THR A 75 -27.721 -14.488 7.264 1.00 0.00 H new ATOM 0 HB THR A 75 -28.076 -15.005 10.219 1.00 0.00 H new ATOM 0 HG1 THR A 75 -30.184 -15.872 9.613 1.00 0.00 H new ATOM 0 HG21 THR A 75 -30.030 -13.520 9.927 1.00 0.00 H new ATOM 0 HG22 THR A 75 -28.520 -12.729 9.416 1.00 0.00 H new ATOM 0 HG23 THR A 75 -29.648 -13.367 8.196 1.00 0.00 H new ATOM 1114 N ARG A 76 -24.986 -14.716 8.601 1.00 0.00 N ATOM 1115 CA ARG A 76 -23.777 -14.091 9.105 1.00 0.00 C ATOM 1116 C ARG A 76 -22.848 -13.699 7.967 1.00 0.00 C ATOM 1117 O ARG A 76 -22.809 -14.351 6.921 1.00 0.00 O ATOM 1118 CB ARG A 76 -23.044 -15.035 10.062 1.00 0.00 C ATOM 1119 CG ARG A 76 -23.870 -15.464 11.260 1.00 0.00 C ATOM 1120 CD ARG A 76 -23.081 -16.386 12.166 1.00 0.00 C ATOM 1121 NE ARG A 76 -23.871 -16.850 13.303 1.00 0.00 N ATOM 1122 CZ ARG A 76 -23.350 -17.182 14.483 1.00 0.00 C ATOM 1123 NH1 ARG A 76 -22.036 -17.137 14.664 1.00 0.00 N ATOM 1124 NH2 ARG A 76 -24.137 -17.580 15.474 1.00 0.00 N ATOM 0 H ARG A 76 -24.843 -15.631 8.174 1.00 0.00 H new ATOM 0 HA ARG A 76 -24.070 -13.189 9.643 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -22.732 -15.923 9.512 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -22.137 -14.545 10.416 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -24.188 -14.584 11.820 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -24.774 -15.970 10.920 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -22.733 -17.245 11.593 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -22.195 -15.865 12.529 1.00 0.00 H new ATOM 0 HE ARG A 76 -24.882 -16.924 13.187 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -21.425 -16.848 13.900 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -21.637 -17.391 15.568 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -25.146 -17.633 15.334 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -23.733 -17.833 16.376 1.00 0.00 H new ATOM 1138 N GLN A 77 -22.110 -12.622 8.176 1.00 0.00 N ATOM 1139 CA GLN A 77 -21.098 -12.196 7.227 1.00 0.00 C ATOM 1140 C GLN A 77 -19.724 -12.592 7.740 1.00 0.00 C ATOM 1141 O GLN A 77 -19.294 -12.132 8.799 1.00 0.00 O ATOM 1142 CB GLN A 77 -21.147 -10.682 7.011 1.00 0.00 C ATOM 1143 CG GLN A 77 -22.471 -10.177 6.467 1.00 0.00 C ATOM 1144 CD GLN A 77 -22.460 -8.679 6.231 1.00 0.00 C ATOM 1145 OE1 GLN A 77 -22.788 -7.899 7.123 1.00 0.00 O ATOM 1146 NE2 GLN A 77 -22.076 -8.269 5.032 1.00 0.00 N ATOM 0 H GLN A 77 -22.194 -12.025 8.999 1.00 0.00 H new ATOM 0 HA GLN A 77 -21.295 -12.684 6.273 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -20.942 -10.184 7.958 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -20.351 -10.398 6.322 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.696 -10.689 5.531 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -23.268 -10.427 7.167 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -21.812 -8.950 4.320 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -22.044 -7.272 4.820 1.00 0.00 H new ATOM 1155 N TYR A 78 -19.057 -13.468 7.010 1.00 0.00 N ATOM 1156 CA TYR A 78 -17.714 -13.885 7.371 1.00 0.00 C ATOM 1157 C TYR A 78 -16.697 -13.185 6.487 1.00 0.00 C ATOM 1158 O TYR A 78 -16.689 -13.368 5.268 1.00 0.00 O ATOM 1159 CB TYR A 78 -17.565 -15.405 7.257 1.00 0.00 C ATOM 1160 CG TYR A 78 -18.352 -16.161 8.303 1.00 0.00 C ATOM 1161 CD1 TYR A 78 -19.707 -16.406 8.137 1.00 0.00 C ATOM 1162 CD2 TYR A 78 -17.741 -16.612 9.467 1.00 0.00 C ATOM 1163 CE1 TYR A 78 -20.431 -17.084 9.097 1.00 0.00 C ATOM 1164 CE2 TYR A 78 -18.462 -17.289 10.432 1.00 0.00 C ATOM 1165 CZ TYR A 78 -19.806 -17.521 10.244 1.00 0.00 C ATOM 1166 OH TYR A 78 -20.527 -18.190 11.204 1.00 0.00 O ATOM 0 H TYR A 78 -19.423 -13.904 6.164 1.00 0.00 H new ATOM 0 HA TYR A 78 -17.533 -13.605 8.409 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -17.891 -15.722 6.267 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -16.511 -15.668 7.345 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -20.204 -16.061 7.242 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -16.687 -16.431 9.620 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -21.484 -17.271 8.949 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -17.973 -17.635 11.331 1.00 0.00 H new ATOM 0 HH TYR A 78 -19.937 -18.430 11.949 1.00 0.00 H new ATOM 1176 N TYR A 79 -15.855 -12.376 7.107 1.00 0.00 N ATOM 1177 CA TYR A 79 -14.870 -11.595 6.378 1.00 0.00 C ATOM 1178 C TYR A 79 -13.499 -12.240 6.449 1.00 0.00 C ATOM 1179 O TYR A 79 -13.161 -12.916 7.423 1.00 0.00 O ATOM 1180 CB TYR A 79 -14.792 -10.167 6.927 1.00 0.00 C ATOM 1181 CG TYR A 79 -15.901 -9.252 6.445 1.00 0.00 C ATOM 1182 CD1 TYR A 79 -17.187 -9.345 6.962 1.00 0.00 C ATOM 1183 CD2 TYR A 79 -15.651 -8.282 5.480 1.00 0.00 C ATOM 1184 CE1 TYR A 79 -18.192 -8.500 6.532 1.00 0.00 C ATOM 1185 CE2 TYR A 79 -16.652 -7.434 5.044 1.00 0.00 C ATOM 1186 CZ TYR A 79 -17.919 -7.546 5.573 1.00 0.00 C ATOM 1187 OH TYR A 79 -18.915 -6.701 5.142 1.00 0.00 O ATOM 0 H TYR A 79 -15.834 -12.243 8.118 1.00 0.00 H new ATOM 0 HA TYR A 79 -15.188 -11.560 5.336 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -14.817 -10.207 8.016 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -13.832 -9.734 6.646 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -17.405 -10.090 7.713 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -14.658 -8.190 5.064 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -19.186 -8.586 6.944 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -16.442 -6.687 4.292 1.00 0.00 H new ATOM 0 HH TYR A 79 -18.555 -6.089 4.466 1.00 0.00 H new ATOM 1197 N ARG A 80 -12.729 -12.030 5.400 1.00 0.00 N ATOM 1198 CA ARG A 80 -11.361 -12.506 5.320 1.00 0.00 C ATOM 1199 C ARG A 80 -10.642 -11.664 4.280 1.00 0.00 C ATOM 1200 O ARG A 80 -11.280 -10.870 3.590 1.00 0.00 O ATOM 1201 CB ARG A 80 -11.325 -13.980 4.905 1.00 0.00 C ATOM 1202 CG ARG A 80 -9.970 -14.642 5.096 1.00 0.00 C ATOM 1203 CD ARG A 80 -9.802 -15.835 4.172 1.00 0.00 C ATOM 1204 NE ARG A 80 -9.733 -15.429 2.766 1.00 0.00 N ATOM 1205 CZ ARG A 80 -9.679 -16.281 1.742 1.00 0.00 C ATOM 1206 NH1 ARG A 80 -9.711 -17.591 1.953 1.00 0.00 N ATOM 1207 NH2 ARG A 80 -9.594 -15.818 0.503 1.00 0.00 N ATOM 0 H ARG A 80 -13.037 -11.520 4.572 1.00 0.00 H new ATOM 0 HA ARG A 80 -10.879 -12.420 6.294 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -12.070 -14.528 5.482 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -11.612 -14.059 3.856 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -9.179 -13.917 4.904 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -9.863 -14.964 6.132 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -8.894 -16.376 4.439 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -10.636 -16.523 4.311 1.00 0.00 H new ATOM 0 HE ARG A 80 -9.726 -14.431 2.557 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -9.777 -17.953 2.904 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -9.669 -18.236 1.164 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -9.570 -14.812 0.335 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -9.553 -16.467 -0.282 1.00 0.00 H new ATOM 1221 N ILE A 81 -9.332 -11.824 4.163 1.00 0.00 N ATOM 1222 CA ILE A 81 -8.599 -11.196 3.077 1.00 0.00 C ATOM 1223 C ILE A 81 -9.194 -11.661 1.746 1.00 0.00 C ATOM 1224 O ILE A 81 -9.524 -12.841 1.596 1.00 0.00 O ATOM 1225 CB ILE A 81 -7.094 -11.537 3.135 1.00 0.00 C ATOM 1226 CG1 ILE A 81 -6.518 -11.148 4.503 1.00 0.00 C ATOM 1227 CG2 ILE A 81 -6.343 -10.828 2.018 1.00 0.00 C ATOM 1228 CD1 ILE A 81 -5.045 -11.462 4.661 1.00 0.00 C ATOM 0 H ILE A 81 -8.760 -12.378 4.801 1.00 0.00 H new ATOM 0 HA ILE A 81 -8.691 -10.114 3.173 1.00 0.00 H new ATOM 0 HB ILE A 81 -6.973 -12.612 2.998 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.671 -10.080 4.660 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -7.076 -11.668 5.282 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.284 -11.080 2.075 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.741 -11.145 1.054 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.466 -9.750 2.124 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.713 -11.158 5.654 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.886 -12.533 4.537 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.475 -10.921 3.906 1.00 0.00 H new ATOM 1240 N ALA A 82 -9.358 -10.725 0.812 1.00 0.00 N ATOM 1241 CA ALA A 82 -10.039 -10.989 -0.460 1.00 0.00 C ATOM 1242 C ALA A 82 -9.549 -12.274 -1.119 1.00 0.00 C ATOM 1243 O ALA A 82 -10.344 -13.130 -1.510 1.00 0.00 O ATOM 1244 CB ALA A 82 -9.856 -9.812 -1.405 1.00 0.00 C ATOM 0 H ALA A 82 -9.025 -9.766 0.912 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.099 -11.119 -0.242 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.365 -10.018 -2.346 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -10.278 -8.914 -0.954 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.793 -9.659 -1.594 1.00 0.00 H new ATOM 1250 N GLY A 83 -8.242 -12.410 -1.228 1.00 0.00 N ATOM 1251 CA GLY A 83 -7.663 -13.600 -1.806 1.00 0.00 C ATOM 1252 C GLY A 83 -6.273 -13.836 -1.272 1.00 0.00 C ATOM 1253 O GLY A 83 -5.711 -12.960 -0.612 1.00 0.00 O ATOM 0 H GLY A 83 -7.564 -11.711 -0.924 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.293 -14.461 -1.583 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.628 -13.502 -2.891 1.00 0.00 H new ATOM 1257 N GLU A 84 -5.707 -15.003 -1.553 1.00 0.00 N ATOM 1258 CA GLU A 84 -4.372 -15.315 -1.072 1.00 0.00 C ATOM 1259 C GLU A 84 -3.358 -14.374 -1.704 1.00 0.00 C ATOM 1260 O GLU A 84 -2.361 -14.031 -1.082 1.00 0.00 O ATOM 1261 CB GLU A 84 -3.986 -16.767 -1.360 1.00 0.00 C ATOM 1262 CG GLU A 84 -2.707 -17.188 -0.648 1.00 0.00 C ATOM 1263 CD GLU A 84 -2.217 -18.560 -1.054 1.00 0.00 C ATOM 1264 OE1 GLU A 84 -3.041 -19.496 -1.121 1.00 0.00 O ATOM 1265 OE2 GLU A 84 -1.000 -18.709 -1.300 1.00 0.00 O ATOM 0 H GLU A 84 -6.147 -15.739 -2.105 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.372 -15.181 0.010 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.801 -17.423 -1.053 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.859 -16.898 -2.435 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.927 -16.456 -0.855 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.878 -17.175 0.428 1.00 0.00 H new ATOM 1272 N ASP A 85 -3.630 -13.939 -2.928 1.00 0.00 N ATOM 1273 CA ASP A 85 -2.741 -13.011 -3.623 1.00 0.00 C ATOM 1274 C ASP A 85 -2.593 -11.730 -2.805 1.00 0.00 C ATOM 1275 O ASP A 85 -1.484 -11.242 -2.577 1.00 0.00 O ATOM 1276 CB ASP A 85 -3.292 -12.693 -5.016 1.00 0.00 C ATOM 1277 CG ASP A 85 -2.233 -12.164 -5.963 1.00 0.00 C ATOM 1278 OD1 ASP A 85 -1.336 -12.948 -6.345 1.00 0.00 O ATOM 1279 OD2 ASP A 85 -2.306 -10.979 -6.349 1.00 0.00 O ATOM 0 H ASP A 85 -4.456 -14.212 -3.460 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.761 -13.474 -3.737 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -3.734 -13.594 -5.441 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.091 -11.958 -4.926 1.00 0.00 H new ATOM 1284 N VAL A 86 -3.723 -11.223 -2.327 1.00 0.00 N ATOM 1285 CA VAL A 86 -3.740 -10.046 -1.468 1.00 0.00 C ATOM 1286 C VAL A 86 -3.127 -10.379 -0.105 1.00 0.00 C ATOM 1287 O VAL A 86 -2.462 -9.547 0.515 1.00 0.00 O ATOM 1288 CB VAL A 86 -5.180 -9.509 -1.275 1.00 0.00 C ATOM 1289 CG1 VAL A 86 -5.187 -8.239 -0.436 1.00 0.00 C ATOM 1290 CG2 VAL A 86 -5.843 -9.260 -2.622 1.00 0.00 C ATOM 0 H VAL A 86 -4.646 -11.612 -2.522 1.00 0.00 H new ATOM 0 HA VAL A 86 -3.148 -9.270 -1.954 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.751 -10.268 -0.740 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.212 -7.886 -0.318 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.760 -8.449 0.545 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.594 -7.471 -0.933 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -6.854 -8.883 -2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.264 -8.525 -3.182 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.886 -10.193 -3.184 1.00 0.00 H new ATOM 1300 N ALA A 87 -3.342 -11.612 0.342 1.00 0.00 N ATOM 1301 CA ALA A 87 -2.795 -12.082 1.609 1.00 0.00 C ATOM 1302 C ALA A 87 -1.271 -12.138 1.561 1.00 0.00 C ATOM 1303 O ALA A 87 -0.601 -11.862 2.557 1.00 0.00 O ATOM 1304 CB ALA A 87 -3.365 -13.448 1.958 1.00 0.00 C ATOM 0 H ALA A 87 -3.895 -12.308 -0.159 1.00 0.00 H new ATOM 0 HA ALA A 87 -3.083 -11.373 2.385 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.947 -13.785 2.906 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.449 -13.379 2.044 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -3.108 -14.161 1.174 1.00 0.00 H new ATOM 1310 N ARG A 88 -0.726 -12.496 0.401 1.00 0.00 N ATOM 1311 CA ARG A 88 0.721 -12.525 0.218 1.00 0.00 C ATOM 1312 C ARG A 88 1.267 -11.104 0.219 1.00 0.00 C ATOM 1313 O ARG A 88 2.377 -10.858 0.686 1.00 0.00 O ATOM 1314 CB ARG A 88 1.119 -13.221 -1.092 1.00 0.00 C ATOM 1315 CG ARG A 88 0.464 -14.578 -1.316 1.00 0.00 C ATOM 1316 CD ARG A 88 0.602 -15.501 -0.114 1.00 0.00 C ATOM 1317 NE ARG A 88 1.988 -15.897 0.144 1.00 0.00 N ATOM 1318 CZ ARG A 88 2.420 -17.160 0.094 1.00 0.00 C ATOM 1319 NH1 ARG A 88 1.602 -18.133 -0.291 1.00 0.00 N ATOM 1320 NH2 ARG A 88 3.675 -17.449 0.422 1.00 0.00 N ATOM 0 H ARG A 88 -1.263 -12.769 -0.422 1.00 0.00 H new ATOM 0 HA ARG A 88 1.146 -13.094 1.045 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.864 -12.568 -1.927 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.201 -13.348 -1.106 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -0.593 -14.434 -1.539 1.00 0.00 H new ATOM 0 HG3 ARG A 88 0.912 -15.054 -2.188 1.00 0.00 H new ATOM 0 HD2 ARG A 88 0.202 -15.002 0.769 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.001 -16.394 -0.277 1.00 0.00 H new ATOM 0 HE ARG A 88 2.662 -15.167 0.375 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.639 -17.917 -0.550 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.937 -19.096 -0.328 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.310 -16.706 0.713 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.003 -18.414 0.383 1.00 0.00 H new ATOM 1334 N LEU A 89 0.471 -10.178 -0.307 1.00 0.00 N ATOM 1335 CA LEU A 89 0.835 -8.764 -0.327 1.00 0.00 C ATOM 1336 C LEU A 89 0.917 -8.223 1.100 1.00 0.00 C ATOM 1337 O LEU A 89 1.884 -7.552 1.464 1.00 0.00 O ATOM 1338 CB LEU A 89 -0.194 -7.979 -1.159 1.00 0.00 C ATOM 1339 CG LEU A 89 0.187 -6.540 -1.541 1.00 0.00 C ATOM 1340 CD1 LEU A 89 -0.638 -6.077 -2.731 1.00 0.00 C ATOM 1341 CD2 LEU A 89 -0.022 -5.584 -0.375 1.00 0.00 C ATOM 0 H LEU A 89 -0.435 -10.383 -0.727 1.00 0.00 H new ATOM 0 HA LEU A 89 1.815 -8.646 -0.788 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.387 -8.536 -2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -1.130 -7.948 -0.602 1.00 0.00 H new ATOM 0 HG LEU A 89 1.245 -6.536 -1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.359 -5.056 -2.992 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.451 -6.733 -3.581 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.697 -6.109 -2.474 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.257 -4.575 -0.678 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -1.070 -5.597 -0.077 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.598 -5.895 0.466 1.00 0.00 H new ATOM 1353 N PHE A 90 -0.094 -8.529 1.907 1.00 0.00 N ATOM 1354 CA PHE A 90 -0.116 -8.092 3.300 1.00 0.00 C ATOM 1355 C PHE A 90 1.022 -8.745 4.082 1.00 0.00 C ATOM 1356 O PHE A 90 1.596 -8.139 4.987 1.00 0.00 O ATOM 1357 CB PHE A 90 -1.468 -8.408 3.948 1.00 0.00 C ATOM 1358 CG PHE A 90 -1.583 -7.933 5.373 1.00 0.00 C ATOM 1359 CD1 PHE A 90 -1.628 -6.578 5.670 1.00 0.00 C ATOM 1360 CD2 PHE A 90 -1.647 -8.843 6.414 1.00 0.00 C ATOM 1361 CE1 PHE A 90 -1.732 -6.144 6.977 1.00 0.00 C ATOM 1362 CE2 PHE A 90 -1.751 -8.414 7.726 1.00 0.00 C ATOM 1363 CZ PHE A 90 -1.795 -7.062 8.006 1.00 0.00 C ATOM 0 H PHE A 90 -0.907 -9.076 1.622 1.00 0.00 H new ATOM 0 HA PHE A 90 0.026 -7.011 3.322 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.260 -7.949 3.357 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.632 -9.485 3.919 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.581 -5.854 4.870 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.615 -9.901 6.200 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.764 -5.087 7.194 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.798 -9.135 8.529 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.879 -6.724 9.028 1.00 0.00 H new ATOM 1373 N ALA A 91 1.356 -9.978 3.722 1.00 0.00 N ATOM 1374 CA ALA A 91 2.483 -10.662 4.334 1.00 0.00 C ATOM 1375 C ALA A 91 3.789 -9.979 3.942 1.00 0.00 C ATOM 1376 O ALA A 91 4.675 -9.788 4.772 1.00 0.00 O ATOM 1377 CB ALA A 91 2.499 -12.128 3.928 1.00 0.00 C ATOM 0 H ALA A 91 0.864 -10.521 3.012 1.00 0.00 H new ATOM 0 HA ALA A 91 2.378 -10.610 5.418 1.00 0.00 H new ATOM 0 HB1 ALA A 91 3.349 -12.626 4.395 1.00 0.00 H new ATOM 0 HB2 ALA A 91 1.575 -12.606 4.254 1.00 0.00 H new ATOM 0 HB3 ALA A 91 2.584 -12.204 2.844 1.00 0.00 H new ATOM 1383 N LEU A 92 3.881 -9.590 2.675 1.00 0.00 N ATOM 1384 CA LEU A 92 5.070 -8.931 2.143 1.00 0.00 C ATOM 1385 C LEU A 92 5.352 -7.641 2.907 1.00 0.00 C ATOM 1386 O LEU A 92 6.464 -7.432 3.395 1.00 0.00 O ATOM 1387 CB LEU A 92 4.879 -8.651 0.642 1.00 0.00 C ATOM 1388 CG LEU A 92 6.118 -8.168 -0.128 1.00 0.00 C ATOM 1389 CD1 LEU A 92 5.954 -8.459 -1.611 1.00 0.00 C ATOM 1390 CD2 LEU A 92 6.347 -6.676 0.076 1.00 0.00 C ATOM 0 H LEU A 92 3.137 -9.722 1.990 1.00 0.00 H new ATOM 0 HA LEU A 92 5.930 -9.588 2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.517 -9.563 0.168 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.095 -7.902 0.532 1.00 0.00 H new ATOM 0 HG LEU A 92 6.984 -8.705 0.258 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.837 -8.113 -2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.835 -9.532 -1.760 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.073 -7.940 -1.988 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.230 -6.364 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.479 -6.122 -0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.496 -6.472 1.136 1.00 0.00 H new ATOM 1402 N VAL A 93 4.337 -6.789 3.027 1.00 0.00 N ATOM 1403 CA VAL A 93 4.499 -5.503 3.700 1.00 0.00 C ATOM 1404 C VAL A 93 4.824 -5.688 5.183 1.00 0.00 C ATOM 1405 O VAL A 93 5.535 -4.876 5.781 1.00 0.00 O ATOM 1406 CB VAL A 93 3.248 -4.604 3.546 1.00 0.00 C ATOM 1407 CG1 VAL A 93 2.971 -4.323 2.081 1.00 0.00 C ATOM 1408 CG2 VAL A 93 2.029 -5.230 4.204 1.00 0.00 C ATOM 0 H VAL A 93 3.398 -6.964 2.669 1.00 0.00 H new ATOM 0 HA VAL A 93 5.337 -5.004 3.214 1.00 0.00 H new ATOM 0 HB VAL A 93 3.454 -3.661 4.052 1.00 0.00 H new ATOM 0 HG11 VAL A 93 2.088 -3.690 1.993 1.00 0.00 H new ATOM 0 HG12 VAL A 93 3.828 -3.814 1.640 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.797 -5.263 1.557 1.00 0.00 H new ATOM 0 HG21 VAL A 93 1.169 -4.572 4.077 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.820 -6.194 3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 93 2.222 -5.373 5.267 1.00 0.00 H new ATOM 1418 N GLN A 94 4.323 -6.769 5.766 1.00 0.00 N ATOM 1419 CA GLN A 94 4.568 -7.054 7.168 1.00 0.00 C ATOM 1420 C GLN A 94 6.014 -7.505 7.367 1.00 0.00 C ATOM 1421 O GLN A 94 6.690 -7.066 8.297 1.00 0.00 O ATOM 1422 CB GLN A 94 3.601 -8.130 7.667 1.00 0.00 C ATOM 1423 CG GLN A 94 3.580 -8.278 9.176 1.00 0.00 C ATOM 1424 CD GLN A 94 2.700 -9.424 9.636 1.00 0.00 C ATOM 1425 OE1 GLN A 94 3.162 -10.555 9.790 1.00 0.00 O ATOM 1426 NE2 GLN A 94 1.426 -9.146 9.855 1.00 0.00 N ATOM 0 H GLN A 94 3.745 -7.461 5.288 1.00 0.00 H new ATOM 0 HA GLN A 94 4.403 -6.145 7.746 1.00 0.00 H new ATOM 0 HB2 GLN A 94 2.596 -7.892 7.320 1.00 0.00 H new ATOM 0 HB3 GLN A 94 3.874 -9.086 7.221 1.00 0.00 H new ATOM 0 HG2 GLN A 94 4.596 -8.438 9.536 1.00 0.00 H new ATOM 0 HG3 GLN A 94 3.225 -7.350 9.624 1.00 0.00 H new ATOM 0 HE21 GLN A 94 1.080 -8.197 9.716 1.00 0.00 H new ATOM 0 HE22 GLN A 94 0.789 -9.881 10.163 1.00 0.00 H new ATOM 1435 N VAL A 95 6.486 -8.368 6.468 1.00 0.00 N ATOM 1436 CA VAL A 95 7.848 -8.891 6.538 1.00 0.00 C ATOM 1437 C VAL A 95 8.882 -7.783 6.365 1.00 0.00 C ATOM 1438 O VAL A 95 9.836 -7.693 7.143 1.00 0.00 O ATOM 1439 CB VAL A 95 8.096 -9.996 5.482 1.00 0.00 C ATOM 1440 CG1 VAL A 95 9.560 -10.410 5.454 1.00 0.00 C ATOM 1441 CG2 VAL A 95 7.214 -11.205 5.757 1.00 0.00 C ATOM 0 H VAL A 95 5.942 -8.720 5.680 1.00 0.00 H new ATOM 0 HA VAL A 95 7.959 -9.327 7.531 1.00 0.00 H new ATOM 0 HB VAL A 95 7.839 -9.587 4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 95 9.704 -11.187 4.703 1.00 0.00 H new ATOM 0 HG12 VAL A 95 10.178 -9.547 5.206 1.00 0.00 H new ATOM 0 HG13 VAL A 95 9.849 -10.793 6.433 1.00 0.00 H new ATOM 0 HG21 VAL A 95 7.402 -11.971 5.005 1.00 0.00 H new ATOM 0 HG22 VAL A 95 7.441 -11.604 6.746 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.166 -10.907 5.718 1.00 0.00 H new ATOM 1451 N VAL A 96 8.685 -6.929 5.361 1.00 0.00 N ATOM 1452 CA VAL A 96 9.640 -5.862 5.081 1.00 0.00 C ATOM 1453 C VAL A 96 9.702 -4.869 6.243 1.00 0.00 C ATOM 1454 O VAL A 96 10.770 -4.363 6.578 1.00 0.00 O ATOM 1455 CB VAL A 96 9.327 -5.122 3.753 1.00 0.00 C ATOM 1456 CG1 VAL A 96 7.963 -4.448 3.790 1.00 0.00 C ATOM 1457 CG2 VAL A 96 10.414 -4.107 3.434 1.00 0.00 C ATOM 0 H VAL A 96 7.880 -6.956 4.735 1.00 0.00 H new ATOM 0 HA VAL A 96 10.616 -6.334 4.966 1.00 0.00 H new ATOM 0 HB VAL A 96 9.303 -5.871 2.961 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.782 -3.941 2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 96 7.190 -5.199 3.953 1.00 0.00 H new ATOM 0 HG13 VAL A 96 7.939 -3.720 4.601 1.00 0.00 H new ATOM 0 HG21 VAL A 96 10.175 -3.600 2.499 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.476 -3.375 4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 96 11.371 -4.618 3.335 1.00 0.00 H new ATOM 1467 N ALA A 97 8.562 -4.612 6.875 1.00 0.00 N ATOM 1468 CA ALA A 97 8.526 -3.740 8.040 1.00 0.00 C ATOM 1469 C ALA A 97 9.248 -4.392 9.215 1.00 0.00 C ATOM 1470 O ALA A 97 10.083 -3.769 9.875 1.00 0.00 O ATOM 1471 CB ALA A 97 7.089 -3.417 8.415 1.00 0.00 C ATOM 0 H ALA A 97 7.656 -4.993 6.601 1.00 0.00 H new ATOM 0 HA ALA A 97 9.037 -2.810 7.792 1.00 0.00 H new ATOM 0 HB1 ALA A 97 7.079 -2.764 9.288 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.599 -2.915 7.581 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.557 -4.340 8.646 1.00 0.00 H new ATOM 1477 N ASP A 98 8.929 -5.662 9.438 1.00 0.00 N ATOM 1478 CA ASP A 98 9.489 -6.447 10.537 1.00 0.00 C ATOM 1479 C ASP A 98 11.015 -6.451 10.526 1.00 0.00 C ATOM 1480 O ASP A 98 11.648 -6.148 11.539 1.00 0.00 O ATOM 1481 CB ASP A 98 8.967 -7.885 10.439 1.00 0.00 C ATOM 1482 CG ASP A 98 9.583 -8.823 11.460 1.00 0.00 C ATOM 1483 OD1 ASP A 98 10.653 -9.406 11.171 1.00 0.00 O ATOM 1484 OD2 ASP A 98 8.981 -9.015 12.534 1.00 0.00 O ATOM 0 H ASP A 98 8.270 -6.181 8.858 1.00 0.00 H new ATOM 0 HA ASP A 98 9.174 -5.987 11.474 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.885 -7.880 10.568 1.00 0.00 H new ATOM 0 HB3 ASP A 98 9.167 -8.268 9.438 1.00 0.00 H new ATOM 1489 N GLU A 99 11.600 -6.758 9.371 1.00 0.00 N ATOM 1490 CA GLU A 99 13.037 -7.002 9.284 1.00 0.00 C ATOM 1491 C GLU A 99 13.876 -5.789 9.690 1.00 0.00 C ATOM 1492 O GLU A 99 14.956 -5.951 10.257 1.00 0.00 O ATOM 1493 CB GLU A 99 13.436 -7.458 7.880 1.00 0.00 C ATOM 1494 CG GLU A 99 13.209 -6.423 6.792 1.00 0.00 C ATOM 1495 CD GLU A 99 14.014 -6.722 5.547 1.00 0.00 C ATOM 1496 OE1 GLU A 99 13.762 -7.763 4.907 1.00 0.00 O ATOM 1497 OE2 GLU A 99 14.927 -5.933 5.224 1.00 0.00 O ATOM 0 H GLU A 99 11.103 -6.844 8.485 1.00 0.00 H new ATOM 0 HA GLU A 99 13.247 -7.798 9.998 1.00 0.00 H new ATOM 0 HB2 GLU A 99 14.491 -7.733 7.887 1.00 0.00 H new ATOM 0 HB3 GLU A 99 12.874 -8.358 7.631 1.00 0.00 H new ATOM 0 HG2 GLU A 99 12.149 -6.390 6.539 1.00 0.00 H new ATOM 0 HG3 GLU A 99 13.478 -5.436 7.169 1.00 0.00 H new ATOM 1504 N HIS A 100 13.402 -4.579 9.410 1.00 0.00 N ATOM 1505 CA HIS A 100 14.194 -3.394 9.735 1.00 0.00 C ATOM 1506 C HIS A 100 13.742 -2.770 11.048 1.00 0.00 C ATOM 1507 O HIS A 100 14.341 -1.803 11.519 1.00 0.00 O ATOM 1508 CB HIS A 100 14.176 -2.346 8.604 1.00 0.00 C ATOM 1509 CG HIS A 100 12.857 -1.668 8.378 1.00 0.00 C ATOM 1510 ND1 HIS A 100 12.379 -0.650 9.176 1.00 0.00 N ATOM 1511 CD2 HIS A 100 11.927 -1.849 7.416 1.00 0.00 C ATOM 1512 CE1 HIS A 100 11.214 -0.245 8.718 1.00 0.00 C ATOM 1513 NE2 HIS A 100 10.914 -0.952 7.646 1.00 0.00 N ATOM 0 H HIS A 100 12.500 -4.393 8.971 1.00 0.00 H new ATOM 0 HA HIS A 100 15.224 -3.732 9.848 1.00 0.00 H new ATOM 0 HB2 HIS A 100 14.924 -1.585 8.825 1.00 0.00 H new ATOM 0 HB3 HIS A 100 14.480 -2.831 7.677 1.00 0.00 H new ATOM 0 HD2 HIS A 100 11.972 -2.569 6.612 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.605 0.536 9.148 1.00 0.00 H new ATOM 0 HE2 HIS A 100 10.070 -0.849 7.082 1.00 0.00 H new ATOM 1522 N LEU A 101 12.688 -3.324 11.639 1.00 0.00 N ATOM 1523 CA LEU A 101 12.212 -2.848 12.929 1.00 0.00 C ATOM 1524 C LEU A 101 12.980 -3.544 14.042 1.00 0.00 C ATOM 1525 O LEU A 101 13.277 -2.947 15.079 1.00 0.00 O ATOM 1526 CB LEU A 101 10.708 -3.093 13.087 1.00 0.00 C ATOM 1527 CG LEU A 101 10.082 -2.475 14.340 1.00 0.00 C ATOM 1528 CD1 LEU A 101 10.230 -0.961 14.320 1.00 0.00 C ATOM 1529 CD2 LEU A 101 8.616 -2.865 14.449 1.00 0.00 C ATOM 0 H LEU A 101 12.152 -4.098 11.247 1.00 0.00 H new ATOM 0 HA LEU A 101 12.382 -1.773 12.988 1.00 0.00 H new ATOM 0 HB2 LEU A 101 10.196 -2.697 12.210 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.529 -4.168 13.102 1.00 0.00 H new ATOM 0 HG LEU A 101 10.608 -2.860 15.213 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.779 -0.539 15.218 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.288 -0.699 14.288 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.729 -0.558 13.440 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.186 -2.417 15.345 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.078 -2.507 13.571 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.532 -3.950 14.509 1.00 0.00 H new ATOM 1541 N GLU A 102 13.308 -4.810 13.821 1.00 0.00 N ATOM 1542 CA GLU A 102 14.149 -5.536 14.754 1.00 0.00 C ATOM 1543 C GLU A 102 15.610 -5.165 14.528 1.00 0.00 C ATOM 1544 O GLU A 102 15.950 -4.498 13.547 1.00 0.00 O ATOM 1545 CB GLU A 102 13.972 -7.047 14.609 1.00 0.00 C ATOM 1546 CG GLU A 102 14.437 -7.592 13.270 1.00 0.00 C ATOM 1547 CD GLU A 102 14.851 -9.042 13.359 1.00 0.00 C ATOM 1548 OE1 GLU A 102 16.022 -9.305 13.685 1.00 0.00 O ATOM 1549 OE2 GLU A 102 14.014 -9.931 13.112 1.00 0.00 O ATOM 0 H GLU A 102 13.006 -5.349 13.010 1.00 0.00 H new ATOM 0 HA GLU A 102 13.849 -5.257 15.764 1.00 0.00 H new ATOM 0 HB2 GLU A 102 14.524 -7.546 15.406 1.00 0.00 H new ATOM 0 HB3 GLU A 102 12.920 -7.295 14.746 1.00 0.00 H new ATOM 0 HG2 GLU A 102 13.635 -7.489 12.539 1.00 0.00 H new ATOM 0 HG3 GLU A 102 15.276 -6.997 12.909 1.00 0.00 H new ATOM 1556 N HIS A 103 16.471 -5.602 15.428 1.00 0.00 N ATOM 1557 CA HIS A 103 17.881 -5.265 15.355 1.00 0.00 C ATOM 1558 C HIS A 103 18.727 -6.496 15.671 1.00 0.00 C ATOM 1559 O HIS A 103 19.923 -6.394 15.952 1.00 0.00 O ATOM 1560 CB HIS A 103 18.172 -4.123 16.337 1.00 0.00 C ATOM 1561 CG HIS A 103 19.462 -3.407 16.095 1.00 0.00 C ATOM 1562 ND1 HIS A 103 19.685 -2.621 14.990 1.00 0.00 N ATOM 1563 CD2 HIS A 103 20.585 -3.330 16.843 1.00 0.00 C ATOM 1564 CE1 HIS A 103 20.888 -2.090 15.066 1.00 0.00 C ATOM 1565 NE2 HIS A 103 21.459 -2.501 16.183 1.00 0.00 N ATOM 0 H HIS A 103 16.218 -6.193 16.220 1.00 0.00 H new ATOM 0 HA HIS A 103 18.136 -4.935 14.348 1.00 0.00 H new ATOM 0 HB2 HIS A 103 17.356 -3.402 16.287 1.00 0.00 H new ATOM 0 HB3 HIS A 103 18.180 -4.526 17.350 1.00 0.00 H new ATOM 0 HD2 HIS A 103 20.762 -3.828 17.785 1.00 0.00 H new ATOM 0 HE1 HIS A 103 21.333 -1.429 14.337 1.00 0.00 H new ATOM 0 HE2 HIS A 103 22.393 -2.246 16.503 1.00 0.00 H new ATOM 1574 N HIS A 104 18.098 -7.666 15.593 1.00 0.00 N ATOM 1575 CA HIS A 104 18.760 -8.914 15.951 1.00 0.00 C ATOM 1576 C HIS A 104 19.406 -9.549 14.721 1.00 0.00 C ATOM 1577 O HIS A 104 20.561 -9.974 14.766 1.00 0.00 O ATOM 1578 CB HIS A 104 17.756 -9.880 16.588 1.00 0.00 C ATOM 1579 CG HIS A 104 18.393 -11.045 17.284 1.00 0.00 C ATOM 1580 ND1 HIS A 104 18.028 -12.354 17.059 1.00 0.00 N ATOM 1581 CD2 HIS A 104 19.360 -11.085 18.227 1.00 0.00 C ATOM 1582 CE1 HIS A 104 18.743 -13.145 17.835 1.00 0.00 C ATOM 1583 NE2 HIS A 104 19.560 -12.401 18.556 1.00 0.00 N ATOM 0 H HIS A 104 17.132 -7.774 15.285 1.00 0.00 H new ATOM 0 HA HIS A 104 19.544 -8.697 16.676 1.00 0.00 H new ATOM 0 HB2 HIS A 104 17.143 -9.332 17.304 1.00 0.00 H new ATOM 0 HB3 HIS A 104 17.085 -10.254 15.815 1.00 0.00 H new ATOM 0 HD2 HIS A 104 19.880 -10.236 18.645 1.00 0.00 H new ATOM 0 HE1 HIS A 104 18.672 -14.222 17.874 1.00 0.00 H new ATOM 0 HE2 HIS A 104 20.229 -12.747 19.244 1.00 0.00 H new ATOM 1592 N HIS A 105 18.656 -9.621 13.630 1.00 0.00 N ATOM 1593 CA HIS A 105 19.192 -10.132 12.374 1.00 0.00 C ATOM 1594 C HIS A 105 20.097 -9.096 11.727 1.00 0.00 C ATOM 1595 O HIS A 105 19.628 -8.178 11.052 1.00 0.00 O ATOM 1596 CB HIS A 105 18.071 -10.514 11.401 1.00 0.00 C ATOM 1597 CG HIS A 105 17.347 -11.778 11.748 1.00 0.00 C ATOM 1598 ND1 HIS A 105 16.198 -11.805 12.503 1.00 0.00 N ATOM 1599 CD2 HIS A 105 17.603 -13.063 11.413 1.00 0.00 C ATOM 1600 CE1 HIS A 105 15.777 -13.050 12.617 1.00 0.00 C ATOM 1601 NE2 HIS A 105 16.612 -13.837 11.962 1.00 0.00 N ATOM 0 H HIS A 105 17.678 -9.334 13.588 1.00 0.00 H new ATOM 0 HA HIS A 105 19.769 -11.028 12.602 1.00 0.00 H new ATOM 0 HB2 HIS A 105 17.350 -9.698 11.360 1.00 0.00 H new ATOM 0 HB3 HIS A 105 18.494 -10.616 10.402 1.00 0.00 H new ATOM 0 HD2 HIS A 105 18.435 -13.415 10.822 1.00 0.00 H new ATOM 0 HE1 HIS A 105 14.898 -13.372 13.155 1.00 0.00 H new ATOM 0 HE2 HIS A 105 16.533 -14.851 11.878 1.00 0.00 H new ATOM 1610 N HIS A 106 21.393 -9.230 11.961 1.00 0.00 N ATOM 1611 CA HIS A 106 22.369 -8.341 11.349 1.00 0.00 C ATOM 1612 C HIS A 106 23.346 -9.152 10.506 1.00 0.00 C ATOM 1613 O HIS A 106 24.222 -8.606 9.837 1.00 0.00 O ATOM 1614 CB HIS A 106 23.109 -7.536 12.424 1.00 0.00 C ATOM 1615 CG HIS A 106 23.935 -6.415 11.871 1.00 0.00 C ATOM 1616 ND1 HIS A 106 23.385 -5.271 11.336 1.00 0.00 N ATOM 1617 CD2 HIS A 106 25.274 -6.271 11.761 1.00 0.00 C ATOM 1618 CE1 HIS A 106 24.351 -4.476 10.915 1.00 0.00 C ATOM 1619 NE2 HIS A 106 25.508 -5.059 11.162 1.00 0.00 N ATOM 0 H HIS A 106 21.793 -9.944 12.569 1.00 0.00 H new ATOM 0 HA HIS A 106 21.852 -7.635 10.700 1.00 0.00 H new ATOM 0 HB2 HIS A 106 22.382 -7.128 13.126 1.00 0.00 H new ATOM 0 HB3 HIS A 106 23.755 -8.208 12.989 1.00 0.00 H new ATOM 0 HD2 HIS A 106 26.022 -6.979 12.085 1.00 0.00 H new ATOM 0 HE1 HIS A 106 24.217 -3.512 10.448 1.00 0.00 H new ATOM 0 HE2 HIS A 106 26.426 -4.672 10.944 1.00 0.00 H new ATOM 1628 N HIS A 107 23.182 -10.467 10.545 1.00 0.00 N ATOM 1629 CA HIS A 107 23.998 -11.367 9.742 1.00 0.00 C ATOM 1630 C HIS A 107 23.283 -11.685 8.437 1.00 0.00 C ATOM 1631 O HIS A 107 22.095 -11.397 8.288 1.00 0.00 O ATOM 1632 CB HIS A 107 24.291 -12.658 10.510 1.00 0.00 C ATOM 1633 CG HIS A 107 25.233 -12.470 11.656 1.00 0.00 C ATOM 1634 ND1 HIS A 107 24.822 -12.127 12.926 1.00 0.00 N ATOM 1635 CD2 HIS A 107 26.578 -12.576 11.715 1.00 0.00 C ATOM 1636 CE1 HIS A 107 25.876 -12.026 13.714 1.00 0.00 C ATOM 1637 NE2 HIS A 107 26.955 -12.294 13.003 1.00 0.00 N ATOM 0 H HIS A 107 22.488 -10.936 11.127 1.00 0.00 H new ATOM 0 HA HIS A 107 24.946 -10.876 9.521 1.00 0.00 H new ATOM 0 HB2 HIS A 107 23.354 -13.069 10.884 1.00 0.00 H new ATOM 0 HB3 HIS A 107 24.710 -13.393 9.823 1.00 0.00 H new ATOM 0 HD2 HIS A 107 27.236 -12.835 10.898 1.00 0.00 H new ATOM 0 HE1 HIS A 107 25.858 -11.768 14.763 1.00 0.00 H new ATOM 0 HE2 HIS A 107 27.913 -12.292 13.354 1.00 0.00 H new ATOM 1646 N HIS A 108 24.005 -12.262 7.491 1.00 0.00 N ATOM 1647 CA HIS A 108 23.430 -12.594 6.197 1.00 0.00 C ATOM 1648 C HIS A 108 23.629 -14.074 5.902 1.00 0.00 C ATOM 1649 O HIS A 108 24.741 -14.448 5.485 1.00 0.00 O ATOM 1650 CB HIS A 108 24.071 -11.743 5.095 1.00 0.00 C ATOM 1651 CG HIS A 108 23.377 -11.842 3.768 1.00 0.00 C ATOM 1652 ND1 HIS A 108 22.665 -10.800 3.217 1.00 0.00 N ATOM 1653 CD2 HIS A 108 23.290 -12.861 2.880 1.00 0.00 C ATOM 1654 CE1 HIS A 108 22.169 -11.172 2.055 1.00 0.00 C ATOM 1655 NE2 HIS A 108 22.533 -12.418 1.825 1.00 0.00 N ATOM 1656 OXT HIS A 108 22.672 -14.856 6.083 1.00 0.00 O ATOM 0 H HIS A 108 24.989 -12.510 7.594 1.00 0.00 H new ATOM 0 HA HIS A 108 22.361 -12.380 6.223 1.00 0.00 H new ATOM 0 HB2 HIS A 108 24.079 -10.700 5.413 1.00 0.00 H new ATOM 0 HB3 HIS A 108 25.111 -12.047 4.974 1.00 0.00 H new ATOM 0 HD2 HIS A 108 23.734 -13.840 2.983 1.00 0.00 H new ATOM 0 HE1 HIS A 108 21.566 -10.560 1.401 1.00 0.00 H new ATOM 0 HE2 HIS A 108 22.291 -12.964 0.998 1.00 0.00 H new TER 1665 HIS A 108 ATOM 1666 N MET B 1 5.412 -7.854 22.812 1.00 0.00 N ATOM 1667 CA MET B 1 4.131 -8.299 22.220 1.00 0.00 C ATOM 1668 C MET B 1 3.011 -7.341 22.603 1.00 0.00 C ATOM 1669 O MET B 1 2.424 -6.688 21.742 1.00 0.00 O ATOM 1670 CB MET B 1 3.797 -9.717 22.698 1.00 0.00 C ATOM 1671 CG MET B 1 2.453 -10.236 22.208 1.00 0.00 C ATOM 1672 SD MET B 1 2.061 -11.868 22.871 1.00 0.00 S ATOM 1673 CE MET B 1 0.397 -12.099 22.249 1.00 0.00 C ATOM 0 H1 MET B 1 6.167 -8.516 22.543 1.00 0.00 H new ATOM 0 H2 MET B 1 5.644 -6.903 22.462 1.00 0.00 H new ATOM 0 H3 MET B 1 5.326 -7.830 23.848 1.00 0.00 H new ATOM 0 HA MET B 1 4.230 -8.305 21.134 1.00 0.00 H new ATOM 0 HB2 MET B 1 4.581 -10.396 22.363 1.00 0.00 H new ATOM 0 HB3 MET B 1 3.806 -9.733 23.788 1.00 0.00 H new ATOM 0 HG2 MET B 1 1.670 -9.534 22.493 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.460 -10.281 21.119 1.00 0.00 H new ATOM 0 HE1 MET B 1 0.017 -13.067 22.577 1.00 0.00 H new ATOM 0 HE2 MET B 1 -0.248 -11.308 22.632 1.00 0.00 H new ATOM 0 HE3 MET B 1 0.408 -12.063 21.160 1.00 0.00 H new ATOM 1685 N ALA B 2 2.743 -7.236 23.898 1.00 0.00 N ATOM 1686 CA ALA B 2 1.667 -6.390 24.392 1.00 0.00 C ATOM 1687 C ALA B 2 2.167 -5.515 25.534 1.00 0.00 C ATOM 1688 O ALA B 2 3.376 -5.353 25.717 1.00 0.00 O ATOM 1689 CB ALA B 2 0.496 -7.251 24.847 1.00 0.00 C ATOM 0 H ALA B 2 3.259 -7.729 24.627 1.00 0.00 H new ATOM 0 HA ALA B 2 1.327 -5.740 23.586 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -0.305 -6.610 25.215 1.00 0.00 H new ATOM 0 HB2 ALA B 2 0.131 -7.842 24.007 1.00 0.00 H new ATOM 0 HB3 ALA B 2 0.823 -7.918 25.645 1.00 0.00 H new ATOM 1695 N GLY B 3 1.242 -4.939 26.288 1.00 0.00 N ATOM 1696 CA GLY B 3 1.613 -4.154 27.447 1.00 0.00 C ATOM 1697 C GLY B 3 1.852 -2.704 27.096 1.00 0.00 C ATOM 1698 O GLY B 3 0.921 -1.898 27.086 1.00 0.00 O ATOM 0 H GLY B 3 0.238 -5.002 26.117 1.00 0.00 H new ATOM 0 HA2 GLY B 3 0.825 -4.220 28.197 1.00 0.00 H new ATOM 0 HA3 GLY B 3 2.515 -4.572 27.894 1.00 0.00 H new ATOM 1702 N GLN B 4 3.097 -2.370 26.798 1.00 0.00 N ATOM 1703 CA GLN B 4 3.443 -1.017 26.397 1.00 0.00 C ATOM 1704 C GLN B 4 3.591 -0.948 24.884 1.00 0.00 C ATOM 1705 O GLN B 4 4.254 -1.797 24.288 1.00 0.00 O ATOM 1706 CB GLN B 4 4.734 -0.540 27.080 1.00 0.00 C ATOM 1707 CG GLN B 4 4.613 -0.374 28.591 1.00 0.00 C ATOM 1708 CD GLN B 4 4.644 -1.696 29.332 1.00 0.00 C ATOM 1709 OE1 GLN B 4 5.293 -2.645 28.901 1.00 0.00 O ATOM 1710 NE2 GLN B 4 3.936 -1.770 30.447 1.00 0.00 N ATOM 0 H GLN B 4 3.885 -3.018 26.826 1.00 0.00 H new ATOM 0 HA GLN B 4 2.637 -0.354 26.712 1.00 0.00 H new ATOM 0 HB2 GLN B 4 5.530 -1.253 26.866 1.00 0.00 H new ATOM 0 HB3 GLN B 4 5.033 0.413 26.643 1.00 0.00 H new ATOM 0 HG2 GLN B 4 5.427 0.257 28.949 1.00 0.00 H new ATOM 0 HG3 GLN B 4 3.682 0.145 28.821 1.00 0.00 H new ATOM 0 HE21 GLN B 4 3.410 -0.959 30.772 1.00 0.00 H new ATOM 0 HE22 GLN B 4 3.916 -2.638 30.982 1.00 0.00 H new ATOM 1719 N SER B 5 2.917 0.039 24.289 1.00 0.00 N ATOM 1720 CA SER B 5 2.942 0.330 22.844 1.00 0.00 C ATOM 1721 C SER B 5 2.247 -0.748 21.998 1.00 0.00 C ATOM 1722 O SER B 5 1.554 -0.415 21.038 1.00 0.00 O ATOM 1723 CB SER B 5 4.372 0.606 22.322 1.00 0.00 C ATOM 1724 OG SER B 5 5.190 -0.553 22.310 1.00 0.00 O ATOM 0 H SER B 5 2.319 0.680 24.811 1.00 0.00 H new ATOM 0 HA SER B 5 2.363 1.246 22.727 1.00 0.00 H new ATOM 0 HB2 SER B 5 4.312 1.013 21.312 1.00 0.00 H new ATOM 0 HB3 SER B 5 4.840 1.368 22.945 1.00 0.00 H new ATOM 0 HG SER B 5 4.729 -1.283 22.773 1.00 0.00 H new ATOM 1730 N ASP B 6 2.401 -2.020 22.384 1.00 0.00 N ATOM 1731 CA ASP B 6 1.913 -3.152 21.590 1.00 0.00 C ATOM 1732 C ASP B 6 2.608 -3.165 20.235 1.00 0.00 C ATOM 1733 O ASP B 6 2.139 -2.574 19.266 1.00 0.00 O ATOM 1734 CB ASP B 6 0.386 -3.130 21.424 1.00 0.00 C ATOM 1735 CG ASP B 6 -0.349 -3.361 22.734 1.00 0.00 C ATOM 1736 OD1 ASP B 6 -0.562 -4.534 23.105 1.00 0.00 O ATOM 1737 OD2 ASP B 6 -0.716 -2.367 23.397 1.00 0.00 O ATOM 0 H ASP B 6 2.865 -2.292 23.251 1.00 0.00 H new ATOM 0 HA ASP B 6 2.154 -4.069 22.128 1.00 0.00 H new ATOM 0 HB2 ASP B 6 0.084 -2.169 21.007 1.00 0.00 H new ATOM 0 HB3 ASP B 6 0.091 -3.896 20.707 1.00 0.00 H new ATOM 1742 N ARG B 7 3.741 -3.848 20.183 1.00 0.00 N ATOM 1743 CA ARG B 7 4.647 -3.755 19.044 1.00 0.00 C ATOM 1744 C ARG B 7 4.041 -4.325 17.759 1.00 0.00 C ATOM 1745 O ARG B 7 4.491 -3.998 16.661 1.00 0.00 O ATOM 1746 CB ARG B 7 5.975 -4.436 19.375 1.00 0.00 C ATOM 1747 CG ARG B 7 7.021 -4.301 18.282 1.00 0.00 C ATOM 1748 CD ARG B 7 8.424 -4.273 18.862 1.00 0.00 C ATOM 1749 NE ARG B 7 8.662 -3.060 19.647 1.00 0.00 N ATOM 1750 CZ ARG B 7 9.661 -2.919 20.514 1.00 0.00 C ATOM 1751 NH1 ARG B 7 10.484 -3.933 20.753 1.00 0.00 N ATOM 1752 NH2 ARG B 7 9.833 -1.763 21.144 1.00 0.00 N ATOM 0 H ARG B 7 4.058 -4.477 20.920 1.00 0.00 H new ATOM 0 HA ARG B 7 4.825 -2.697 18.854 1.00 0.00 H new ATOM 0 HB2 ARG B 7 6.370 -4.012 20.298 1.00 0.00 H new ATOM 0 HB3 ARG B 7 5.793 -5.494 19.563 1.00 0.00 H new ATOM 0 HG2 ARG B 7 6.930 -5.133 17.584 1.00 0.00 H new ATOM 0 HG3 ARG B 7 6.841 -3.388 17.714 1.00 0.00 H new ATOM 0 HD2 ARG B 7 8.575 -5.150 19.492 1.00 0.00 H new ATOM 0 HD3 ARG B 7 9.153 -4.332 18.054 1.00 0.00 H new ATOM 0 HE ARG B 7 8.023 -2.275 19.521 1.00 0.00 H new ATOM 0 HH11 ARG B 7 10.351 -4.822 20.271 1.00 0.00 H new ATOM 0 HH12 ARG B 7 11.249 -3.823 21.418 1.00 0.00 H new ATOM 0 HH21 ARG B 7 9.200 -0.984 20.963 1.00 0.00 H new ATOM 0 HH22 ARG B 7 10.599 -1.654 21.809 1.00 0.00 H new ATOM 1766 N LYS B 8 3.011 -5.152 17.877 1.00 0.00 N ATOM 1767 CA LYS B 8 2.333 -5.647 16.688 1.00 0.00 C ATOM 1768 C LYS B 8 1.656 -4.483 15.966 1.00 0.00 C ATOM 1769 O LYS B 8 1.657 -4.409 14.738 1.00 0.00 O ATOM 1770 CB LYS B 8 1.324 -6.745 17.030 1.00 0.00 C ATOM 1771 CG LYS B 8 0.143 -6.279 17.855 1.00 0.00 C ATOM 1772 CD LYS B 8 -0.768 -7.436 18.217 1.00 0.00 C ATOM 1773 CE LYS B 8 -1.618 -7.924 17.043 1.00 0.00 C ATOM 1774 NZ LYS B 8 -0.846 -8.735 16.060 1.00 0.00 N ATOM 0 H LYS B 8 2.633 -5.488 18.763 1.00 0.00 H new ATOM 0 HA LYS B 8 3.075 -6.095 16.026 1.00 0.00 H new ATOM 0 HB2 LYS B 8 0.953 -7.182 16.103 1.00 0.00 H new ATOM 0 HB3 LYS B 8 1.839 -7.538 17.572 1.00 0.00 H new ATOM 0 HG2 LYS B 8 0.500 -5.796 18.765 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -0.420 -5.531 17.297 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -0.163 -8.264 18.588 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -1.425 -7.131 19.031 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -2.447 -8.520 17.425 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -2.052 -7.063 16.534 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -1.490 -9.382 15.562 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -0.389 -8.103 15.371 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -0.119 -9.286 16.559 1.00 0.00 H new ATOM 1788 N ALA B 9 1.129 -3.542 16.747 1.00 0.00 N ATOM 1789 CA ALA B 9 0.485 -2.357 16.198 1.00 0.00 C ATOM 1790 C ALA B 9 1.529 -1.431 15.591 1.00 0.00 C ATOM 1791 O ALA B 9 1.248 -0.689 14.649 1.00 0.00 O ATOM 1792 CB ALA B 9 -0.310 -1.640 17.279 1.00 0.00 C ATOM 0 H ALA B 9 1.137 -3.581 17.766 1.00 0.00 H new ATOM 0 HA ALA B 9 -0.206 -2.661 15.412 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -0.786 -0.756 16.855 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -1.074 -2.310 17.673 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.360 -1.340 18.085 1.00 0.00 H new ATOM 1798 N ALA B 10 2.742 -1.494 16.132 1.00 0.00 N ATOM 1799 CA ALA B 10 3.865 -0.739 15.593 1.00 0.00 C ATOM 1800 C ALA B 10 4.227 -1.246 14.203 1.00 0.00 C ATOM 1801 O ALA B 10 4.704 -0.484 13.359 1.00 0.00 O ATOM 1802 CB ALA B 10 5.066 -0.825 16.524 1.00 0.00 C ATOM 0 H ALA B 10 2.971 -2.063 16.947 1.00 0.00 H new ATOM 0 HA ALA B 10 3.570 0.307 15.513 1.00 0.00 H new ATOM 0 HB1 ALA B 10 5.894 -0.255 16.103 1.00 0.00 H new ATOM 0 HB2 ALA B 10 4.801 -0.415 17.499 1.00 0.00 H new ATOM 0 HB3 ALA B 10 5.364 -1.867 16.638 1.00 0.00 H new ATOM 1808 N LEU B 11 3.979 -2.532 13.960 1.00 0.00 N ATOM 1809 CA LEU B 11 4.200 -3.109 12.643 1.00 0.00 C ATOM 1810 C LEU B 11 3.200 -2.518 11.664 1.00 0.00 C ATOM 1811 O LEU B 11 3.551 -2.131 10.551 1.00 0.00 O ATOM 1812 CB LEU B 11 4.049 -4.632 12.686 1.00 0.00 C ATOM 1813 CG LEU B 11 5.093 -5.370 13.522 1.00 0.00 C ATOM 1814 CD1 LEU B 11 4.719 -6.834 13.668 1.00 0.00 C ATOM 1815 CD2 LEU B 11 6.466 -5.240 12.888 1.00 0.00 C ATOM 0 H LEU B 11 3.627 -3.188 14.657 1.00 0.00 H new ATOM 0 HA LEU B 11 5.215 -2.876 12.320 1.00 0.00 H new ATOM 0 HB2 LEU B 11 3.060 -4.871 13.077 1.00 0.00 H new ATOM 0 HB3 LEU B 11 4.089 -5.013 11.666 1.00 0.00 H new ATOM 0 HG LEU B 11 5.122 -4.918 14.514 1.00 0.00 H new ATOM 0 HD11 LEU B 11 5.474 -7.344 14.266 1.00 0.00 H new ATOM 0 HD12 LEU B 11 3.750 -6.915 14.160 1.00 0.00 H new ATOM 0 HD13 LEU B 11 4.664 -7.296 12.682 1.00 0.00 H new ATOM 0 HD21 LEU B 11 7.199 -5.771 13.495 1.00 0.00 H new ATOM 0 HD22 LEU B 11 6.446 -5.669 11.886 1.00 0.00 H new ATOM 0 HD23 LEU B 11 6.740 -4.187 12.827 1.00 0.00 H new ATOM 1827 N LEU B 12 1.954 -2.421 12.112 1.00 0.00 N ATOM 1828 CA LEU B 12 0.883 -1.855 11.304 1.00 0.00 C ATOM 1829 C LEU B 12 1.146 -0.377 11.035 1.00 0.00 C ATOM 1830 O LEU B 12 0.807 0.141 9.975 1.00 0.00 O ATOM 1831 CB LEU B 12 -0.458 -2.024 12.018 1.00 0.00 C ATOM 1832 CG LEU B 12 -0.805 -3.459 12.421 1.00 0.00 C ATOM 1833 CD1 LEU B 12 -2.132 -3.496 13.160 1.00 0.00 C ATOM 1834 CD2 LEU B 12 -0.851 -4.362 11.196 1.00 0.00 C ATOM 0 H LEU B 12 1.660 -2.730 13.038 1.00 0.00 H new ATOM 0 HA LEU B 12 0.848 -2.384 10.352 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -0.456 -1.403 12.914 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -1.247 -1.645 11.369 1.00 0.00 H new ATOM 0 HG LEU B 12 -0.027 -3.827 13.090 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.364 -4.524 13.440 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -2.066 -2.882 14.058 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.920 -3.109 12.513 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -1.099 -5.378 11.502 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -1.609 -3.997 10.503 1.00 0.00 H new ATOM 0 HD23 LEU B 12 0.122 -4.359 10.705 1.00 0.00 H new ATOM 1846 N ASP B 13 1.752 0.295 12.006 1.00 0.00 N ATOM 1847 CA ASP B 13 2.112 1.704 11.864 1.00 0.00 C ATOM 1848 C ASP B 13 3.158 1.893 10.768 1.00 0.00 C ATOM 1849 O ASP B 13 3.090 2.842 9.985 1.00 0.00 O ATOM 1850 CB ASP B 13 2.635 2.253 13.193 1.00 0.00 C ATOM 1851 CG ASP B 13 3.155 3.676 13.081 1.00 0.00 C ATOM 1852 OD1 ASP B 13 2.336 4.618 13.036 1.00 0.00 O ATOM 1853 OD2 ASP B 13 4.388 3.857 13.053 1.00 0.00 O ATOM 0 H ASP B 13 2.006 -0.114 12.905 1.00 0.00 H new ATOM 0 HA ASP B 13 1.217 2.257 11.580 1.00 0.00 H new ATOM 0 HB2 ASP B 13 1.836 2.221 13.933 1.00 0.00 H new ATOM 0 HB3 ASP B 13 3.434 1.607 13.558 1.00 0.00 H new ATOM 1858 N GLN B 14 4.116 0.975 10.709 1.00 0.00 N ATOM 1859 CA GLN B 14 5.153 1.022 9.689 1.00 0.00 C ATOM 1860 C GLN B 14 4.575 0.657 8.323 1.00 0.00 C ATOM 1861 O GLN B 14 4.936 1.246 7.302 1.00 0.00 O ATOM 1862 CB GLN B 14 6.301 0.079 10.056 1.00 0.00 C ATOM 1863 CG GLN B 14 7.469 0.129 9.085 1.00 0.00 C ATOM 1864 CD GLN B 14 8.103 1.505 8.987 1.00 0.00 C ATOM 1865 OE1 GLN B 14 8.083 2.256 10.078 1.00 0.00 O flip ATOM 1866 NE2 GLN B 14 8.624 1.882 7.935 1.00 0.00 N flip ATOM 0 H GLN B 14 4.195 0.190 11.356 1.00 0.00 H new ATOM 0 HA GLN B 14 5.543 2.038 9.636 1.00 0.00 H new ATOM 0 HB2 GLN B 14 6.660 0.329 11.054 1.00 0.00 H new ATOM 0 HB3 GLN B 14 5.921 -0.942 10.100 1.00 0.00 H new ATOM 0 HG2 GLN B 14 8.225 -0.591 9.398 1.00 0.00 H new ATOM 0 HG3 GLN B 14 7.126 -0.178 8.097 1.00 0.00 H new ATOM 0 HE21 GLN B 14 8.618 1.273 7.116 1.00 0.00 H new ATOM 0 HE22 GLN B 14 9.061 2.802 7.883 1.00 0.00 H new ATOM 1875 N VAL B 15 3.668 -0.314 8.311 1.00 0.00 N ATOM 1876 CA VAL B 15 2.970 -0.689 7.088 1.00 0.00 C ATOM 1877 C VAL B 15 2.122 0.479 6.592 1.00 0.00 C ATOM 1878 O VAL B 15 2.046 0.743 5.391 1.00 0.00 O ATOM 1879 CB VAL B 15 2.078 -1.932 7.301 1.00 0.00 C ATOM 1880 CG1 VAL B 15 1.276 -2.250 6.051 1.00 0.00 C ATOM 1881 CG2 VAL B 15 2.923 -3.129 7.697 1.00 0.00 C ATOM 0 H VAL B 15 3.400 -0.855 9.133 1.00 0.00 H new ATOM 0 HA VAL B 15 3.721 -0.939 6.339 1.00 0.00 H new ATOM 0 HB VAL B 15 1.380 -1.709 8.108 1.00 0.00 H new ATOM 0 HG11 VAL B 15 0.657 -3.129 6.230 1.00 0.00 H new ATOM 0 HG12 VAL B 15 0.638 -1.402 5.802 1.00 0.00 H new ATOM 0 HG13 VAL B 15 1.956 -2.447 5.223 1.00 0.00 H new ATOM 0 HG21 VAL B 15 2.279 -3.996 7.843 1.00 0.00 H new ATOM 0 HG22 VAL B 15 3.645 -3.342 6.908 1.00 0.00 H new ATOM 0 HG23 VAL B 15 3.453 -2.910 8.624 1.00 0.00 H new ATOM 1891 N ALA B 16 1.507 1.187 7.531 1.00 0.00 N ATOM 1892 CA ALA B 16 0.718 2.366 7.211 1.00 0.00 C ATOM 1893 C ALA B 16 1.586 3.441 6.570 1.00 0.00 C ATOM 1894 O ALA B 16 1.142 4.142 5.669 1.00 0.00 O ATOM 1895 CB ALA B 16 0.035 2.910 8.456 1.00 0.00 C ATOM 0 H ALA B 16 1.541 0.962 8.525 1.00 0.00 H new ATOM 0 HA ALA B 16 -0.050 2.073 6.495 1.00 0.00 H new ATOM 0 HB1 ALA B 16 -0.550 3.792 8.194 1.00 0.00 H new ATOM 0 HB2 ALA B 16 -0.624 2.148 8.872 1.00 0.00 H new ATOM 0 HB3 ALA B 16 0.789 3.181 9.195 1.00 0.00 H new ATOM 1901 N ARG B 17 2.829 3.554 7.035 1.00 0.00 N ATOM 1902 CA ARG B 17 3.773 4.521 6.481 1.00 0.00 C ATOM 1903 C ARG B 17 3.953 4.258 4.987 1.00 0.00 C ATOM 1904 O ARG B 17 3.872 5.173 4.159 1.00 0.00 O ATOM 1905 CB ARG B 17 5.128 4.427 7.197 1.00 0.00 C ATOM 1906 CG ARG B 17 5.904 5.736 7.214 1.00 0.00 C ATOM 1907 CD ARG B 17 7.302 5.562 7.795 1.00 0.00 C ATOM 1908 NE ARG B 17 8.260 5.088 6.793 1.00 0.00 N ATOM 1909 CZ ARG B 17 9.586 5.097 6.964 1.00 0.00 C ATOM 1910 NH1 ARG B 17 10.112 5.427 8.137 1.00 0.00 N ATOM 1911 NH2 ARG B 17 10.385 4.737 5.964 1.00 0.00 N ATOM 0 H ARG B 17 3.205 2.987 7.795 1.00 0.00 H new ATOM 0 HA ARG B 17 3.376 5.525 6.629 1.00 0.00 H new ATOM 0 HB2 ARG B 17 4.964 4.099 8.223 1.00 0.00 H new ATOM 0 HB3 ARG B 17 5.734 3.662 6.710 1.00 0.00 H new ATOM 0 HG2 ARG B 17 5.979 6.126 6.199 1.00 0.00 H new ATOM 0 HG3 ARG B 17 5.357 6.474 7.800 1.00 0.00 H new ATOM 0 HD2 ARG B 17 7.645 6.513 8.203 1.00 0.00 H new ATOM 0 HD3 ARG B 17 7.264 4.854 8.623 1.00 0.00 H new ATOM 0 HE ARG B 17 7.893 4.729 5.911 1.00 0.00 H new ATOM 0 HH11 ARG B 17 9.504 5.676 8.917 1.00 0.00 H new ATOM 0 HH12 ARG B 17 11.125 5.431 8.259 1.00 0.00 H new ATOM 0 HH21 ARG B 17 9.986 4.455 5.069 1.00 0.00 H new ATOM 0 HH22 ARG B 17 11.397 4.743 6.092 1.00 0.00 H new ATOM 1925 N VAL B 18 4.176 2.992 4.655 1.00 0.00 N ATOM 1926 CA VAL B 18 4.302 2.569 3.266 1.00 0.00 C ATOM 1927 C VAL B 18 2.995 2.809 2.514 1.00 0.00 C ATOM 1928 O VAL B 18 2.989 3.383 1.427 1.00 0.00 O ATOM 1929 CB VAL B 18 4.686 1.075 3.165 1.00 0.00 C ATOM 1930 CG1 VAL B 18 4.816 0.639 1.712 1.00 0.00 C ATOM 1931 CG2 VAL B 18 5.978 0.804 3.923 1.00 0.00 C ATOM 0 H VAL B 18 4.274 2.237 5.333 1.00 0.00 H new ATOM 0 HA VAL B 18 5.096 3.163 2.814 1.00 0.00 H new ATOM 0 HB VAL B 18 3.887 0.490 3.621 1.00 0.00 H new ATOM 0 HG11 VAL B 18 5.087 -0.416 1.672 1.00 0.00 H new ATOM 0 HG12 VAL B 18 3.865 0.789 1.201 1.00 0.00 H new ATOM 0 HG13 VAL B 18 5.589 1.231 1.222 1.00 0.00 H new ATOM 0 HG21 VAL B 18 6.233 -0.253 3.841 1.00 0.00 H new ATOM 0 HG22 VAL B 18 6.782 1.405 3.498 1.00 0.00 H new ATOM 0 HG23 VAL B 18 5.845 1.065 4.973 1.00 0.00 H new ATOM 1941 N GLY B 19 1.890 2.391 3.121 1.00 0.00 N ATOM 1942 CA GLY B 19 0.585 2.553 2.507 1.00 0.00 C ATOM 1943 C GLY B 19 0.260 4.002 2.193 1.00 0.00 C ATOM 1944 O GLY B 19 -0.294 4.302 1.136 1.00 0.00 O ATOM 0 H GLY B 19 1.875 1.939 4.035 1.00 0.00 H new ATOM 0 HA2 GLY B 19 0.546 1.969 1.588 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -0.178 2.150 3.173 1.00 0.00 H new ATOM 1948 N LYS B 20 0.619 4.903 3.102 1.00 0.00 N ATOM 1949 CA LYS B 20 0.348 6.325 2.926 1.00 0.00 C ATOM 1950 C LYS B 20 1.217 6.916 1.821 1.00 0.00 C ATOM 1951 O LYS B 20 0.842 7.904 1.190 1.00 0.00 O ATOM 1952 CB LYS B 20 0.553 7.075 4.245 1.00 0.00 C ATOM 1953 CG LYS B 20 -0.461 6.683 5.309 1.00 0.00 C ATOM 1954 CD LYS B 20 -0.149 7.295 6.664 1.00 0.00 C ATOM 1955 CE LYS B 20 -0.301 8.806 6.654 1.00 0.00 C ATOM 1956 NZ LYS B 20 -0.160 9.376 8.018 1.00 0.00 N ATOM 0 H LYS B 20 1.100 4.672 3.971 1.00 0.00 H new ATOM 0 HA LYS B 20 -0.693 6.439 2.625 1.00 0.00 H new ATOM 0 HB2 LYS B 20 1.558 6.878 4.617 1.00 0.00 H new ATOM 0 HB3 LYS B 20 0.485 8.147 4.062 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -1.455 6.998 4.992 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -0.485 5.597 5.401 1.00 0.00 H new ATOM 0 HD2 LYS B 20 -0.813 6.869 7.416 1.00 0.00 H new ATOM 0 HD3 LYS B 20 0.869 7.035 6.954 1.00 0.00 H new ATOM 0 HE2 LYS B 20 0.450 9.244 5.996 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -1.276 9.072 6.246 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -0.269 10.409 7.975 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -0.892 8.976 8.639 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 0.780 9.143 8.396 1.00 0.00 H new ATOM 1970 N ALA B 21 2.372 6.306 1.583 1.00 0.00 N ATOM 1971 CA ALA B 21 3.216 6.705 0.463 1.00 0.00 C ATOM 1972 C ALA B 21 2.582 6.271 -0.863 1.00 0.00 C ATOM 1973 O ALA B 21 2.736 6.945 -1.883 1.00 0.00 O ATOM 1974 CB ALA B 21 4.623 6.134 0.611 1.00 0.00 C ATOM 0 H ALA B 21 2.743 5.540 2.145 1.00 0.00 H new ATOM 0 HA ALA B 21 3.298 7.792 0.463 1.00 0.00 H new ATOM 0 HB1 ALA B 21 5.233 6.446 -0.237 1.00 0.00 H new ATOM 0 HB2 ALA B 21 5.070 6.502 1.535 1.00 0.00 H new ATOM 0 HB3 ALA B 21 4.573 5.046 0.641 1.00 0.00 H new ATOM 1980 N LEU B 22 1.847 5.163 -0.835 1.00 0.00 N ATOM 1981 CA LEU B 22 1.133 4.677 -2.018 1.00 0.00 C ATOM 1982 C LEU B 22 -0.203 5.399 -2.193 1.00 0.00 C ATOM 1983 O LEU B 22 -0.788 5.383 -3.274 1.00 0.00 O ATOM 1984 CB LEU B 22 0.874 3.165 -1.928 1.00 0.00 C ATOM 1985 CG LEU B 22 2.001 2.248 -2.420 1.00 0.00 C ATOM 1986 CD1 LEU B 22 2.391 2.595 -3.847 1.00 0.00 C ATOM 1987 CD2 LEU B 22 3.207 2.320 -1.501 1.00 0.00 C ATOM 0 H LEU B 22 1.728 4.582 -0.005 1.00 0.00 H new ATOM 0 HA LEU B 22 1.769 4.883 -2.879 1.00 0.00 H new ATOM 0 HB2 LEU B 22 0.661 2.916 -0.888 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -0.025 2.938 -2.501 1.00 0.00 H new ATOM 0 HG LEU B 22 1.630 1.223 -2.405 1.00 0.00 H new ATOM 0 HD11 LEU B 22 3.192 1.933 -4.177 1.00 0.00 H new ATOM 0 HD12 LEU B 22 1.527 2.473 -4.500 1.00 0.00 H new ATOM 0 HD13 LEU B 22 2.734 3.629 -3.889 1.00 0.00 H new ATOM 0 HD21 LEU B 22 3.989 1.660 -1.875 1.00 0.00 H new ATOM 0 HD22 LEU B 22 3.580 3.344 -1.470 1.00 0.00 H new ATOM 0 HD23 LEU B 22 2.919 2.008 -0.497 1.00 0.00 H new ATOM 1999 N ALA B 23 -0.672 6.040 -1.129 1.00 0.00 N ATOM 2000 CA ALA B 23 -1.968 6.712 -1.134 1.00 0.00 C ATOM 2001 C ALA B 23 -1.893 8.078 -1.818 1.00 0.00 C ATOM 2002 O ALA B 23 -2.394 9.076 -1.296 1.00 0.00 O ATOM 2003 CB ALA B 23 -2.477 6.857 0.292 1.00 0.00 C ATOM 0 H ALA B 23 -0.170 6.109 -0.244 1.00 0.00 H new ATOM 0 HA ALA B 23 -2.666 6.100 -1.706 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -3.444 7.359 0.284 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -2.584 5.870 0.742 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -1.768 7.446 0.873 1.00 0.00 H new ATOM 2009 N ASN B 24 -1.290 8.105 -2.996 1.00 0.00 N ATOM 2010 CA ASN B 24 -1.115 9.340 -3.750 1.00 0.00 C ATOM 2011 C ASN B 24 -1.453 9.105 -5.215 1.00 0.00 C ATOM 2012 O ASN B 24 -1.902 8.024 -5.585 1.00 0.00 O ATOM 2013 CB ASN B 24 0.324 9.854 -3.623 1.00 0.00 C ATOM 2014 CG ASN B 24 0.673 10.281 -2.210 1.00 0.00 C ATOM 2015 OD1 ASN B 24 0.474 11.434 -1.829 1.00 0.00 O ATOM 2016 ND2 ASN B 24 1.218 9.363 -1.429 1.00 0.00 N ATOM 0 H ASN B 24 -0.910 7.278 -3.456 1.00 0.00 H new ATOM 0 HA ASN B 24 -1.789 10.093 -3.340 1.00 0.00 H new ATOM 0 HB2 ASN B 24 1.014 9.073 -3.942 1.00 0.00 H new ATOM 0 HB3 ASN B 24 0.464 10.698 -4.298 1.00 0.00 H new ATOM 0 HD21 ASN B 24 1.489 9.601 -0.475 1.00 0.00 H new ATOM 0 HD22 ASN B 24 1.367 8.417 -1.781 1.00 0.00 H new ATOM 2023 N GLY B 25 -1.249 10.117 -6.045 1.00 0.00 N ATOM 2024 CA GLY B 25 -1.502 9.967 -7.463 1.00 0.00 C ATOM 2025 C GLY B 25 -0.338 10.447 -8.300 1.00 0.00 C ATOM 2026 O GLY B 25 0.211 9.698 -9.107 1.00 0.00 O ATOM 0 H GLY B 25 -0.913 11.038 -5.763 1.00 0.00 H new ATOM 0 HA2 GLY B 25 -1.702 8.919 -7.687 1.00 0.00 H new ATOM 0 HA3 GLY B 25 -2.398 10.527 -7.733 1.00 0.00 H new ATOM 2030 N ARG B 26 0.061 11.694 -8.080 1.00 0.00 N ATOM 2031 CA ARG B 26 1.154 12.305 -8.832 1.00 0.00 C ATOM 2032 C ARG B 26 2.477 11.633 -8.497 1.00 0.00 C ATOM 2033 O ARG B 26 3.402 11.611 -9.306 1.00 0.00 O ATOM 2034 CB ARG B 26 1.240 13.794 -8.500 1.00 0.00 C ATOM 2035 CG ARG B 26 0.005 14.588 -8.890 1.00 0.00 C ATOM 2036 CD ARG B 26 0.105 15.145 -10.303 1.00 0.00 C ATOM 2037 NE ARG B 26 0.082 14.102 -11.325 1.00 0.00 N ATOM 2038 CZ ARG B 26 0.577 14.255 -12.552 1.00 0.00 C ATOM 2039 NH1 ARG B 26 1.211 15.376 -12.889 1.00 0.00 N ATOM 2040 NH2 ARG B 26 0.452 13.278 -13.437 1.00 0.00 N ATOM 0 H ARG B 26 -0.359 12.307 -7.381 1.00 0.00 H new ATOM 0 HA ARG B 26 0.955 12.177 -9.896 1.00 0.00 H new ATOM 0 HB2 ARG B 26 1.409 13.907 -7.429 1.00 0.00 H new ATOM 0 HB3 ARG B 26 2.107 14.219 -9.006 1.00 0.00 H new ATOM 0 HG2 ARG B 26 -0.875 13.949 -8.814 1.00 0.00 H new ATOM 0 HG3 ARG B 26 -0.135 15.409 -8.186 1.00 0.00 H new ATOM 0 HD2 ARG B 26 -0.721 15.835 -10.476 1.00 0.00 H new ATOM 0 HD3 ARG B 26 1.026 15.720 -10.398 1.00 0.00 H new ATOM 0 HE ARG B 26 -0.338 13.204 -11.085 1.00 0.00 H new ATOM 0 HH11 ARG B 26 1.320 16.125 -12.206 1.00 0.00 H new ATOM 0 HH12 ARG B 26 1.587 15.486 -13.831 1.00 0.00 H new ATOM 0 HH21 ARG B 26 -0.022 12.413 -13.178 1.00 0.00 H new ATOM 0 HH22 ARG B 26 0.830 13.391 -14.378 1.00 0.00 H new ATOM 2054 N ARG B 27 2.552 11.073 -7.297 1.00 0.00 N ATOM 2055 CA ARG B 27 3.781 10.463 -6.806 1.00 0.00 C ATOM 2056 C ARG B 27 3.930 9.030 -7.313 1.00 0.00 C ATOM 2057 O ARG B 27 5.028 8.478 -7.317 1.00 0.00 O ATOM 2058 CB ARG B 27 3.803 10.485 -5.275 1.00 0.00 C ATOM 2059 CG ARG B 27 3.753 11.887 -4.687 1.00 0.00 C ATOM 2060 CD ARG B 27 3.725 11.861 -3.166 1.00 0.00 C ATOM 2061 NE ARG B 27 3.701 13.209 -2.602 1.00 0.00 N ATOM 2062 CZ ARG B 27 3.535 13.480 -1.306 1.00 0.00 C ATOM 2063 NH1 ARG B 27 3.347 12.499 -0.432 1.00 0.00 N ATOM 2064 NH2 ARG B 27 3.552 14.737 -0.879 1.00 0.00 N ATOM 0 H ARG B 27 1.771 11.028 -6.642 1.00 0.00 H new ATOM 0 HA ARG B 27 4.621 11.044 -7.186 1.00 0.00 H new ATOM 0 HB2 ARG B 27 2.956 9.912 -4.899 1.00 0.00 H new ATOM 0 HB3 ARG B 27 4.706 9.985 -4.925 1.00 0.00 H new ATOM 0 HG2 ARG B 27 4.620 12.454 -5.025 1.00 0.00 H new ATOM 0 HG3 ARG B 27 2.869 12.405 -5.058 1.00 0.00 H new ATOM 0 HD2 ARG B 27 2.848 11.309 -2.828 1.00 0.00 H new ATOM 0 HD3 ARG B 27 4.600 11.327 -2.795 1.00 0.00 H new ATOM 0 HE ARG B 27 3.819 13.995 -3.241 1.00 0.00 H new ATOM 0 HH11 ARG B 27 3.329 11.530 -0.749 1.00 0.00 H new ATOM 0 HH12 ARG B 27 3.221 12.714 0.557 1.00 0.00 H new ATOM 0 HH21 ARG B 27 3.692 15.499 -1.542 1.00 0.00 H new ATOM 0 HH22 ARG B 27 3.425 14.941 0.112 1.00 0.00 H new ATOM 2078 N LEU B 28 2.829 8.440 -7.760 1.00 0.00 N ATOM 2079 CA LEU B 28 2.845 7.046 -8.186 1.00 0.00 C ATOM 2080 C LEU B 28 3.419 6.903 -9.588 1.00 0.00 C ATOM 2081 O LEU B 28 4.018 5.878 -9.914 1.00 0.00 O ATOM 2082 CB LEU B 28 1.447 6.429 -8.118 1.00 0.00 C ATOM 2083 CG LEU B 28 0.840 6.344 -6.715 1.00 0.00 C ATOM 2084 CD1 LEU B 28 -0.420 5.495 -6.732 1.00 0.00 C ATOM 2085 CD2 LEU B 28 1.847 5.782 -5.721 1.00 0.00 C ATOM 0 H LEU B 28 1.922 8.899 -7.837 1.00 0.00 H new ATOM 0 HA LEU B 28 3.492 6.504 -7.496 1.00 0.00 H new ATOM 0 HB2 LEU B 28 0.779 7.012 -8.751 1.00 0.00 H new ATOM 0 HB3 LEU B 28 1.489 5.425 -8.540 1.00 0.00 H new ATOM 0 HG LEU B 28 0.576 7.353 -6.397 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -0.839 5.445 -5.727 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -1.150 5.941 -7.407 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -0.176 4.489 -7.074 1.00 0.00 H new ATOM 0 HD21 LEU B 28 1.392 5.731 -4.732 1.00 0.00 H new ATOM 0 HD22 LEU B 28 2.148 4.782 -6.034 1.00 0.00 H new ATOM 0 HD23 LEU B 28 2.723 6.430 -5.685 1.00 0.00 H new ATOM 2097 N GLN B 29 3.257 7.933 -10.415 1.00 0.00 N ATOM 2098 CA GLN B 29 3.832 7.913 -11.754 1.00 0.00 C ATOM 2099 C GLN B 29 5.351 7.967 -11.660 1.00 0.00 C ATOM 2100 O GLN B 29 6.064 7.460 -12.521 1.00 0.00 O ATOM 2101 CB GLN B 29 3.313 9.076 -12.603 1.00 0.00 C ATOM 2102 CG GLN B 29 3.695 8.949 -14.070 1.00 0.00 C ATOM 2103 CD GLN B 29 3.132 10.050 -14.949 1.00 0.00 C ATOM 2104 OE1 GLN B 29 2.819 9.815 -16.116 1.00 0.00 O ATOM 2105 NE2 GLN B 29 3.022 11.257 -14.416 1.00 0.00 N ATOM 0 H GLN B 29 2.739 8.781 -10.184 1.00 0.00 H new ATOM 0 HA GLN B 29 3.530 6.986 -12.242 1.00 0.00 H new ATOM 0 HB2 GLN B 29 2.228 9.127 -12.518 1.00 0.00 H new ATOM 0 HB3 GLN B 29 3.708 10.012 -12.209 1.00 0.00 H new ATOM 0 HG2 GLN B 29 4.782 8.951 -14.154 1.00 0.00 H new ATOM 0 HG3 GLN B 29 3.348 7.986 -14.444 1.00 0.00 H new ATOM 0 HE21 GLN B 29 3.292 11.412 -13.445 1.00 0.00 H new ATOM 0 HE22 GLN B 29 2.667 12.032 -14.977 1.00 0.00 H new ATOM 2114 N ILE B 30 5.836 8.580 -10.591 1.00 0.00 N ATOM 2115 CA ILE B 30 7.261 8.614 -10.317 1.00 0.00 C ATOM 2116 C ILE B 30 7.753 7.207 -10.001 1.00 0.00 C ATOM 2117 O ILE B 30 8.822 6.791 -10.448 1.00 0.00 O ATOM 2118 CB ILE B 30 7.583 9.548 -9.130 1.00 0.00 C ATOM 2119 CG1 ILE B 30 7.054 10.960 -9.406 1.00 0.00 C ATOM 2120 CG2 ILE B 30 9.083 9.580 -8.871 1.00 0.00 C ATOM 2121 CD1 ILE B 30 7.257 11.922 -8.255 1.00 0.00 C ATOM 0 H ILE B 30 5.261 9.061 -9.899 1.00 0.00 H new ATOM 0 HA ILE B 30 7.767 8.999 -11.202 1.00 0.00 H new ATOM 0 HB ILE B 30 7.089 9.162 -8.239 1.00 0.00 H new ATOM 0 HG12 ILE B 30 7.550 11.357 -10.292 1.00 0.00 H new ATOM 0 HG13 ILE B 30 5.990 10.901 -9.636 1.00 0.00 H new ATOM 0 HG21 ILE B 30 9.293 10.243 -8.032 1.00 0.00 H new ATOM 0 HG22 ILE B 30 9.433 8.575 -8.636 1.00 0.00 H new ATOM 0 HG23 ILE B 30 9.598 9.945 -9.759 1.00 0.00 H new ATOM 0 HD11 ILE B 30 6.858 12.900 -8.524 1.00 0.00 H new ATOM 0 HD12 ILE B 30 6.738 11.548 -7.372 1.00 0.00 H new ATOM 0 HD13 ILE B 30 8.322 12.011 -8.039 1.00 0.00 H new ATOM 2133 N LEU B 31 6.943 6.469 -9.250 1.00 0.00 N ATOM 2134 CA LEU B 31 7.281 5.108 -8.861 1.00 0.00 C ATOM 2135 C LEU B 31 7.280 4.170 -10.062 1.00 0.00 C ATOM 2136 O LEU B 31 8.164 3.324 -10.189 1.00 0.00 O ATOM 2137 CB LEU B 31 6.318 4.596 -7.790 1.00 0.00 C ATOM 2138 CG LEU B 31 6.480 5.242 -6.414 1.00 0.00 C ATOM 2139 CD1 LEU B 31 5.420 4.729 -5.454 1.00 0.00 C ATOM 2140 CD2 LEU B 31 7.874 4.969 -5.868 1.00 0.00 C ATOM 0 H LEU B 31 6.043 6.794 -8.898 1.00 0.00 H new ATOM 0 HA LEU B 31 8.289 5.126 -8.447 1.00 0.00 H new ATOM 0 HB2 LEU B 31 5.296 4.759 -8.133 1.00 0.00 H new ATOM 0 HB3 LEU B 31 6.452 3.519 -7.687 1.00 0.00 H new ATOM 0 HG LEU B 31 6.351 6.319 -6.518 1.00 0.00 H new ATOM 0 HD11 LEU B 31 5.552 5.201 -4.480 1.00 0.00 H new ATOM 0 HD12 LEU B 31 4.430 4.970 -5.842 1.00 0.00 H new ATOM 0 HD13 LEU B 31 5.516 3.648 -5.350 1.00 0.00 H new ATOM 0 HD21 LEU B 31 7.978 5.434 -4.888 1.00 0.00 H new ATOM 0 HD22 LEU B 31 8.025 3.893 -5.778 1.00 0.00 H new ATOM 0 HD23 LEU B 31 8.619 5.384 -6.547 1.00 0.00 H new ATOM 2152 N ASP B 32 6.297 4.320 -10.950 1.00 0.00 N ATOM 2153 CA ASP B 32 6.236 3.472 -12.139 1.00 0.00 C ATOM 2154 C ASP B 32 7.371 3.835 -13.093 1.00 0.00 C ATOM 2155 O ASP B 32 7.845 2.996 -13.864 1.00 0.00 O ATOM 2156 CB ASP B 32 4.857 3.551 -12.838 1.00 0.00 C ATOM 2157 CG ASP B 32 4.771 4.546 -13.992 1.00 0.00 C ATOM 2158 OD1 ASP B 32 5.375 4.289 -15.057 1.00 0.00 O ATOM 2159 OD2 ASP B 32 4.063 5.565 -13.858 1.00 0.00 O ATOM 0 H ASP B 32 5.546 5.006 -10.872 1.00 0.00 H new ATOM 0 HA ASP B 32 6.362 2.436 -11.825 1.00 0.00 H new ATOM 0 HB2 ASP B 32 4.600 2.560 -13.213 1.00 0.00 H new ATOM 0 HB3 ASP B 32 4.105 3.815 -12.094 1.00 0.00 H new ATOM 2164 N LEU B 33 7.821 5.082 -13.009 1.00 0.00 N ATOM 2165 CA LEU B 33 8.941 5.554 -13.809 1.00 0.00 C ATOM 2166 C LEU B 33 10.251 4.962 -13.298 1.00 0.00 C ATOM 2167 O LEU B 33 11.147 4.648 -14.081 1.00 0.00 O ATOM 2168 CB LEU B 33 9.011 7.082 -13.772 1.00 0.00 C ATOM 2169 CG LEU B 33 10.098 7.704 -14.645 1.00 0.00 C ATOM 2170 CD1 LEU B 33 9.809 7.449 -16.116 1.00 0.00 C ATOM 2171 CD2 LEU B 33 10.204 9.194 -14.369 1.00 0.00 C ATOM 0 H LEU B 33 7.423 5.788 -12.389 1.00 0.00 H new ATOM 0 HA LEU B 33 8.788 5.230 -14.838 1.00 0.00 H new ATOM 0 HB2 LEU B 33 8.045 7.482 -14.082 1.00 0.00 H new ATOM 0 HB3 LEU B 33 9.170 7.398 -12.741 1.00 0.00 H new ATOM 0 HG LEU B 33 11.053 7.239 -14.400 1.00 0.00 H new ATOM 0 HD11 LEU B 33 10.594 7.899 -16.724 1.00 0.00 H new ATOM 0 HD12 LEU B 33 9.778 6.375 -16.300 1.00 0.00 H new ATOM 0 HD13 LEU B 33 8.848 7.890 -16.380 1.00 0.00 H new ATOM 0 HD21 LEU B 33 10.983 9.626 -14.998 1.00 0.00 H new ATOM 0 HD22 LEU B 33 9.251 9.674 -14.591 1.00 0.00 H new ATOM 0 HD23 LEU B 33 10.455 9.353 -13.320 1.00 0.00 H new ATOM 2183 N LEU B 34 10.355 4.806 -11.983 1.00 0.00 N ATOM 2184 CA LEU B 34 11.556 4.248 -11.367 1.00 0.00 C ATOM 2185 C LEU B 34 11.520 2.721 -11.381 1.00 0.00 C ATOM 2186 O LEU B 34 12.514 2.061 -11.085 1.00 0.00 O ATOM 2187 CB LEU B 34 11.711 4.754 -9.932 1.00 0.00 C ATOM 2188 CG LEU B 34 11.939 6.260 -9.793 1.00 0.00 C ATOM 2189 CD1 LEU B 34 12.017 6.654 -8.327 1.00 0.00 C ATOM 2190 CD2 LEU B 34 13.208 6.673 -10.519 1.00 0.00 C ATOM 0 H LEU B 34 9.621 5.058 -11.321 1.00 0.00 H new ATOM 0 HA LEU B 34 12.414 4.579 -11.952 1.00 0.00 H new ATOM 0 HB2 LEU B 34 10.816 4.485 -9.370 1.00 0.00 H new ATOM 0 HB3 LEU B 34 12.548 4.232 -9.468 1.00 0.00 H new ATOM 0 HG LEU B 34 11.095 6.779 -10.246 1.00 0.00 H new ATOM 0 HD11 LEU B 34 12.180 7.729 -8.247 1.00 0.00 H new ATOM 0 HD12 LEU B 34 11.084 6.390 -7.829 1.00 0.00 H new ATOM 0 HD13 LEU B 34 12.844 6.126 -7.852 1.00 0.00 H new ATOM 0 HD21 LEU B 34 13.356 7.747 -10.411 1.00 0.00 H new ATOM 0 HD22 LEU B 34 14.060 6.144 -10.092 1.00 0.00 H new ATOM 0 HD23 LEU B 34 13.120 6.424 -11.576 1.00 0.00 H new ATOM 2202 N ALA B 35 10.366 2.161 -11.725 1.00 0.00 N ATOM 2203 CA ALA B 35 10.213 0.712 -11.810 1.00 0.00 C ATOM 2204 C ALA B 35 11.092 0.135 -12.915 1.00 0.00 C ATOM 2205 O ALA B 35 11.545 -1.008 -12.832 1.00 0.00 O ATOM 2206 CB ALA B 35 8.755 0.343 -12.038 1.00 0.00 C ATOM 0 H ALA B 35 9.522 2.688 -11.950 1.00 0.00 H new ATOM 0 HA ALA B 35 10.535 0.280 -10.862 1.00 0.00 H new ATOM 0 HB1 ALA B 35 8.659 -0.741 -12.099 1.00 0.00 H new ATOM 0 HB2 ALA B 35 8.152 0.715 -11.210 1.00 0.00 H new ATOM 0 HB3 ALA B 35 8.408 0.791 -12.969 1.00 0.00 H new ATOM 2212 N GLN B 36 11.343 0.937 -13.943 1.00 0.00 N ATOM 2213 CA GLN B 36 12.196 0.518 -15.047 1.00 0.00 C ATOM 2214 C GLN B 36 13.647 0.923 -14.796 1.00 0.00 C ATOM 2215 O GLN B 36 14.469 0.928 -15.714 1.00 0.00 O ATOM 2216 CB GLN B 36 11.706 1.109 -16.373 1.00 0.00 C ATOM 2217 CG GLN B 36 11.640 2.626 -16.385 1.00 0.00 C ATOM 2218 CD GLN B 36 11.397 3.187 -17.772 1.00 0.00 C ATOM 2219 OE1 GLN B 36 11.824 2.612 -18.775 1.00 0.00 O ATOM 2220 NE2 GLN B 36 10.691 4.302 -17.843 1.00 0.00 N ATOM 0 H GLN B 36 10.968 1.881 -14.034 1.00 0.00 H new ATOM 0 HA GLN B 36 12.144 -0.569 -15.113 1.00 0.00 H new ATOM 0 HB2 GLN B 36 12.368 0.778 -17.173 1.00 0.00 H new ATOM 0 HB3 GLN B 36 10.716 0.711 -16.593 1.00 0.00 H new ATOM 0 HG2 GLN B 36 10.844 2.957 -15.718 1.00 0.00 H new ATOM 0 HG3 GLN B 36 12.573 3.030 -15.992 1.00 0.00 H new ATOM 0 HE21 GLN B 36 10.355 4.748 -16.989 1.00 0.00 H new ATOM 0 HE22 GLN B 36 10.482 4.716 -18.751 1.00 0.00 H new ATOM 2229 N GLY B 37 13.955 1.269 -13.556 1.00 0.00 N ATOM 2230 CA GLY B 37 15.322 1.575 -13.197 1.00 0.00 C ATOM 2231 C GLY B 37 15.456 2.895 -12.472 1.00 0.00 C ATOM 2232 O GLY B 37 14.580 3.753 -12.561 1.00 0.00 O ATOM 0 H GLY B 37 13.283 1.343 -12.792 1.00 0.00 H new ATOM 0 HA2 GLY B 37 15.714 0.778 -12.566 1.00 0.00 H new ATOM 0 HA3 GLY B 37 15.933 1.597 -14.099 1.00 0.00 H new ATOM 2236 N GLU B 38 16.555 3.046 -11.750 1.00 0.00 N ATOM 2237 CA GLU B 38 16.844 4.275 -11.030 1.00 0.00 C ATOM 2238 C GLU B 38 17.272 5.373 -11.992 1.00 0.00 C ATOM 2239 O GLU B 38 18.070 5.132 -12.900 1.00 0.00 O ATOM 2240 CB GLU B 38 17.933 4.026 -9.989 1.00 0.00 C ATOM 2241 CG GLU B 38 19.165 3.324 -10.533 1.00 0.00 C ATOM 2242 CD GLU B 38 20.141 2.957 -9.440 1.00 0.00 C ATOM 2243 OE1 GLU B 38 19.969 1.880 -8.825 1.00 0.00 O ATOM 2244 OE2 GLU B 38 21.078 3.738 -9.183 1.00 0.00 O ATOM 0 H GLU B 38 17.268 2.324 -11.647 1.00 0.00 H new ATOM 0 HA GLU B 38 15.937 4.602 -10.522 1.00 0.00 H new ATOM 0 HB2 GLU B 38 18.233 4.981 -9.558 1.00 0.00 H new ATOM 0 HB3 GLU B 38 17.516 3.428 -9.179 1.00 0.00 H new ATOM 0 HG2 GLU B 38 18.862 2.422 -11.065 1.00 0.00 H new ATOM 0 HG3 GLU B 38 19.660 3.971 -11.258 1.00 0.00 H new ATOM 2251 N ARG B 39 16.751 6.575 -11.793 1.00 0.00 N ATOM 2252 CA ARG B 39 16.994 7.667 -12.724 1.00 0.00 C ATOM 2253 C ARG B 39 17.343 8.942 -11.966 1.00 0.00 C ATOM 2254 O ARG B 39 17.084 9.051 -10.766 1.00 0.00 O ATOM 2255 CB ARG B 39 15.763 7.907 -13.609 1.00 0.00 C ATOM 2256 CG ARG B 39 14.963 6.645 -13.910 1.00 0.00 C ATOM 2257 CD ARG B 39 14.023 6.833 -15.086 1.00 0.00 C ATOM 2258 NE ARG B 39 14.730 6.730 -16.363 1.00 0.00 N ATOM 2259 CZ ARG B 39 14.153 6.900 -17.553 1.00 0.00 C ATOM 2260 NH1 ARG B 39 12.864 7.226 -17.630 1.00 0.00 N ATOM 2261 NH2 ARG B 39 14.860 6.741 -18.663 1.00 0.00 N ATOM 0 H ARG B 39 16.160 6.818 -10.998 1.00 0.00 H new ATOM 0 HA ARG B 39 17.835 7.391 -13.361 1.00 0.00 H new ATOM 0 HB2 ARG B 39 15.111 8.630 -13.119 1.00 0.00 H new ATOM 0 HB3 ARG B 39 16.085 8.354 -14.549 1.00 0.00 H new ATOM 0 HG2 ARG B 39 15.648 5.824 -14.121 1.00 0.00 H new ATOM 0 HG3 ARG B 39 14.388 6.362 -13.028 1.00 0.00 H new ATOM 0 HD2 ARG B 39 13.234 6.082 -15.045 1.00 0.00 H new ATOM 0 HD3 ARG B 39 13.540 7.808 -15.014 1.00 0.00 H new ATOM 0 HE ARG B 39 15.727 6.515 -16.341 1.00 0.00 H new ATOM 0 HH11 ARG B 39 12.317 7.346 -16.778 1.00 0.00 H new ATOM 0 HH12 ARG B 39 12.424 7.356 -18.541 1.00 0.00 H new ATOM 0 HH21 ARG B 39 15.847 6.488 -18.607 1.00 0.00 H new ATOM 0 HH22 ARG B 39 14.417 6.871 -19.573 1.00 0.00 H new ATOM 2275 N ALA B 40 17.934 9.899 -12.666 1.00 0.00 N ATOM 2276 CA ALA B 40 18.282 11.178 -12.068 1.00 0.00 C ATOM 2277 C ALA B 40 17.051 12.068 -11.957 1.00 0.00 C ATOM 2278 O ALA B 40 16.067 11.863 -12.672 1.00 0.00 O ATOM 2279 CB ALA B 40 19.362 11.868 -12.883 1.00 0.00 C ATOM 0 H ALA B 40 18.183 9.813 -13.651 1.00 0.00 H new ATOM 0 HA ALA B 40 18.668 10.996 -11.065 1.00 0.00 H new ATOM 0 HB1 ALA B 40 19.611 12.824 -12.422 1.00 0.00 H new ATOM 0 HB2 ALA B 40 20.251 11.238 -12.916 1.00 0.00 H new ATOM 0 HB3 ALA B 40 19.000 12.038 -13.897 1.00 0.00 H new ATOM 2285 N VAL B 41 17.117 13.059 -11.073 1.00 0.00 N ATOM 2286 CA VAL B 41 15.998 13.970 -10.838 1.00 0.00 C ATOM 2287 C VAL B 41 15.527 14.616 -12.138 1.00 0.00 C ATOM 2288 O VAL B 41 14.326 14.714 -12.390 1.00 0.00 O ATOM 2289 CB VAL B 41 16.371 15.084 -9.833 1.00 0.00 C ATOM 2290 CG1 VAL B 41 15.184 15.998 -9.568 1.00 0.00 C ATOM 2291 CG2 VAL B 41 16.882 14.489 -8.531 1.00 0.00 C ATOM 0 H VAL B 41 17.940 13.254 -10.503 1.00 0.00 H new ATOM 0 HA VAL B 41 15.191 13.368 -10.419 1.00 0.00 H new ATOM 0 HB VAL B 41 17.169 15.679 -10.276 1.00 0.00 H new ATOM 0 HG11 VAL B 41 15.473 16.773 -8.858 1.00 0.00 H new ATOM 0 HG12 VAL B 41 14.866 16.462 -10.502 1.00 0.00 H new ATOM 0 HG13 VAL B 41 14.361 15.415 -9.154 1.00 0.00 H new ATOM 0 HG21 VAL B 41 17.138 15.292 -7.840 1.00 0.00 H new ATOM 0 HG22 VAL B 41 16.107 13.863 -8.089 1.00 0.00 H new ATOM 0 HG23 VAL B 41 17.767 13.885 -8.730 1.00 0.00 H new ATOM 2301 N GLU B 42 16.478 15.047 -12.963 1.00 0.00 N ATOM 2302 CA GLU B 42 16.163 15.694 -14.232 1.00 0.00 C ATOM 2303 C GLU B 42 15.333 14.776 -15.123 1.00 0.00 C ATOM 2304 O GLU B 42 14.350 15.204 -15.730 1.00 0.00 O ATOM 2305 CB GLU B 42 17.441 16.112 -14.968 1.00 0.00 C ATOM 2306 CG GLU B 42 18.421 16.894 -14.107 1.00 0.00 C ATOM 2307 CD GLU B 42 19.434 16.000 -13.418 1.00 0.00 C ATOM 2308 OE1 GLU B 42 19.084 15.359 -12.411 1.00 0.00 O ATOM 2309 OE2 GLU B 42 20.587 15.926 -13.903 1.00 0.00 O ATOM 0 H GLU B 42 17.476 14.959 -12.774 1.00 0.00 H new ATOM 0 HA GLU B 42 15.579 16.587 -14.007 1.00 0.00 H new ATOM 0 HB2 GLU B 42 17.938 15.219 -15.348 1.00 0.00 H new ATOM 0 HB3 GLU B 42 17.169 16.717 -15.833 1.00 0.00 H new ATOM 0 HG2 GLU B 42 18.946 17.620 -14.728 1.00 0.00 H new ATOM 0 HG3 GLU B 42 17.869 17.458 -13.355 1.00 0.00 H new ATOM 2316 N ALA B 43 15.725 13.509 -15.185 1.00 0.00 N ATOM 2317 CA ALA B 43 15.029 12.529 -16.007 1.00 0.00 C ATOM 2318 C ALA B 43 13.644 12.235 -15.445 1.00 0.00 C ATOM 2319 O ALA B 43 12.673 12.085 -16.191 1.00 0.00 O ATOM 2320 CB ALA B 43 15.841 11.246 -16.107 1.00 0.00 C ATOM 0 H ALA B 43 16.525 13.136 -14.673 1.00 0.00 H new ATOM 0 HA ALA B 43 14.911 12.947 -17.007 1.00 0.00 H new ATOM 0 HB1 ALA B 43 15.306 10.524 -16.725 1.00 0.00 H new ATOM 0 HB2 ALA B 43 16.810 11.463 -16.558 1.00 0.00 H new ATOM 0 HB3 ALA B 43 15.989 10.831 -15.110 1.00 0.00 H new ATOM 2326 N ILE B 44 13.563 12.160 -14.122 1.00 0.00 N ATOM 2327 CA ILE B 44 12.300 11.912 -13.441 1.00 0.00 C ATOM 2328 C ILE B 44 11.339 13.076 -13.652 1.00 0.00 C ATOM 2329 O ILE B 44 10.199 12.879 -14.076 1.00 0.00 O ATOM 2330 CB ILE B 44 12.507 11.697 -11.925 1.00 0.00 C ATOM 2331 CG1 ILE B 44 13.411 10.488 -11.674 1.00 0.00 C ATOM 2332 CG2 ILE B 44 11.166 11.515 -11.221 1.00 0.00 C ATOM 2333 CD1 ILE B 44 13.766 10.292 -10.216 1.00 0.00 C ATOM 0 H ILE B 44 14.362 12.268 -13.497 1.00 0.00 H new ATOM 0 HA ILE B 44 11.876 11.004 -13.870 1.00 0.00 H new ATOM 0 HB ILE B 44 12.993 12.583 -11.516 1.00 0.00 H new ATOM 0 HG12 ILE B 44 12.915 9.590 -12.043 1.00 0.00 H new ATOM 0 HG13 ILE B 44 14.329 10.604 -12.251 1.00 0.00 H new ATOM 0 HG21 ILE B 44 11.332 11.365 -10.154 1.00 0.00 H new ATOM 0 HG22 ILE B 44 10.553 12.404 -11.371 1.00 0.00 H new ATOM 0 HG23 ILE B 44 10.653 10.646 -11.634 1.00 0.00 H new ATOM 0 HD11 ILE B 44 14.408 9.418 -10.112 1.00 0.00 H new ATOM 0 HD12 ILE B 44 14.291 11.173 -9.848 1.00 0.00 H new ATOM 0 HD13 ILE B 44 12.855 10.144 -9.636 1.00 0.00 H new ATOM 2345 N ALA B 45 11.818 14.280 -13.371 1.00 0.00 N ATOM 2346 CA ALA B 45 11.007 15.486 -13.482 1.00 0.00 C ATOM 2347 C ALA B 45 10.441 15.645 -14.886 1.00 0.00 C ATOM 2348 O ALA B 45 9.237 15.831 -15.064 1.00 0.00 O ATOM 2349 CB ALA B 45 11.834 16.705 -13.103 1.00 0.00 C ATOM 0 H ALA B 45 12.775 14.449 -13.061 1.00 0.00 H new ATOM 0 HA ALA B 45 10.167 15.395 -12.793 1.00 0.00 H new ATOM 0 HB1 ALA B 45 11.220 17.602 -13.189 1.00 0.00 H new ATOM 0 HB2 ALA B 45 12.185 16.602 -12.076 1.00 0.00 H new ATOM 0 HB3 ALA B 45 12.690 16.786 -13.772 1.00 0.00 H new ATOM 2355 N THR B 46 11.311 15.542 -15.881 1.00 0.00 N ATOM 2356 CA THR B 46 10.907 15.700 -17.270 1.00 0.00 C ATOM 2357 C THR B 46 9.819 14.690 -17.642 1.00 0.00 C ATOM 2358 O THR B 46 8.758 15.064 -18.145 1.00 0.00 O ATOM 2359 CB THR B 46 12.117 15.537 -18.219 1.00 0.00 C ATOM 2360 OG1 THR B 46 13.180 16.412 -17.814 1.00 0.00 O ATOM 2361 CG2 THR B 46 11.725 15.851 -19.656 1.00 0.00 C ATOM 0 H THR B 46 12.304 15.349 -15.751 1.00 0.00 H new ATOM 0 HA THR B 46 10.505 16.707 -17.383 1.00 0.00 H new ATOM 0 HB THR B 46 12.453 14.502 -18.165 1.00 0.00 H new ATOM 0 HG1 THR B 46 13.765 15.945 -17.181 1.00 0.00 H new ATOM 0 HG21 THR B 46 12.593 15.729 -20.305 1.00 0.00 H new ATOM 0 HG22 THR B 46 10.935 15.171 -19.975 1.00 0.00 H new ATOM 0 HG23 THR B 46 11.366 16.878 -19.719 1.00 0.00 H new ATOM 2369 N ALA B 47 10.069 13.420 -17.342 1.00 0.00 N ATOM 2370 CA ALA B 47 9.169 12.345 -17.740 1.00 0.00 C ATOM 2371 C ALA B 47 7.812 12.444 -17.049 1.00 0.00 C ATOM 2372 O ALA B 47 6.792 12.038 -17.609 1.00 0.00 O ATOM 2373 CB ALA B 47 9.808 10.997 -17.455 1.00 0.00 C ATOM 0 H ALA B 47 10.890 13.110 -16.823 1.00 0.00 H new ATOM 0 HA ALA B 47 8.994 12.445 -18.811 1.00 0.00 H new ATOM 0 HB1 ALA B 47 9.127 10.201 -17.756 1.00 0.00 H new ATOM 0 HB2 ALA B 47 10.739 10.910 -18.015 1.00 0.00 H new ATOM 0 HB3 ALA B 47 10.017 10.912 -16.389 1.00 0.00 H new ATOM 2379 N THR B 48 7.794 12.987 -15.841 1.00 0.00 N ATOM 2380 CA THR B 48 6.556 13.099 -15.083 1.00 0.00 C ATOM 2381 C THR B 48 5.816 14.397 -15.410 1.00 0.00 C ATOM 2382 O THR B 48 4.612 14.511 -15.168 1.00 0.00 O ATOM 2383 CB THR B 48 6.816 13.011 -13.568 1.00 0.00 C ATOM 2384 OG1 THR B 48 7.887 13.887 -13.198 1.00 0.00 O ATOM 2385 CG2 THR B 48 7.153 11.587 -13.155 1.00 0.00 C ATOM 0 H THR B 48 8.618 13.355 -15.366 1.00 0.00 H new ATOM 0 HA THR B 48 5.927 12.259 -15.376 1.00 0.00 H new ATOM 0 HB THR B 48 5.906 13.315 -13.052 1.00 0.00 H new ATOM 0 HG1 THR B 48 8.738 13.404 -13.253 1.00 0.00 H new ATOM 0 HG21 THR B 48 7.332 11.553 -12.080 1.00 0.00 H new ATOM 0 HG22 THR B 48 6.321 10.929 -13.405 1.00 0.00 H new ATOM 0 HG23 THR B 48 8.048 11.257 -13.683 1.00 0.00 H new ATOM 2393 N GLY B 49 6.530 15.362 -15.981 1.00 0.00 N ATOM 2394 CA GLY B 49 5.910 16.623 -16.341 1.00 0.00 C ATOM 2395 C GLY B 49 5.923 17.639 -15.212 1.00 0.00 C ATOM 2396 O GLY B 49 5.121 18.578 -15.204 1.00 0.00 O ATOM 0 H GLY B 49 7.524 15.293 -16.200 1.00 0.00 H new ATOM 0 HA2 GLY B 49 6.427 17.042 -17.204 1.00 0.00 H new ATOM 0 HA3 GLY B 49 4.879 16.440 -16.645 1.00 0.00 H new ATOM 2400 N MET B 50 6.825 17.458 -14.257 1.00 0.00 N ATOM 2401 CA MET B 50 6.969 18.406 -13.157 1.00 0.00 C ATOM 2402 C MET B 50 8.368 19.007 -13.159 1.00 0.00 C ATOM 2403 O MET B 50 9.292 18.436 -13.733 1.00 0.00 O ATOM 2404 CB MET B 50 6.689 17.743 -11.801 1.00 0.00 C ATOM 2405 CG MET B 50 5.232 17.355 -11.583 1.00 0.00 C ATOM 2406 SD MET B 50 4.908 15.605 -11.885 1.00 0.00 S ATOM 2407 CE MET B 50 5.890 14.853 -10.588 1.00 0.00 C ATOM 0 H MET B 50 7.467 16.666 -14.220 1.00 0.00 H new ATOM 0 HA MET B 50 6.234 19.197 -13.305 1.00 0.00 H new ATOM 0 HB2 MET B 50 7.308 16.850 -11.711 1.00 0.00 H new ATOM 0 HB3 MET B 50 6.994 18.424 -11.007 1.00 0.00 H new ATOM 0 HG2 MET B 50 4.947 17.599 -10.560 1.00 0.00 H new ATOM 0 HG3 MET B 50 4.601 17.953 -12.241 1.00 0.00 H new ATOM 0 HE1 MET B 50 5.460 13.888 -10.319 1.00 0.00 H new ATOM 0 HE2 MET B 50 6.911 14.709 -10.942 1.00 0.00 H new ATOM 0 HE3 MET B 50 5.897 15.504 -9.713 1.00 0.00 H new ATOM 2417 N ASN B 51 8.519 20.165 -12.531 1.00 0.00 N ATOM 2418 CA ASN B 51 9.819 20.815 -12.448 1.00 0.00 C ATOM 2419 C ASN B 51 10.668 20.156 -11.365 1.00 0.00 C ATOM 2420 O ASN B 51 10.133 19.520 -10.455 1.00 0.00 O ATOM 2421 CB ASN B 51 9.662 22.316 -12.170 1.00 0.00 C ATOM 2422 CG ASN B 51 10.983 23.064 -12.259 1.00 0.00 C ATOM 2423 OD1 ASN B 51 11.885 22.671 -13.002 1.00 0.00 O ATOM 2424 ND2 ASN B 51 11.113 24.141 -11.502 1.00 0.00 N ATOM 0 H ASN B 51 7.761 20.672 -12.074 1.00 0.00 H new ATOM 0 HA ASN B 51 10.324 20.700 -13.407 1.00 0.00 H new ATOM 0 HB2 ASN B 51 8.957 22.743 -12.883 1.00 0.00 H new ATOM 0 HB3 ASN B 51 9.235 22.456 -11.177 1.00 0.00 H new ATOM 0 HD21 ASN B 51 11.981 24.676 -11.521 1.00 0.00 H new ATOM 0 HD22 ASN B 51 10.345 24.436 -10.899 1.00 0.00 H new ATOM 2431 N LEU B 52 11.985 20.323 -11.470 1.00 0.00 N ATOM 2432 CA LEU B 52 12.941 19.680 -10.568 1.00 0.00 C ATOM 2433 C LEU B 52 12.571 19.890 -9.100 1.00 0.00 C ATOM 2434 O LEU B 52 12.575 18.944 -8.312 1.00 0.00 O ATOM 2435 CB LEU B 52 14.350 20.226 -10.820 1.00 0.00 C ATOM 2436 CG LEU B 52 14.906 19.993 -12.228 1.00 0.00 C ATOM 2437 CD1 LEU B 52 16.267 20.652 -12.380 1.00 0.00 C ATOM 2438 CD2 LEU B 52 15.001 18.505 -12.523 1.00 0.00 C ATOM 0 H LEU B 52 12.421 20.908 -12.183 1.00 0.00 H new ATOM 0 HA LEU B 52 12.913 18.610 -10.774 1.00 0.00 H new ATOM 0 HB2 LEU B 52 14.346 21.298 -10.623 1.00 0.00 H new ATOM 0 HB3 LEU B 52 15.031 19.772 -10.100 1.00 0.00 H new ATOM 0 HG LEU B 52 14.222 20.445 -12.946 1.00 0.00 H new ATOM 0 HD11 LEU B 52 16.646 20.476 -13.387 1.00 0.00 H new ATOM 0 HD12 LEU B 52 16.173 21.725 -12.210 1.00 0.00 H new ATOM 0 HD13 LEU B 52 16.959 20.229 -11.652 1.00 0.00 H new ATOM 0 HD21 LEU B 52 15.398 18.358 -13.527 1.00 0.00 H new ATOM 0 HD22 LEU B 52 15.663 18.032 -11.798 1.00 0.00 H new ATOM 0 HD23 LEU B 52 14.010 18.057 -12.455 1.00 0.00 H new ATOM 2450 N THR B 53 12.248 21.128 -8.748 1.00 0.00 N ATOM 2451 CA THR B 53 11.935 21.488 -7.371 1.00 0.00 C ATOM 2452 C THR B 53 10.728 20.706 -6.842 1.00 0.00 C ATOM 2453 O THR B 53 10.783 20.114 -5.765 1.00 0.00 O ATOM 2454 CB THR B 53 11.657 22.997 -7.265 1.00 0.00 C ATOM 2455 OG1 THR B 53 12.619 23.715 -8.052 1.00 0.00 O ATOM 2456 CG2 THR B 53 11.736 23.461 -5.819 1.00 0.00 C ATOM 0 H THR B 53 12.196 21.907 -9.405 1.00 0.00 H new ATOM 0 HA THR B 53 12.801 21.231 -6.761 1.00 0.00 H new ATOM 0 HB THR B 53 10.651 23.193 -7.637 1.00 0.00 H new ATOM 0 HG1 THR B 53 12.442 24.677 -7.987 1.00 0.00 H new ATOM 0 HG21 THR B 53 11.536 24.531 -5.769 1.00 0.00 H new ATOM 0 HG22 THR B 53 10.996 22.925 -5.224 1.00 0.00 H new ATOM 0 HG23 THR B 53 12.733 23.259 -5.426 1.00 0.00 H new ATOM 2464 N THR B 54 9.649 20.689 -7.611 1.00 0.00 N ATOM 2465 CA THR B 54 8.431 20.007 -7.198 1.00 0.00 C ATOM 2466 C THR B 54 8.620 18.490 -7.216 1.00 0.00 C ATOM 2467 O THR B 54 8.119 17.779 -6.341 1.00 0.00 O ATOM 2468 CB THR B 54 7.254 20.405 -8.105 1.00 0.00 C ATOM 2469 OG1 THR B 54 7.146 21.834 -8.138 1.00 0.00 O ATOM 2470 CG2 THR B 54 5.949 19.803 -7.603 1.00 0.00 C ATOM 0 H THR B 54 9.592 21.140 -8.524 1.00 0.00 H new ATOM 0 HA THR B 54 8.206 20.313 -6.176 1.00 0.00 H new ATOM 0 HB THR B 54 7.441 20.022 -9.108 1.00 0.00 H new ATOM 0 HG1 THR B 54 6.398 22.092 -8.716 1.00 0.00 H new ATOM 0 HG21 THR B 54 5.134 20.100 -8.263 1.00 0.00 H new ATOM 0 HG22 THR B 54 6.030 18.716 -7.593 1.00 0.00 H new ATOM 0 HG23 THR B 54 5.748 20.161 -6.593 1.00 0.00 H new ATOM 2478 N ALA B 55 9.366 18.004 -8.201 1.00 0.00 N ATOM 2479 CA ALA B 55 9.634 16.579 -8.325 1.00 0.00 C ATOM 2480 C ALA B 55 10.427 16.065 -7.129 1.00 0.00 C ATOM 2481 O ALA B 55 10.052 15.069 -6.513 1.00 0.00 O ATOM 2482 CB ALA B 55 10.381 16.286 -9.617 1.00 0.00 C ATOM 0 H ALA B 55 9.796 18.578 -8.926 1.00 0.00 H new ATOM 0 HA ALA B 55 8.676 16.059 -8.349 1.00 0.00 H new ATOM 0 HB1 ALA B 55 10.572 15.216 -9.692 1.00 0.00 H new ATOM 0 HB2 ALA B 55 9.778 16.607 -10.467 1.00 0.00 H new ATOM 0 HB3 ALA B 55 11.328 16.825 -9.620 1.00 0.00 H new ATOM 2488 N SER B 56 11.507 16.762 -6.792 1.00 0.00 N ATOM 2489 CA SER B 56 12.381 16.341 -5.702 1.00 0.00 C ATOM 2490 C SER B 56 11.662 16.406 -4.356 1.00 0.00 C ATOM 2491 O SER B 56 11.912 15.586 -3.472 1.00 0.00 O ATOM 2492 CB SER B 56 13.660 17.184 -5.682 1.00 0.00 C ATOM 2493 OG SER B 56 13.370 18.572 -5.752 1.00 0.00 O ATOM 0 H SER B 56 11.798 17.621 -7.258 1.00 0.00 H new ATOM 0 HA SER B 56 12.658 15.301 -5.876 1.00 0.00 H new ATOM 0 HB2 SER B 56 14.221 16.974 -4.771 1.00 0.00 H new ATOM 0 HB3 SER B 56 14.296 16.902 -6.521 1.00 0.00 H new ATOM 0 HG SER B 56 13.164 18.817 -6.678 1.00 0.00 H new ATOM 2499 N ALA B 57 10.755 17.368 -4.209 1.00 0.00 N ATOM 2500 CA ALA B 57 9.950 17.480 -2.998 1.00 0.00 C ATOM 2501 C ALA B 57 9.094 16.231 -2.800 1.00 0.00 C ATOM 2502 O ALA B 57 9.012 15.681 -1.700 1.00 0.00 O ATOM 2503 CB ALA B 57 9.075 18.725 -3.058 1.00 0.00 C ATOM 0 H ALA B 57 10.560 18.080 -4.913 1.00 0.00 H new ATOM 0 HA ALA B 57 10.622 17.569 -2.145 1.00 0.00 H new ATOM 0 HB1 ALA B 57 8.480 18.796 -2.148 1.00 0.00 H new ATOM 0 HB2 ALA B 57 9.706 19.609 -3.148 1.00 0.00 H new ATOM 0 HB3 ALA B 57 8.412 18.663 -3.921 1.00 0.00 H new ATOM 2509 N ASN B 58 8.482 15.770 -3.882 1.00 0.00 N ATOM 2510 CA ASN B 58 7.640 14.583 -3.831 1.00 0.00 C ATOM 2511 C ASN B 58 8.491 13.321 -3.730 1.00 0.00 C ATOM 2512 O ASN B 58 8.077 12.331 -3.130 1.00 0.00 O ATOM 2513 CB ASN B 58 6.714 14.523 -5.049 1.00 0.00 C ATOM 2514 CG ASN B 58 5.545 15.487 -4.926 1.00 0.00 C ATOM 2515 OD1 ASN B 58 4.491 15.134 -4.398 1.00 0.00 O ATOM 2516 ND2 ASN B 58 5.718 16.708 -5.408 1.00 0.00 N ATOM 0 H ASN B 58 8.553 16.199 -4.805 1.00 0.00 H new ATOM 0 HA ASN B 58 7.019 14.643 -2.937 1.00 0.00 H new ATOM 0 HB2 ASN B 58 7.283 14.757 -5.949 1.00 0.00 H new ATOM 0 HB3 ASN B 58 6.335 13.508 -5.166 1.00 0.00 H new ATOM 0 HD21 ASN B 58 4.963 17.392 -5.348 1.00 0.00 H new ATOM 0 HD22 ASN B 58 6.606 16.965 -5.839 1.00 0.00 H new ATOM 2523 N LEU B 59 9.686 13.370 -4.306 1.00 0.00 N ATOM 2524 CA LEU B 59 10.647 12.282 -4.168 1.00 0.00 C ATOM 2525 C LEU B 59 11.060 12.125 -2.708 1.00 0.00 C ATOM 2526 O LEU B 59 11.169 11.010 -2.197 1.00 0.00 O ATOM 2527 CB LEU B 59 11.877 12.546 -5.040 1.00 0.00 C ATOM 2528 CG LEU B 59 11.668 12.341 -6.539 1.00 0.00 C ATOM 2529 CD1 LEU B 59 12.817 12.947 -7.328 1.00 0.00 C ATOM 2530 CD2 LEU B 59 11.541 10.859 -6.850 1.00 0.00 C ATOM 0 H LEU B 59 10.013 14.152 -4.873 1.00 0.00 H new ATOM 0 HA LEU B 59 10.176 11.357 -4.500 1.00 0.00 H new ATOM 0 HB2 LEU B 59 12.208 13.571 -4.872 1.00 0.00 H new ATOM 0 HB3 LEU B 59 12.684 11.892 -4.709 1.00 0.00 H new ATOM 0 HG LEU B 59 10.747 12.844 -6.832 1.00 0.00 H new ATOM 0 HD11 LEU B 59 12.649 12.790 -8.394 1.00 0.00 H new ATOM 0 HD12 LEU B 59 12.875 14.016 -7.123 1.00 0.00 H new ATOM 0 HD13 LEU B 59 13.752 12.470 -7.034 1.00 0.00 H new ATOM 0 HD21 LEU B 59 11.392 10.723 -7.921 1.00 0.00 H new ATOM 0 HD22 LEU B 59 12.451 10.343 -6.542 1.00 0.00 H new ATOM 0 HD23 LEU B 59 10.689 10.446 -6.310 1.00 0.00 H new ATOM 2542 N GLN B 60 11.272 13.254 -2.043 1.00 0.00 N ATOM 2543 CA GLN B 60 11.605 13.268 -0.622 1.00 0.00 C ATOM 2544 C GLN B 60 10.478 12.645 0.201 1.00 0.00 C ATOM 2545 O GLN B 60 10.729 11.949 1.187 1.00 0.00 O ATOM 2546 CB GLN B 60 11.870 14.703 -0.161 1.00 0.00 C ATOM 2547 CG GLN B 60 12.168 14.832 1.324 1.00 0.00 C ATOM 2548 CD GLN B 60 12.326 16.273 1.759 1.00 0.00 C ATOM 2549 OE1 GLN B 60 11.353 16.932 2.123 1.00 0.00 O ATOM 2550 NE2 GLN B 60 13.553 16.766 1.737 1.00 0.00 N ATOM 0 H GLN B 60 11.219 14.180 -2.468 1.00 0.00 H new ATOM 0 HA GLN B 60 12.507 12.676 -0.470 1.00 0.00 H new ATOM 0 HB2 GLN B 60 12.711 15.105 -0.726 1.00 0.00 H new ATOM 0 HB3 GLN B 60 11.002 15.317 -0.401 1.00 0.00 H new ATOM 0 HG2 GLN B 60 11.363 14.370 1.895 1.00 0.00 H new ATOM 0 HG3 GLN B 60 13.080 14.283 1.558 1.00 0.00 H new ATOM 0 HE21 GLN B 60 14.331 16.184 1.428 1.00 0.00 H new ATOM 0 HE22 GLN B 60 13.721 17.729 2.029 1.00 0.00 H new ATOM 2559 N ALA B 61 9.240 12.892 -0.217 1.00 0.00 N ATOM 2560 CA ALA B 61 8.073 12.333 0.454 1.00 0.00 C ATOM 2561 C ALA B 61 8.046 10.810 0.327 1.00 0.00 C ATOM 2562 O ALA B 61 7.771 10.101 1.296 1.00 0.00 O ATOM 2563 CB ALA B 61 6.800 12.941 -0.113 1.00 0.00 C ATOM 0 H ALA B 61 9.020 13.479 -1.022 1.00 0.00 H new ATOM 0 HA ALA B 61 8.136 12.579 1.514 1.00 0.00 H new ATOM 0 HB1 ALA B 61 5.935 12.515 0.396 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.814 14.021 0.037 1.00 0.00 H new ATOM 0 HB3 ALA B 61 6.736 12.723 -1.179 1.00 0.00 H new ATOM 2569 N LEU B 62 8.351 10.310 -0.865 1.00 0.00 N ATOM 2570 CA LEU B 62 8.423 8.868 -1.097 1.00 0.00 C ATOM 2571 C LEU B 62 9.604 8.269 -0.340 1.00 0.00 C ATOM 2572 O LEU B 62 9.573 7.107 0.075 1.00 0.00 O ATOM 2573 CB LEU B 62 8.550 8.570 -2.593 1.00 0.00 C ATOM 2574 CG LEU B 62 7.375 9.034 -3.455 1.00 0.00 C ATOM 2575 CD1 LEU B 62 7.663 8.771 -4.924 1.00 0.00 C ATOM 2576 CD2 LEU B 62 6.090 8.336 -3.029 1.00 0.00 C ATOM 0 H LEU B 62 8.553 10.880 -1.687 1.00 0.00 H new ATOM 0 HA LEU B 62 7.503 8.414 -0.730 1.00 0.00 H new ATOM 0 HB2 LEU B 62 9.460 9.041 -2.964 1.00 0.00 H new ATOM 0 HB3 LEU B 62 8.672 7.495 -2.723 1.00 0.00 H new ATOM 0 HG LEU B 62 7.244 10.107 -3.314 1.00 0.00 H new ATOM 0 HD11 LEU B 62 6.818 9.106 -5.526 1.00 0.00 H new ATOM 0 HD12 LEU B 62 8.559 9.315 -5.222 1.00 0.00 H new ATOM 0 HD13 LEU B 62 7.818 7.703 -5.079 1.00 0.00 H new ATOM 0 HD21 LEU B 62 5.265 8.679 -3.654 1.00 0.00 H new ATOM 0 HD22 LEU B 62 6.207 7.258 -3.142 1.00 0.00 H new ATOM 0 HD23 LEU B 62 5.877 8.571 -1.986 1.00 0.00 H new ATOM 2588 N LYS B 63 10.640 9.077 -0.159 1.00 0.00 N ATOM 2589 CA LYS B 63 11.811 8.668 0.600 1.00 0.00 C ATOM 2590 C LYS B 63 11.446 8.530 2.076 1.00 0.00 C ATOM 2591 O LYS B 63 11.834 7.569 2.733 1.00 0.00 O ATOM 2592 CB LYS B 63 12.940 9.687 0.422 1.00 0.00 C ATOM 2593 CG LYS B 63 14.302 9.183 0.872 1.00 0.00 C ATOM 2594 CD LYS B 63 15.364 10.262 0.743 1.00 0.00 C ATOM 2595 CE LYS B 63 16.761 9.718 1.018 1.00 0.00 C ATOM 2596 NZ LYS B 63 16.913 9.199 2.405 1.00 0.00 N ATOM 0 H LYS B 63 10.692 10.025 -0.531 1.00 0.00 H new ATOM 0 HA LYS B 63 12.157 7.703 0.230 1.00 0.00 H new ATOM 0 HB2 LYS B 63 12.998 9.971 -0.629 1.00 0.00 H new ATOM 0 HB3 LYS B 63 12.694 10.589 0.983 1.00 0.00 H new ATOM 0 HG2 LYS B 63 14.244 8.850 1.908 1.00 0.00 H new ATOM 0 HG3 LYS B 63 14.587 8.317 0.274 1.00 0.00 H new ATOM 0 HD2 LYS B 63 15.330 10.687 -0.260 1.00 0.00 H new ATOM 0 HD3 LYS B 63 15.146 11.072 1.439 1.00 0.00 H new ATOM 0 HE2 LYS B 63 16.981 8.919 0.310 1.00 0.00 H new ATOM 0 HE3 LYS B 63 17.494 10.507 0.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 17.767 9.606 2.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 16.080 9.465 2.968 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 16.998 8.163 2.381 1.00 0.00 H new ATOM 2610 N SER B 64 10.675 9.489 2.582 1.00 0.00 N ATOM 2611 CA SER B 64 10.221 9.456 3.966 1.00 0.00 C ATOM 2612 C SER B 64 9.166 8.368 4.182 1.00 0.00 C ATOM 2613 O SER B 64 8.931 7.940 5.311 1.00 0.00 O ATOM 2614 CB SER B 64 9.686 10.827 4.385 1.00 0.00 C ATOM 2615 OG SER B 64 8.841 11.379 3.389 1.00 0.00 O ATOM 0 H SER B 64 10.352 10.299 2.052 1.00 0.00 H new ATOM 0 HA SER B 64 11.077 9.211 4.595 1.00 0.00 H new ATOM 0 HB2 SER B 64 9.135 10.734 5.321 1.00 0.00 H new ATOM 0 HB3 SER B 64 10.520 11.503 4.572 1.00 0.00 H new ATOM 0 HG SER B 64 8.447 10.656 2.857 1.00 0.00 H new ATOM 2621 N GLY B 65 8.520 7.931 3.101 1.00 0.00 N ATOM 2622 CA GLY B 65 7.644 6.781 3.186 1.00 0.00 C ATOM 2623 C GLY B 65 8.447 5.503 3.296 1.00 0.00 C ATOM 2624 O GLY B 65 8.013 4.529 3.911 1.00 0.00 O ATOM 0 H GLY B 65 8.589 8.353 2.175 1.00 0.00 H new ATOM 0 HA2 GLY B 65 6.989 6.880 4.051 1.00 0.00 H new ATOM 0 HA3 GLY B 65 7.004 6.739 2.305 1.00 0.00 H new ATOM 2628 N GLY B 66 9.647 5.528 2.722 1.00 0.00 N ATOM 2629 CA GLY B 66 10.531 4.381 2.774 1.00 0.00 C ATOM 2630 C GLY B 66 10.497 3.567 1.499 1.00 0.00 C ATOM 2631 O GLY B 66 10.800 2.376 1.509 1.00 0.00 O ATOM 0 H GLY B 66 10.023 6.331 2.218 1.00 0.00 H new ATOM 0 HA2 GLY B 66 11.551 4.720 2.958 1.00 0.00 H new ATOM 0 HA3 GLY B 66 10.249 3.747 3.614 1.00 0.00 H new ATOM 2635 N LEU B 67 10.122 4.204 0.398 1.00 0.00 N ATOM 2636 CA LEU B 67 10.021 3.500 -0.873 1.00 0.00 C ATOM 2637 C LEU B 67 11.259 3.727 -1.725 1.00 0.00 C ATOM 2638 O LEU B 67 11.793 2.794 -2.327 1.00 0.00 O ATOM 2639 CB LEU B 67 8.782 3.935 -1.658 1.00 0.00 C ATOM 2640 CG LEU B 67 7.440 3.779 -0.935 1.00 0.00 C ATOM 2641 CD1 LEU B 67 6.309 3.722 -1.943 1.00 0.00 C ATOM 2642 CD2 LEU B 67 7.425 2.539 -0.056 1.00 0.00 C ATOM 0 H LEU B 67 9.885 5.195 0.358 1.00 0.00 H new ATOM 0 HA LEU B 67 9.935 2.439 -0.640 1.00 0.00 H new ATOM 0 HB2 LEU B 67 8.902 4.982 -1.937 1.00 0.00 H new ATOM 0 HB3 LEU B 67 8.742 3.361 -2.584 1.00 0.00 H new ATOM 0 HG LEU B 67 7.302 4.647 -0.290 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.360 3.611 -1.419 1.00 0.00 H new ATOM 0 HD12 LEU B 67 6.296 4.642 -2.527 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.457 2.872 -2.609 1.00 0.00 H new ATOM 0 HD21 LEU B 67 6.459 2.458 0.442 1.00 0.00 H new ATOM 0 HD22 LEU B 67 7.591 1.655 -0.671 1.00 0.00 H new ATOM 0 HD23 LEU B 67 8.214 2.614 0.692 1.00 0.00 H new ATOM 2654 N VAL B 68 11.719 4.967 -1.778 1.00 0.00 N ATOM 2655 CA VAL B 68 12.852 5.311 -2.623 1.00 0.00 C ATOM 2656 C VAL B 68 14.039 5.789 -1.798 1.00 0.00 C ATOM 2657 O VAL B 68 13.897 6.168 -0.633 1.00 0.00 O ATOM 2658 CB VAL B 68 12.493 6.391 -3.670 1.00 0.00 C ATOM 2659 CG1 VAL B 68 11.377 5.906 -4.582 1.00 0.00 C ATOM 2660 CG2 VAL B 68 12.108 7.700 -2.999 1.00 0.00 C ATOM 0 H VAL B 68 11.329 5.747 -1.250 1.00 0.00 H new ATOM 0 HA VAL B 68 13.125 4.396 -3.149 1.00 0.00 H new ATOM 0 HB VAL B 68 13.379 6.574 -4.278 1.00 0.00 H new ATOM 0 HG11 VAL B 68 11.140 6.681 -5.311 1.00 0.00 H new ATOM 0 HG12 VAL B 68 11.699 5.004 -5.103 1.00 0.00 H new ATOM 0 HG13 VAL B 68 10.491 5.685 -3.987 1.00 0.00 H new ATOM 0 HG21 VAL B 68 11.861 8.440 -3.760 1.00 0.00 H new ATOM 0 HG22 VAL B 68 11.243 7.538 -2.356 1.00 0.00 H new ATOM 0 HG23 VAL B 68 12.944 8.061 -2.400 1.00 0.00 H new ATOM 2670 N GLU B 69 15.204 5.755 -2.418 1.00 0.00 N ATOM 2671 CA GLU B 69 16.431 6.229 -1.809 1.00 0.00 C ATOM 2672 C GLU B 69 17.156 7.158 -2.769 1.00 0.00 C ATOM 2673 O GLU B 69 16.857 7.180 -3.964 1.00 0.00 O ATOM 2674 CB GLU B 69 17.330 5.053 -1.428 1.00 0.00 C ATOM 2675 CG GLU B 69 17.383 4.808 0.067 1.00 0.00 C ATOM 2676 CD GLU B 69 17.773 6.058 0.824 1.00 0.00 C ATOM 2677 OE1 GLU B 69 18.759 6.715 0.424 1.00 0.00 O ATOM 2678 OE2 GLU B 69 17.082 6.409 1.800 1.00 0.00 O ATOM 0 H GLU B 69 15.325 5.395 -3.365 1.00 0.00 H new ATOM 0 HA GLU B 69 16.183 6.778 -0.901 1.00 0.00 H new ATOM 0 HB2 GLU B 69 16.971 4.152 -1.926 1.00 0.00 H new ATOM 0 HB3 GLU B 69 18.339 5.240 -1.796 1.00 0.00 H new ATOM 0 HG2 GLU B 69 16.410 4.461 0.414 1.00 0.00 H new ATOM 0 HG3 GLU B 69 18.099 4.014 0.281 1.00 0.00 H new ATOM 2685 N ALA B 70 18.105 7.916 -2.249 1.00 0.00 N ATOM 2686 CA ALA B 70 18.800 8.911 -3.047 1.00 0.00 C ATOM 2687 C ALA B 70 20.289 8.615 -3.122 1.00 0.00 C ATOM 2688 O ALA B 70 20.916 8.253 -2.123 1.00 0.00 O ATOM 2689 CB ALA B 70 18.566 10.301 -2.479 1.00 0.00 C ATOM 0 H ALA B 70 18.412 7.862 -1.278 1.00 0.00 H new ATOM 0 HA ALA B 70 18.398 8.871 -4.059 1.00 0.00 H new ATOM 0 HB1 ALA B 70 19.093 11.036 -3.087 1.00 0.00 H new ATOM 0 HB2 ALA B 70 17.499 10.522 -2.486 1.00 0.00 H new ATOM 0 HB3 ALA B 70 18.938 10.343 -1.455 1.00 0.00 H new ATOM 2695 N ARG B 71 20.840 8.759 -4.312 1.00 0.00 N ATOM 2696 CA ARG B 71 22.258 8.561 -4.538 1.00 0.00 C ATOM 2697 C ARG B 71 22.827 9.720 -5.340 1.00 0.00 C ATOM 2698 O ARG B 71 22.474 9.910 -6.505 1.00 0.00 O ATOM 2699 CB ARG B 71 22.502 7.247 -5.286 1.00 0.00 C ATOM 2700 CG ARG B 71 23.944 7.064 -5.740 1.00 0.00 C ATOM 2701 CD ARG B 71 24.113 5.804 -6.567 1.00 0.00 C ATOM 2702 NE ARG B 71 25.471 5.672 -7.102 1.00 0.00 N ATOM 2703 CZ ARG B 71 26.065 4.508 -7.350 1.00 0.00 C ATOM 2704 NH1 ARG B 71 25.406 3.371 -7.173 1.00 0.00 N ATOM 2705 NH2 ARG B 71 27.311 4.490 -7.805 1.00 0.00 N ATOM 0 H ARG B 71 20.317 9.017 -5.149 1.00 0.00 H new ATOM 0 HA ARG B 71 22.758 8.515 -3.571 1.00 0.00 H new ATOM 0 HB2 ARG B 71 22.224 6.414 -4.640 1.00 0.00 H new ATOM 0 HB3 ARG B 71 21.848 7.207 -6.157 1.00 0.00 H new ATOM 0 HG2 ARG B 71 24.254 7.929 -6.326 1.00 0.00 H new ATOM 0 HG3 ARG B 71 24.597 7.019 -4.869 1.00 0.00 H new ATOM 0 HD2 ARG B 71 23.880 4.934 -5.953 1.00 0.00 H new ATOM 0 HD3 ARG B 71 23.399 5.813 -7.391 1.00 0.00 H new ATOM 0 HE ARG B 71 25.993 6.526 -7.296 1.00 0.00 H new ATOM 0 HH11 ARG B 71 24.440 3.387 -6.846 1.00 0.00 H new ATOM 0 HH12 ARG B 71 25.865 2.480 -7.364 1.00 0.00 H new ATOM 0 HH21 ARG B 71 27.809 5.366 -7.963 1.00 0.00 H new ATOM 0 HH22 ARG B 71 27.771 3.600 -7.997 1.00 0.00 H new ATOM 2719 N ARG B 72 23.688 10.507 -4.720 1.00 0.00 N ATOM 2720 CA ARG B 72 24.379 11.562 -5.439 1.00 0.00 C ATOM 2721 C ARG B 72 25.536 10.988 -6.240 1.00 0.00 C ATOM 2722 O ARG B 72 26.371 10.249 -5.712 1.00 0.00 O ATOM 2723 CB ARG B 72 24.900 12.652 -4.502 1.00 0.00 C ATOM 2724 CG ARG B 72 23.909 13.777 -4.259 1.00 0.00 C ATOM 2725 CD ARG B 72 24.618 15.038 -3.788 1.00 0.00 C ATOM 2726 NE ARG B 72 25.663 15.450 -4.731 1.00 0.00 N ATOM 2727 CZ ARG B 72 26.461 16.503 -4.559 1.00 0.00 C ATOM 2728 NH1 ARG B 72 26.318 17.290 -3.502 1.00 0.00 N ATOM 2729 NH2 ARG B 72 27.403 16.771 -5.457 1.00 0.00 N ATOM 0 H ARG B 72 23.924 10.437 -3.730 1.00 0.00 H new ATOM 0 HA ARG B 72 23.653 12.016 -6.113 1.00 0.00 H new ATOM 0 HB2 ARG B 72 25.164 12.200 -3.546 1.00 0.00 H new ATOM 0 HB3 ARG B 72 25.815 13.071 -4.920 1.00 0.00 H new ATOM 0 HG2 ARG B 72 23.359 13.986 -5.177 1.00 0.00 H new ATOM 0 HG3 ARG B 72 23.178 13.467 -3.513 1.00 0.00 H new ATOM 0 HD2 ARG B 72 23.892 15.843 -3.672 1.00 0.00 H new ATOM 0 HD3 ARG B 72 25.060 14.864 -2.807 1.00 0.00 H new ATOM 0 HE ARG B 72 25.787 14.892 -5.576 1.00 0.00 H new ATOM 0 HH11 ARG B 72 25.593 17.091 -2.813 1.00 0.00 H new ATOM 0 HH12 ARG B 72 26.933 18.094 -3.378 1.00 0.00 H new ATOM 0 HH21 ARG B 72 27.513 16.171 -6.275 1.00 0.00 H new ATOM 0 HH22 ARG B 72 28.016 17.576 -5.329 1.00 0.00 H new ATOM 2743 N GLU B 73 25.573 11.331 -7.513 1.00 0.00 N ATOM 2744 CA GLU B 73 26.641 10.907 -8.397 1.00 0.00 C ATOM 2745 C GLU B 73 27.102 12.109 -9.210 1.00 0.00 C ATOM 2746 O GLU B 73 26.383 12.587 -10.090 1.00 0.00 O ATOM 2747 CB GLU B 73 26.152 9.787 -9.319 1.00 0.00 C ATOM 2748 CG GLU B 73 27.268 8.931 -9.888 1.00 0.00 C ATOM 2749 CD GLU B 73 28.027 8.190 -8.809 1.00 0.00 C ATOM 2750 OE1 GLU B 73 27.462 7.245 -8.224 1.00 0.00 O ATOM 2751 OE2 GLU B 73 29.193 8.549 -8.539 1.00 0.00 O ATOM 0 H GLU B 73 24.865 11.911 -7.963 1.00 0.00 H new ATOM 0 HA GLU B 73 27.476 10.519 -7.814 1.00 0.00 H new ATOM 0 HB2 GLU B 73 25.463 9.149 -8.766 1.00 0.00 H new ATOM 0 HB3 GLU B 73 25.588 10.227 -10.142 1.00 0.00 H new ATOM 0 HG2 GLU B 73 26.849 8.213 -10.593 1.00 0.00 H new ATOM 0 HG3 GLU B 73 27.959 9.562 -10.447 1.00 0.00 H new ATOM 2758 N GLY B 74 28.284 12.611 -8.893 1.00 0.00 N ATOM 2759 CA GLY B 74 28.737 13.853 -9.482 1.00 0.00 C ATOM 2760 C GLY B 74 27.920 15.025 -8.980 1.00 0.00 C ATOM 2761 O GLY B 74 27.838 15.259 -7.771 1.00 0.00 O ATOM 0 H GLY B 74 28.938 12.181 -8.239 1.00 0.00 H new ATOM 0 HA2 GLY B 74 29.789 14.010 -9.243 1.00 0.00 H new ATOM 0 HA3 GLY B 74 28.663 13.792 -10.568 1.00 0.00 H new ATOM 2765 N THR B 75 27.287 15.749 -9.890 1.00 0.00 N ATOM 2766 CA THR B 75 26.416 16.847 -9.505 1.00 0.00 C ATOM 2767 C THR B 75 24.955 16.417 -9.618 1.00 0.00 C ATOM 2768 O THR B 75 24.039 17.155 -9.255 1.00 0.00 O ATOM 2769 CB THR B 75 26.651 18.092 -10.385 1.00 0.00 C ATOM 2770 OG1 THR B 75 28.052 18.260 -10.635 1.00 0.00 O ATOM 2771 CG2 THR B 75 26.110 19.343 -9.706 1.00 0.00 C ATOM 0 H THR B 75 27.360 15.597 -10.896 1.00 0.00 H new ATOM 0 HA THR B 75 26.649 17.108 -8.473 1.00 0.00 H new ATOM 0 HB THR B 75 26.125 17.944 -11.328 1.00 0.00 H new ATOM 0 HG1 THR B 75 28.192 19.052 -11.196 1.00 0.00 H new ATOM 0 HG21 THR B 75 26.287 20.209 -10.344 1.00 0.00 H new ATOM 0 HG22 THR B 75 25.039 19.230 -9.535 1.00 0.00 H new ATOM 0 HG23 THR B 75 26.616 19.487 -8.751 1.00 0.00 H new ATOM 2779 N ARG B 76 24.738 15.205 -10.108 1.00 0.00 N ATOM 2780 CA ARG B 76 23.389 14.703 -10.296 1.00 0.00 C ATOM 2781 C ARG B 76 22.949 13.897 -9.085 1.00 0.00 C ATOM 2782 O ARG B 76 23.771 13.303 -8.384 1.00 0.00 O ATOM 2783 CB ARG B 76 23.292 13.824 -11.545 1.00 0.00 C ATOM 2784 CG ARG B 76 23.792 14.482 -12.816 1.00 0.00 C ATOM 2785 CD ARG B 76 23.406 13.662 -14.034 1.00 0.00 C ATOM 2786 NE ARG B 76 24.104 14.094 -15.240 1.00 0.00 N ATOM 2787 CZ ARG B 76 23.628 14.994 -16.099 1.00 0.00 C ATOM 2788 NH1 ARG B 76 22.497 15.640 -15.839 1.00 0.00 N ATOM 2789 NH2 ARG B 76 24.295 15.263 -17.212 1.00 0.00 N ATOM 0 H ARG B 76 25.476 14.556 -10.381 1.00 0.00 H new ATOM 0 HA ARG B 76 22.734 15.565 -10.421 1.00 0.00 H new ATOM 0 HB2 ARG B 76 23.861 12.910 -11.376 1.00 0.00 H new ATOM 0 HB3 ARG B 76 22.252 13.530 -11.688 1.00 0.00 H new ATOM 0 HG2 ARG B 76 23.375 15.485 -12.900 1.00 0.00 H new ATOM 0 HG3 ARG B 76 24.876 14.590 -12.773 1.00 0.00 H new ATOM 0 HD2 ARG B 76 23.627 12.611 -13.846 1.00 0.00 H new ATOM 0 HD3 ARG B 76 22.330 13.738 -14.193 1.00 0.00 H new ATOM 0 HE ARG B 76 25.015 13.680 -15.438 1.00 0.00 H new ATOM 0 HH11 ARG B 76 21.987 15.448 -14.977 1.00 0.00 H new ATOM 0 HH12 ARG B 76 22.139 16.328 -16.501 1.00 0.00 H new ATOM 0 HH21 ARG B 76 25.172 14.781 -17.410 1.00 0.00 H new ATOM 0 HH22 ARG B 76 23.932 15.952 -17.871 1.00 0.00 H new ATOM 2803 N GLN B 77 21.654 13.888 -8.839 1.00 0.00 N ATOM 2804 CA GLN B 77 21.095 13.094 -7.767 1.00 0.00 C ATOM 2805 C GLN B 77 20.168 12.044 -8.354 1.00 0.00 C ATOM 2806 O GLN B 77 19.167 12.371 -8.991 1.00 0.00 O ATOM 2807 CB GLN B 77 20.342 13.979 -6.771 1.00 0.00 C ATOM 2808 CG GLN B 77 19.886 13.237 -5.525 1.00 0.00 C ATOM 2809 CD GLN B 77 19.169 14.133 -4.535 1.00 0.00 C ATOM 2810 OE1 GLN B 77 18.473 15.142 -5.038 1.00 0.00 O flip ATOM 2811 NE2 GLN B 77 19.236 13.919 -3.327 1.00 0.00 N flip ATOM 0 H GLN B 77 20.968 14.424 -9.370 1.00 0.00 H new ATOM 0 HA GLN B 77 21.904 12.601 -7.228 1.00 0.00 H new ATOM 0 HB2 GLN B 77 20.985 14.808 -6.476 1.00 0.00 H new ATOM 0 HB3 GLN B 77 19.472 14.411 -7.266 1.00 0.00 H new ATOM 0 HG2 GLN B 77 19.223 12.422 -5.816 1.00 0.00 H new ATOM 0 HG3 GLN B 77 20.752 12.787 -5.039 1.00 0.00 H new ATOM 0 HE21 GLN B 77 19.782 13.132 -2.978 1.00 0.00 H new ATOM 0 HE22 GLN B 77 18.745 14.529 -2.673 1.00 0.00 H new ATOM 2820 N TYR B 78 20.523 10.788 -8.169 1.00 0.00 N ATOM 2821 CA TYR B 78 19.748 9.688 -8.709 1.00 0.00 C ATOM 2822 C TYR B 78 18.838 9.109 -7.638 1.00 0.00 C ATOM 2823 O TYR B 78 19.264 8.871 -6.509 1.00 0.00 O ATOM 2824 CB TYR B 78 20.677 8.596 -9.252 1.00 0.00 C ATOM 2825 CG TYR B 78 21.475 9.018 -10.467 1.00 0.00 C ATOM 2826 CD1 TYR B 78 22.647 9.753 -10.339 1.00 0.00 C ATOM 2827 CD2 TYR B 78 21.055 8.676 -11.743 1.00 0.00 C ATOM 2828 CE1 TYR B 78 23.375 10.137 -11.450 1.00 0.00 C ATOM 2829 CE2 TYR B 78 21.776 9.054 -12.858 1.00 0.00 C ATOM 2830 CZ TYR B 78 22.934 9.782 -12.709 1.00 0.00 C ATOM 2831 OH TYR B 78 23.651 10.160 -13.820 1.00 0.00 O ATOM 0 H TYR B 78 21.350 10.502 -7.645 1.00 0.00 H new ATOM 0 HA TYR B 78 19.135 10.067 -9.527 1.00 0.00 H new ATOM 0 HB2 TYR B 78 21.366 8.294 -8.464 1.00 0.00 H new ATOM 0 HB3 TYR B 78 20.081 7.720 -9.507 1.00 0.00 H new ATOM 0 HD1 TYR B 78 22.995 10.029 -9.355 1.00 0.00 H new ATOM 0 HD2 TYR B 78 20.148 8.104 -11.867 1.00 0.00 H new ATOM 0 HE1 TYR B 78 24.283 10.711 -11.334 1.00 0.00 H new ATOM 0 HE2 TYR B 78 21.432 8.779 -13.844 1.00 0.00 H new ATOM 0 HH TYR B 78 23.204 9.828 -14.626 1.00 0.00 H new ATOM 2841 N TYR B 79 17.583 8.899 -7.987 1.00 0.00 N ATOM 2842 CA TYR B 79 16.644 8.283 -7.074 1.00 0.00 C ATOM 2843 C TYR B 79 16.354 6.862 -7.508 1.00 0.00 C ATOM 2844 O TYR B 79 16.089 6.598 -8.682 1.00 0.00 O ATOM 2845 CB TYR B 79 15.353 9.094 -6.977 1.00 0.00 C ATOM 2846 CG TYR B 79 15.463 10.291 -6.060 1.00 0.00 C ATOM 2847 CD1 TYR B 79 15.991 11.492 -6.510 1.00 0.00 C ATOM 2848 CD2 TYR B 79 15.042 10.214 -4.739 1.00 0.00 C ATOM 2849 CE1 TYR B 79 16.094 12.584 -5.671 1.00 0.00 C ATOM 2850 CE2 TYR B 79 15.141 11.302 -3.894 1.00 0.00 C ATOM 2851 CZ TYR B 79 15.668 12.485 -4.364 1.00 0.00 C ATOM 2852 OH TYR B 79 15.769 13.572 -3.529 1.00 0.00 O ATOM 0 H TYR B 79 17.192 9.146 -8.896 1.00 0.00 H new ATOM 0 HA TYR B 79 17.095 8.262 -6.082 1.00 0.00 H new ATOM 0 HB2 TYR B 79 15.070 9.434 -7.973 1.00 0.00 H new ATOM 0 HB3 TYR B 79 14.552 8.446 -6.622 1.00 0.00 H new ATOM 0 HD1 TYR B 79 16.327 11.574 -7.533 1.00 0.00 H new ATOM 0 HD2 TYR B 79 14.630 9.288 -4.366 1.00 0.00 H new ATOM 0 HE1 TYR B 79 16.507 13.512 -6.038 1.00 0.00 H new ATOM 0 HE2 TYR B 79 14.807 11.226 -2.870 1.00 0.00 H new ATOM 0 HH TYR B 79 15.424 13.337 -2.642 1.00 0.00 H new ATOM 2862 N ARG B 80 16.426 5.953 -6.557 1.00 0.00 N ATOM 2863 CA ARG B 80 16.224 4.544 -6.825 1.00 0.00 C ATOM 2864 C ARG B 80 15.281 3.957 -5.796 1.00 0.00 C ATOM 2865 O ARG B 80 15.000 4.585 -4.782 1.00 0.00 O ATOM 2866 CB ARG B 80 17.565 3.802 -6.798 1.00 0.00 C ATOM 2867 CG ARG B 80 18.289 3.875 -5.463 1.00 0.00 C ATOM 2868 CD ARG B 80 19.686 3.279 -5.550 1.00 0.00 C ATOM 2869 NE ARG B 80 19.675 1.927 -6.106 1.00 0.00 N ATOM 2870 CZ ARG B 80 19.774 0.818 -5.374 1.00 0.00 C ATOM 2871 NH1 ARG B 80 19.941 0.898 -4.059 1.00 0.00 N ATOM 2872 NH2 ARG B 80 19.727 -0.374 -5.965 1.00 0.00 N ATOM 0 H ARG B 80 16.625 6.169 -5.580 1.00 0.00 H new ATOM 0 HA ARG B 80 15.784 4.431 -7.816 1.00 0.00 H new ATOM 0 HB2 ARG B 80 17.394 2.755 -7.049 1.00 0.00 H new ATOM 0 HB3 ARG B 80 18.212 4.214 -7.573 1.00 0.00 H new ATOM 0 HG2 ARG B 80 18.356 4.914 -5.141 1.00 0.00 H new ATOM 0 HG3 ARG B 80 17.712 3.343 -4.706 1.00 0.00 H new ATOM 0 HD2 ARG B 80 20.315 3.919 -6.169 1.00 0.00 H new ATOM 0 HD3 ARG B 80 20.133 3.258 -4.556 1.00 0.00 H new ATOM 0 HE ARG B 80 19.586 1.826 -7.117 1.00 0.00 H new ATOM 0 HH11 ARG B 80 19.994 1.810 -3.606 1.00 0.00 H new ATOM 0 HH12 ARG B 80 20.016 0.047 -3.502 1.00 0.00 H new ATOM 0 HH21 ARG B 80 19.615 -0.437 -6.977 1.00 0.00 H new ATOM 0 HH22 ARG B 80 19.803 -1.224 -5.406 1.00 0.00 H new ATOM 2886 N ILE B 81 14.783 2.765 -6.057 1.00 0.00 N ATOM 2887 CA ILE B 81 13.930 2.087 -5.101 1.00 0.00 C ATOM 2888 C ILE B 81 14.784 1.550 -3.953 1.00 0.00 C ATOM 2889 O ILE B 81 15.859 0.993 -4.183 1.00 0.00 O ATOM 2890 CB ILE B 81 13.134 0.947 -5.773 1.00 0.00 C ATOM 2891 CG1 ILE B 81 12.276 1.512 -6.912 1.00 0.00 C ATOM 2892 CG2 ILE B 81 12.263 0.225 -4.753 1.00 0.00 C ATOM 2893 CD1 ILE B 81 11.426 0.475 -7.616 1.00 0.00 C ATOM 0 H ILE B 81 14.953 2.247 -6.919 1.00 0.00 H new ATOM 0 HA ILE B 81 13.206 2.800 -4.707 1.00 0.00 H new ATOM 0 HB ILE B 81 13.837 0.224 -6.187 1.00 0.00 H new ATOM 0 HG12 ILE B 81 11.625 2.289 -6.512 1.00 0.00 H new ATOM 0 HG13 ILE B 81 12.929 1.989 -7.643 1.00 0.00 H new ATOM 0 HG21 ILE B 81 11.711 -0.574 -5.247 1.00 0.00 H new ATOM 0 HG22 ILE B 81 12.893 -0.199 -3.971 1.00 0.00 H new ATOM 0 HG23 ILE B 81 11.561 0.931 -4.310 1.00 0.00 H new ATOM 0 HD11 ILE B 81 10.849 0.954 -8.408 1.00 0.00 H new ATOM 0 HD12 ILE B 81 12.070 -0.291 -8.048 1.00 0.00 H new ATOM 0 HD13 ILE B 81 10.746 0.015 -6.899 1.00 0.00 H new ATOM 2905 N ALA B 82 14.308 1.742 -2.723 1.00 0.00 N ATOM 2906 CA ALA B 82 15.069 1.390 -1.523 1.00 0.00 C ATOM 2907 C ALA B 82 15.513 -0.070 -1.532 1.00 0.00 C ATOM 2908 O ALA B 82 16.620 -0.394 -1.095 1.00 0.00 O ATOM 2909 CB ALA B 82 14.250 1.687 -0.276 1.00 0.00 C ATOM 0 H ALA B 82 13.390 2.143 -2.530 1.00 0.00 H new ATOM 0 HA ALA B 82 15.971 2.002 -1.516 1.00 0.00 H new ATOM 0 HB1 ALA B 82 14.827 1.421 0.610 1.00 0.00 H new ATOM 0 HB2 ALA B 82 14.006 2.749 -0.245 1.00 0.00 H new ATOM 0 HB3 ALA B 82 13.329 1.104 -0.298 1.00 0.00 H new ATOM 2915 N GLY B 83 14.657 -0.946 -2.038 1.00 0.00 N ATOM 2916 CA GLY B 83 15.000 -2.348 -2.102 1.00 0.00 C ATOM 2917 C GLY B 83 14.062 -3.132 -2.990 1.00 0.00 C ATOM 2918 O GLY B 83 13.053 -2.601 -3.459 1.00 0.00 O ATOM 0 H GLY B 83 13.735 -0.710 -2.404 1.00 0.00 H new ATOM 0 HA2 GLY B 83 16.019 -2.453 -2.473 1.00 0.00 H new ATOM 0 HA3 GLY B 83 14.982 -2.770 -1.097 1.00 0.00 H new ATOM 2922 N GLU B 84 14.388 -4.401 -3.205 1.00 0.00 N ATOM 2923 CA GLU B 84 13.582 -5.283 -4.050 1.00 0.00 C ATOM 2924 C GLU B 84 12.173 -5.426 -3.480 1.00 0.00 C ATOM 2925 O GLU B 84 11.205 -5.636 -4.213 1.00 0.00 O ATOM 2926 CB GLU B 84 14.247 -6.659 -4.141 1.00 0.00 C ATOM 2927 CG GLU B 84 13.636 -7.570 -5.192 1.00 0.00 C ATOM 2928 CD GLU B 84 13.902 -7.082 -6.599 1.00 0.00 C ATOM 2929 OE1 GLU B 84 15.011 -7.329 -7.115 1.00 0.00 O ATOM 2930 OE2 GLU B 84 13.011 -6.443 -7.194 1.00 0.00 O ATOM 0 H GLU B 84 15.212 -4.848 -2.803 1.00 0.00 H new ATOM 0 HA GLU B 84 13.512 -4.847 -5.047 1.00 0.00 H new ATOM 0 HB2 GLU B 84 15.306 -6.526 -4.361 1.00 0.00 H new ATOM 0 HB3 GLU B 84 14.183 -7.148 -3.169 1.00 0.00 H new ATOM 0 HG2 GLU B 84 14.039 -8.576 -5.076 1.00 0.00 H new ATOM 0 HG3 GLU B 84 12.560 -7.637 -5.030 1.00 0.00 H new ATOM 2937 N ASP B 85 12.075 -5.294 -2.163 1.00 0.00 N ATOM 2938 CA ASP B 85 10.810 -5.423 -1.450 1.00 0.00 C ATOM 2939 C ASP B 85 9.802 -4.392 -1.950 1.00 0.00 C ATOM 2940 O ASP B 85 8.667 -4.726 -2.274 1.00 0.00 O ATOM 2941 CB ASP B 85 11.040 -5.237 0.052 1.00 0.00 C ATOM 2942 CG ASP B 85 12.262 -5.985 0.546 1.00 0.00 C ATOM 2943 OD1 ASP B 85 12.135 -7.165 0.932 1.00 0.00 O ATOM 2944 OD2 ASP B 85 13.366 -5.395 0.527 1.00 0.00 O ATOM 0 H ASP B 85 12.872 -5.094 -1.558 1.00 0.00 H new ATOM 0 HA ASP B 85 10.408 -6.419 -1.635 1.00 0.00 H new ATOM 0 HB2 ASP B 85 11.154 -4.175 0.271 1.00 0.00 H new ATOM 0 HB3 ASP B 85 10.161 -5.582 0.597 1.00 0.00 H new ATOM 2949 N VAL B 86 10.238 -3.140 -2.029 1.00 0.00 N ATOM 2950 CA VAL B 86 9.386 -2.050 -2.496 1.00 0.00 C ATOM 2951 C VAL B 86 9.067 -2.218 -3.978 1.00 0.00 C ATOM 2952 O VAL B 86 7.947 -1.957 -4.417 1.00 0.00 O ATOM 2953 CB VAL B 86 10.055 -0.681 -2.271 1.00 0.00 C ATOM 2954 CG1 VAL B 86 9.135 0.448 -2.710 1.00 0.00 C ATOM 2955 CG2 VAL B 86 10.454 -0.511 -0.813 1.00 0.00 C ATOM 0 H VAL B 86 11.183 -2.852 -1.774 1.00 0.00 H new ATOM 0 HA VAL B 86 8.462 -2.087 -1.918 1.00 0.00 H new ATOM 0 HB VAL B 86 10.958 -0.640 -2.880 1.00 0.00 H new ATOM 0 HG11 VAL B 86 9.628 1.405 -2.542 1.00 0.00 H new ATOM 0 HG12 VAL B 86 8.906 0.339 -3.770 1.00 0.00 H new ATOM 0 HG13 VAL B 86 8.211 0.410 -2.133 1.00 0.00 H new ATOM 0 HG21 VAL B 86 10.925 0.462 -0.676 1.00 0.00 H new ATOM 0 HG22 VAL B 86 9.567 -0.577 -0.183 1.00 0.00 H new ATOM 0 HG23 VAL B 86 11.157 -1.296 -0.534 1.00 0.00 H new ATOM 2965 N ALA B 87 10.060 -2.669 -4.739 1.00 0.00 N ATOM 2966 CA ALA B 87 9.889 -2.896 -6.171 1.00 0.00 C ATOM 2967 C ALA B 87 8.796 -3.927 -6.430 1.00 0.00 C ATOM 2968 O ALA B 87 7.863 -3.679 -7.195 1.00 0.00 O ATOM 2969 CB ALA B 87 11.200 -3.346 -6.797 1.00 0.00 C ATOM 0 H ALA B 87 10.993 -2.885 -4.387 1.00 0.00 H new ATOM 0 HA ALA B 87 9.587 -1.955 -6.631 1.00 0.00 H new ATOM 0 HB1 ALA B 87 11.056 -3.511 -7.865 1.00 0.00 H new ATOM 0 HB2 ALA B 87 11.957 -2.576 -6.648 1.00 0.00 H new ATOM 0 HB3 ALA B 87 11.528 -4.274 -6.328 1.00 0.00 H new ATOM 2975 N ARG B 88 8.910 -5.079 -5.775 1.00 0.00 N ATOM 2976 CA ARG B 88 7.910 -6.134 -5.902 1.00 0.00 C ATOM 2977 C ARG B 88 6.566 -5.691 -5.333 1.00 0.00 C ATOM 2978 O ARG B 88 5.515 -6.092 -5.829 1.00 0.00 O ATOM 2979 CB ARG B 88 8.369 -7.411 -5.192 1.00 0.00 C ATOM 2980 CG ARG B 88 9.328 -8.264 -6.006 1.00 0.00 C ATOM 2981 CD ARG B 88 9.673 -9.552 -5.273 1.00 0.00 C ATOM 2982 NE ARG B 88 10.308 -10.541 -6.147 1.00 0.00 N ATOM 2983 CZ ARG B 88 10.109 -11.856 -6.044 1.00 0.00 C ATOM 2984 NH1 ARG B 88 9.311 -12.333 -5.097 1.00 0.00 N ATOM 2985 NH2 ARG B 88 10.709 -12.690 -6.887 1.00 0.00 N ATOM 0 H ARG B 88 9.685 -5.305 -5.151 1.00 0.00 H new ATOM 0 HA ARG B 88 7.790 -6.341 -6.965 1.00 0.00 H new ATOM 0 HB2 ARG B 88 8.850 -7.139 -4.253 1.00 0.00 H new ATOM 0 HB3 ARG B 88 7.493 -8.008 -4.940 1.00 0.00 H new ATOM 0 HG2 ARG B 88 8.880 -8.500 -6.971 1.00 0.00 H new ATOM 0 HG3 ARG B 88 10.239 -7.701 -6.207 1.00 0.00 H new ATOM 0 HD2 ARG B 88 10.340 -9.326 -4.441 1.00 0.00 H new ATOM 0 HD3 ARG B 88 8.765 -9.978 -4.847 1.00 0.00 H new ATOM 0 HE ARG B 88 10.938 -10.205 -6.876 1.00 0.00 H new ATOM 0 HH11 ARG B 88 8.850 -11.694 -4.449 1.00 0.00 H new ATOM 0 HH12 ARG B 88 9.158 -13.338 -5.017 1.00 0.00 H new ATOM 0 HH21 ARG B 88 11.323 -12.325 -7.615 1.00 0.00 H new ATOM 0 HH22 ARG B 88 10.555 -13.695 -6.806 1.00 0.00 H new ATOM 2999 N LEU B 89 6.608 -4.872 -4.288 1.00 0.00 N ATOM 3000 CA LEU B 89 5.392 -4.360 -3.663 1.00 0.00 C ATOM 3001 C LEU B 89 4.581 -3.559 -4.676 1.00 0.00 C ATOM 3002 O LEU B 89 3.397 -3.833 -4.895 1.00 0.00 O ATOM 3003 CB LEU B 89 5.762 -3.491 -2.449 1.00 0.00 C ATOM 3004 CG LEU B 89 4.642 -3.210 -1.437 1.00 0.00 C ATOM 3005 CD1 LEU B 89 5.238 -2.663 -0.153 1.00 0.00 C ATOM 3006 CD2 LEU B 89 3.628 -2.218 -1.988 1.00 0.00 C ATOM 0 H LEU B 89 7.472 -4.547 -3.854 1.00 0.00 H new ATOM 0 HA LEU B 89 4.781 -5.195 -3.321 1.00 0.00 H new ATOM 0 HB2 LEU B 89 6.584 -3.975 -1.922 1.00 0.00 H new ATOM 0 HB3 LEU B 89 6.137 -2.536 -2.816 1.00 0.00 H new ATOM 0 HG LEU B 89 4.126 -4.149 -1.239 1.00 0.00 H new ATOM 0 HD11 LEU B 89 4.440 -2.465 0.563 1.00 0.00 H new ATOM 0 HD12 LEU B 89 5.929 -3.393 0.267 1.00 0.00 H new ATOM 0 HD13 LEU B 89 5.773 -1.737 -0.366 1.00 0.00 H new ATOM 0 HD21 LEU B 89 2.850 -2.043 -1.245 1.00 0.00 H new ATOM 0 HD22 LEU B 89 4.128 -1.277 -2.219 1.00 0.00 H new ATOM 0 HD23 LEU B 89 3.179 -2.623 -2.895 1.00 0.00 H new ATOM 3018 N PHE B 90 5.230 -2.585 -5.305 1.00 0.00 N ATOM 3019 CA PHE B 90 4.569 -1.735 -6.286 1.00 0.00 C ATOM 3020 C PHE B 90 4.147 -2.553 -7.504 1.00 0.00 C ATOM 3021 O PHE B 90 3.071 -2.342 -8.063 1.00 0.00 O ATOM 3022 CB PHE B 90 5.490 -0.586 -6.712 1.00 0.00 C ATOM 3023 CG PHE B 90 4.840 0.389 -7.656 1.00 0.00 C ATOM 3024 CD1 PHE B 90 3.940 1.331 -7.183 1.00 0.00 C ATOM 3025 CD2 PHE B 90 5.122 0.360 -9.013 1.00 0.00 C ATOM 3026 CE1 PHE B 90 3.334 2.226 -8.046 1.00 0.00 C ATOM 3027 CE2 PHE B 90 4.518 1.252 -9.879 1.00 0.00 C ATOM 3028 CZ PHE B 90 3.623 2.187 -9.395 1.00 0.00 C ATOM 0 H PHE B 90 6.214 -2.365 -5.152 1.00 0.00 H new ATOM 0 HA PHE B 90 3.677 -1.311 -5.825 1.00 0.00 H new ATOM 0 HB2 PHE B 90 5.824 -0.051 -5.823 1.00 0.00 H new ATOM 0 HB3 PHE B 90 6.379 -1.001 -7.187 1.00 0.00 H new ATOM 0 HD1 PHE B 90 3.709 1.367 -6.129 1.00 0.00 H new ATOM 0 HD2 PHE B 90 5.821 -0.368 -9.398 1.00 0.00 H new ATOM 0 HE1 PHE B 90 2.635 2.955 -7.664 1.00 0.00 H new ATOM 0 HE2 PHE B 90 4.746 1.218 -10.934 1.00 0.00 H new ATOM 0 HZ PHE B 90 3.151 2.885 -10.070 1.00 0.00 H new ATOM 3038 N ALA B 91 4.991 -3.501 -7.899 1.00 0.00 N ATOM 3039 CA ALA B 91 4.698 -4.359 -9.039 1.00 0.00 C ATOM 3040 C ALA B 91 3.463 -5.215 -8.775 1.00 0.00 C ATOM 3041 O ALA B 91 2.571 -5.309 -9.617 1.00 0.00 O ATOM 3042 CB ALA B 91 5.896 -5.239 -9.361 1.00 0.00 C ATOM 0 H ALA B 91 5.884 -3.694 -7.445 1.00 0.00 H new ATOM 0 HA ALA B 91 4.491 -3.722 -9.899 1.00 0.00 H new ATOM 0 HB1 ALA B 91 5.662 -5.874 -10.215 1.00 0.00 H new ATOM 0 HB2 ALA B 91 6.755 -4.612 -9.600 1.00 0.00 H new ATOM 0 HB3 ALA B 91 6.132 -5.863 -8.499 1.00 0.00 H new ATOM 3048 N LEU B 92 3.411 -5.820 -7.592 1.00 0.00 N ATOM 3049 CA LEU B 92 2.312 -6.708 -7.230 1.00 0.00 C ATOM 3050 C LEU B 92 0.987 -5.955 -7.188 1.00 0.00 C ATOM 3051 O LEU B 92 0.011 -6.377 -7.809 1.00 0.00 O ATOM 3052 CB LEU B 92 2.584 -7.377 -5.879 1.00 0.00 C ATOM 3053 CG LEU B 92 1.536 -8.402 -5.427 1.00 0.00 C ATOM 3054 CD1 LEU B 92 1.401 -9.520 -6.450 1.00 0.00 C ATOM 3055 CD2 LEU B 92 1.906 -8.973 -4.065 1.00 0.00 C ATOM 0 H LEU B 92 4.119 -5.711 -6.866 1.00 0.00 H new ATOM 0 HA LEU B 92 2.240 -7.480 -7.996 1.00 0.00 H new ATOM 0 HB2 LEU B 92 3.554 -7.872 -5.927 1.00 0.00 H new ATOM 0 HB3 LEU B 92 2.660 -6.601 -5.118 1.00 0.00 H new ATOM 0 HG LEU B 92 0.575 -7.895 -5.344 1.00 0.00 H new ATOM 0 HD11 LEU B 92 0.653 -10.236 -6.110 1.00 0.00 H new ATOM 0 HD12 LEU B 92 1.093 -9.101 -7.408 1.00 0.00 H new ATOM 0 HD13 LEU B 92 2.360 -10.025 -6.566 1.00 0.00 H new ATOM 0 HD21 LEU B 92 1.153 -9.699 -3.758 1.00 0.00 H new ATOM 0 HD22 LEU B 92 2.878 -9.463 -4.128 1.00 0.00 H new ATOM 0 HD23 LEU B 92 1.953 -8.167 -3.333 1.00 0.00 H new ATOM 3067 N VAL B 93 0.957 -4.830 -6.475 1.00 0.00 N ATOM 3068 CA VAL B 93 -0.270 -4.049 -6.345 1.00 0.00 C ATOM 3069 C VAL B 93 -0.720 -3.507 -7.708 1.00 0.00 C ATOM 3070 O VAL B 93 -1.918 -3.372 -7.969 1.00 0.00 O ATOM 3071 CB VAL B 93 -0.112 -2.893 -5.323 1.00 0.00 C ATOM 3072 CG1 VAL B 93 0.913 -1.871 -5.788 1.00 0.00 C ATOM 3073 CG2 VAL B 93 -1.452 -2.225 -5.052 1.00 0.00 C ATOM 0 H VAL B 93 1.762 -4.442 -5.983 1.00 0.00 H new ATOM 0 HA VAL B 93 -1.042 -4.719 -5.966 1.00 0.00 H new ATOM 0 HB VAL B 93 0.253 -3.326 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL B 93 0.997 -1.076 -5.047 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.881 -2.356 -5.910 1.00 0.00 H new ATOM 0 HG13 VAL B 93 0.597 -1.446 -6.741 1.00 0.00 H new ATOM 0 HG21 VAL B 93 -1.317 -1.417 -4.332 1.00 0.00 H new ATOM 0 HG22 VAL B 93 -1.851 -1.820 -5.982 1.00 0.00 H new ATOM 0 HG23 VAL B 93 -2.149 -2.959 -4.647 1.00 0.00 H new ATOM 3083 N GLN B 94 0.244 -3.228 -8.584 1.00 0.00 N ATOM 3084 CA GLN B 94 -0.055 -2.794 -9.942 1.00 0.00 C ATOM 3085 C GLN B 94 -0.812 -3.889 -10.683 1.00 0.00 C ATOM 3086 O GLN B 94 -1.803 -3.623 -11.366 1.00 0.00 O ATOM 3087 CB GLN B 94 1.240 -2.444 -10.683 1.00 0.00 C ATOM 3088 CG GLN B 94 1.031 -2.032 -12.135 1.00 0.00 C ATOM 3089 CD GLN B 94 2.328 -1.692 -12.847 1.00 0.00 C ATOM 3090 OE1 GLN B 94 3.420 -2.314 -12.424 1.00 0.00 O flip ATOM 3091 NE2 GLN B 94 2.347 -0.878 -13.770 1.00 0.00 N flip ATOM 0 H GLN B 94 1.240 -3.296 -8.374 1.00 0.00 H new ATOM 0 HA GLN B 94 -0.681 -1.903 -9.899 1.00 0.00 H new ATOM 0 HB2 GLN B 94 1.741 -1.633 -10.154 1.00 0.00 H new ATOM 0 HB3 GLN B 94 1.908 -3.305 -10.653 1.00 0.00 H new ATOM 0 HG2 GLN B 94 0.531 -2.841 -12.668 1.00 0.00 H new ATOM 0 HG3 GLN B 94 0.366 -1.169 -12.170 1.00 0.00 H new ATOM 0 HE21 GLN B 94 1.484 -0.421 -14.065 1.00 0.00 H new ATOM 0 HE22 GLN B 94 3.226 -0.660 -14.240 1.00 0.00 H new ATOM 3100 N VAL B 95 -0.348 -5.125 -10.529 1.00 0.00 N ATOM 3101 CA VAL B 95 -1.004 -6.272 -11.145 1.00 0.00 C ATOM 3102 C VAL B 95 -2.407 -6.452 -10.576 1.00 0.00 C ATOM 3103 O VAL B 95 -3.356 -6.703 -11.317 1.00 0.00 O ATOM 3104 CB VAL B 95 -0.198 -7.575 -10.936 1.00 0.00 C ATOM 3105 CG1 VAL B 95 -0.918 -8.767 -11.551 1.00 0.00 C ATOM 3106 CG2 VAL B 95 1.198 -7.438 -11.521 1.00 0.00 C ATOM 0 H VAL B 95 0.481 -5.358 -9.982 1.00 0.00 H new ATOM 0 HA VAL B 95 -1.063 -6.072 -12.215 1.00 0.00 H new ATOM 0 HB VAL B 95 -0.110 -7.749 -9.864 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -0.330 -9.670 -11.390 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -1.896 -8.882 -11.083 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -1.045 -8.603 -12.621 1.00 0.00 H new ATOM 0 HG21 VAL B 95 1.751 -8.364 -11.365 1.00 0.00 H new ATOM 0 HG22 VAL B 95 1.126 -7.234 -12.589 1.00 0.00 H new ATOM 0 HG23 VAL B 95 1.720 -6.617 -11.029 1.00 0.00 H new ATOM 3116 N VAL B 96 -2.529 -6.306 -9.259 1.00 0.00 N ATOM 3117 CA VAL B 96 -3.818 -6.419 -8.586 1.00 0.00 C ATOM 3118 C VAL B 96 -4.831 -5.453 -9.195 1.00 0.00 C ATOM 3119 O VAL B 96 -5.953 -5.840 -9.522 1.00 0.00 O ATOM 3120 CB VAL B 96 -3.692 -6.144 -7.069 1.00 0.00 C ATOM 3121 CG1 VAL B 96 -5.057 -6.153 -6.394 1.00 0.00 C ATOM 3122 CG2 VAL B 96 -2.776 -7.168 -6.417 1.00 0.00 C ATOM 0 H VAL B 96 -1.746 -6.108 -8.635 1.00 0.00 H new ATOM 0 HA VAL B 96 -4.166 -7.443 -8.725 1.00 0.00 H new ATOM 0 HB VAL B 96 -3.257 -5.152 -6.943 1.00 0.00 H new ATOM 0 HG11 VAL B 96 -4.937 -5.957 -5.328 1.00 0.00 H new ATOM 0 HG12 VAL B 96 -5.687 -5.381 -6.836 1.00 0.00 H new ATOM 0 HG13 VAL B 96 -5.525 -7.127 -6.533 1.00 0.00 H new ATOM 0 HG21 VAL B 96 -2.699 -6.960 -5.350 1.00 0.00 H new ATOM 0 HG22 VAL B 96 -3.186 -8.168 -6.563 1.00 0.00 H new ATOM 0 HG23 VAL B 96 -1.786 -7.112 -6.870 1.00 0.00 H new ATOM 3132 N ALA B 97 -4.425 -4.201 -9.357 1.00 0.00 N ATOM 3133 CA ALA B 97 -5.285 -3.190 -9.954 1.00 0.00 C ATOM 3134 C ALA B 97 -5.600 -3.527 -11.409 1.00 0.00 C ATOM 3135 O ALA B 97 -6.760 -3.523 -11.819 1.00 0.00 O ATOM 3136 CB ALA B 97 -4.629 -1.823 -9.858 1.00 0.00 C ATOM 0 H ALA B 97 -3.503 -3.861 -9.082 1.00 0.00 H new ATOM 0 HA ALA B 97 -6.225 -3.172 -9.402 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -5.281 -1.074 -10.308 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -4.459 -1.574 -8.811 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -3.676 -1.839 -10.387 1.00 0.00 H new ATOM 3142 N ASP B 98 -4.559 -3.843 -12.169 1.00 0.00 N ATOM 3143 CA ASP B 98 -4.684 -4.121 -13.601 1.00 0.00 C ATOM 3144 C ASP B 98 -5.629 -5.290 -13.878 1.00 0.00 C ATOM 3145 O ASP B 98 -6.558 -5.171 -14.679 1.00 0.00 O ATOM 3146 CB ASP B 98 -3.299 -4.410 -14.192 1.00 0.00 C ATOM 3147 CG ASP B 98 -3.339 -4.732 -15.673 1.00 0.00 C ATOM 3148 OD1 ASP B 98 -3.463 -3.794 -16.491 1.00 0.00 O ATOM 3149 OD2 ASP B 98 -3.213 -5.921 -16.031 1.00 0.00 O ATOM 0 H ASP B 98 -3.605 -3.915 -11.815 1.00 0.00 H new ATOM 0 HA ASP B 98 -5.112 -3.239 -14.077 1.00 0.00 H new ATOM 0 HB2 ASP B 98 -2.655 -3.546 -14.032 1.00 0.00 H new ATOM 0 HB3 ASP B 98 -2.850 -5.246 -13.657 1.00 0.00 H new ATOM 3154 N GLU B 99 -5.414 -6.405 -13.192 1.00 0.00 N ATOM 3155 CA GLU B 99 -6.195 -7.614 -13.430 1.00 0.00 C ATOM 3156 C GLU B 99 -7.625 -7.464 -12.895 1.00 0.00 C ATOM 3157 O GLU B 99 -8.508 -8.268 -13.209 1.00 0.00 O ATOM 3158 CB GLU B 99 -5.504 -8.815 -12.780 1.00 0.00 C ATOM 3159 CG GLU B 99 -5.985 -10.164 -13.295 1.00 0.00 C ATOM 3160 CD GLU B 99 -5.694 -10.370 -14.770 1.00 0.00 C ATOM 3161 OE1 GLU B 99 -4.593 -9.991 -15.223 1.00 0.00 O ATOM 3162 OE2 GLU B 99 -6.562 -10.924 -15.479 1.00 0.00 O ATOM 0 H GLU B 99 -4.705 -6.498 -12.465 1.00 0.00 H new ATOM 0 HA GLU B 99 -6.258 -7.777 -14.506 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -4.430 -8.737 -12.947 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -5.663 -8.772 -11.702 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -5.507 -10.958 -12.721 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -7.058 -10.250 -13.126 1.00 0.00 H new ATOM 3169 N HIS B 100 -7.858 -6.436 -12.086 1.00 0.00 N ATOM 3170 CA HIS B 100 -9.195 -6.178 -11.559 1.00 0.00 C ATOM 3171 C HIS B 100 -10.007 -5.321 -12.522 1.00 0.00 C ATOM 3172 O HIS B 100 -11.235 -5.292 -12.453 1.00 0.00 O ATOM 3173 CB HIS B 100 -9.134 -5.508 -10.184 1.00 0.00 C ATOM 3174 CG HIS B 100 -8.833 -6.452 -9.056 1.00 0.00 C ATOM 3175 ND1 HIS B 100 -8.835 -7.827 -9.189 1.00 0.00 N ATOM 3176 CD2 HIS B 100 -8.537 -6.208 -7.758 1.00 0.00 C ATOM 3177 CE1 HIS B 100 -8.553 -8.379 -8.023 1.00 0.00 C ATOM 3178 NE2 HIS B 100 -8.369 -7.420 -7.136 1.00 0.00 N ATOM 0 H HIS B 100 -7.146 -5.772 -11.782 1.00 0.00 H new ATOM 0 HA HIS B 100 -9.690 -7.143 -11.448 1.00 0.00 H new ATOM 0 HB2 HIS B 100 -8.372 -4.729 -10.205 1.00 0.00 H new ATOM 0 HB3 HIS B 100 -10.087 -5.017 -9.988 1.00 0.00 H new ATOM 0 HD2 HIS B 100 -8.449 -5.236 -7.296 1.00 0.00 H new ATOM 0 HE1 HIS B 100 -8.484 -9.439 -7.828 1.00 0.00 H new ATOM 0 HE2 HIS B 100 -8.140 -7.556 -6.151 1.00 0.00 H new ATOM 3187 N LEU B 101 -9.323 -4.632 -13.423 1.00 0.00 N ATOM 3188 CA LEU B 101 -9.999 -3.814 -14.420 1.00 0.00 C ATOM 3189 C LEU B 101 -10.489 -4.677 -15.579 1.00 0.00 C ATOM 3190 O LEU B 101 -11.504 -4.374 -16.206 1.00 0.00 O ATOM 3191 CB LEU B 101 -9.077 -2.705 -14.937 1.00 0.00 C ATOM 3192 CG LEU B 101 -9.215 -1.345 -14.240 1.00 0.00 C ATOM 3193 CD1 LEU B 101 -10.613 -0.777 -14.443 1.00 0.00 C ATOM 3194 CD2 LEU B 101 -8.901 -1.456 -12.755 1.00 0.00 C ATOM 0 H LEU B 101 -8.305 -4.622 -13.485 1.00 0.00 H new ATOM 0 HA LEU B 101 -10.861 -3.347 -13.943 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -8.045 -3.040 -14.837 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -9.266 -2.568 -16.002 1.00 0.00 H new ATOM 0 HG LEU B 101 -8.493 -0.664 -14.691 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -10.690 0.187 -13.941 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -10.802 -0.648 -15.509 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -11.349 -1.464 -14.025 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -9.007 -0.477 -12.287 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -9.592 -2.158 -12.289 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -7.879 -1.812 -12.625 1.00 0.00 H new ATOM 3206 N GLU B 102 -9.763 -5.753 -15.858 1.00 0.00 N ATOM 3207 CA GLU B 102 -10.157 -6.691 -16.898 1.00 0.00 C ATOM 3208 C GLU B 102 -9.375 -7.985 -16.739 1.00 0.00 C ATOM 3209 O GLU B 102 -8.141 -7.974 -16.752 1.00 0.00 O ATOM 3210 CB GLU B 102 -9.898 -6.099 -18.291 1.00 0.00 C ATOM 3211 CG GLU B 102 -10.945 -6.482 -19.338 1.00 0.00 C ATOM 3212 CD GLU B 102 -11.085 -7.979 -19.546 1.00 0.00 C ATOM 3213 OE1 GLU B 102 -11.846 -8.619 -18.791 1.00 0.00 O ATOM 3214 OE2 GLU B 102 -10.459 -8.520 -20.482 1.00 0.00 O ATOM 0 H GLU B 102 -8.897 -5.996 -15.377 1.00 0.00 H new ATOM 0 HA GLU B 102 -11.224 -6.891 -16.800 1.00 0.00 H new ATOM 0 HB2 GLU B 102 -9.861 -5.013 -18.211 1.00 0.00 H new ATOM 0 HB3 GLU B 102 -8.918 -6.427 -18.637 1.00 0.00 H new ATOM 0 HG2 GLU B 102 -11.911 -6.074 -19.039 1.00 0.00 H new ATOM 0 HG3 GLU B 102 -10.683 -6.016 -20.288 1.00 0.00 H new ATOM 3221 N HIS B 103 -10.087 -9.092 -16.586 1.00 0.00 N ATOM 3222 CA HIS B 103 -9.449 -10.399 -16.482 1.00 0.00 C ATOM 3223 C HIS B 103 -9.075 -10.905 -17.864 1.00 0.00 C ATOM 3224 O HIS B 103 -9.685 -11.841 -18.383 1.00 0.00 O ATOM 3225 CB HIS B 103 -10.351 -11.416 -15.778 1.00 0.00 C ATOM 3226 CG HIS B 103 -10.392 -11.260 -14.290 1.00 0.00 C ATOM 3227 ND1 HIS B 103 -9.486 -11.863 -13.447 1.00 0.00 N ATOM 3228 CD2 HIS B 103 -11.247 -10.578 -13.494 1.00 0.00 C ATOM 3229 CE1 HIS B 103 -9.784 -11.560 -12.197 1.00 0.00 C ATOM 3230 NE2 HIS B 103 -10.851 -10.779 -12.197 1.00 0.00 N ATOM 0 H HIS B 103 -11.105 -9.113 -16.531 1.00 0.00 H new ATOM 0 HA HIS B 103 -8.548 -10.282 -15.880 1.00 0.00 H new ATOM 0 HB2 HIS B 103 -11.363 -11.323 -16.172 1.00 0.00 H new ATOM 0 HB3 HIS B 103 -10.006 -12.421 -16.019 1.00 0.00 H new ATOM 0 HD2 HIS B 103 -12.088 -9.984 -13.820 1.00 0.00 H new ATOM 0 HE1 HIS B 103 -9.247 -11.894 -11.322 1.00 0.00 H new ATOM 0 HE2 HIS B 103 -11.304 -10.391 -11.370 1.00 0.00 H new ATOM 3239 N HIS B 104 -8.054 -10.281 -18.437 1.00 0.00 N ATOM 3240 CA HIS B 104 -7.615 -10.551 -19.806 1.00 0.00 C ATOM 3241 C HIS B 104 -6.850 -11.870 -19.895 1.00 0.00 C ATOM 3242 O HIS B 104 -5.811 -11.960 -20.548 1.00 0.00 O ATOM 3243 CB HIS B 104 -6.744 -9.389 -20.306 1.00 0.00 C ATOM 3244 CG HIS B 104 -5.606 -9.041 -19.388 1.00 0.00 C ATOM 3245 ND1 HIS B 104 -5.748 -8.212 -18.295 1.00 0.00 N ATOM 3246 CD2 HIS B 104 -4.305 -9.423 -19.397 1.00 0.00 C ATOM 3247 CE1 HIS B 104 -4.591 -8.102 -17.676 1.00 0.00 C ATOM 3248 NE2 HIS B 104 -3.699 -8.827 -18.323 1.00 0.00 N ATOM 0 H HIS B 104 -7.501 -9.567 -17.963 1.00 0.00 H new ATOM 0 HA HIS B 104 -8.497 -10.640 -20.440 1.00 0.00 H new ATOM 0 HB2 HIS B 104 -6.342 -9.645 -21.286 1.00 0.00 H new ATOM 0 HB3 HIS B 104 -7.372 -8.508 -20.440 1.00 0.00 H new ATOM 0 HD1 HIS B 104 -6.614 -7.755 -18.010 1.00 0.00 H new ATOM 0 HD2 HIS B 104 -3.834 -10.076 -20.117 1.00 0.00 H new ATOM 0 HE1 HIS B 104 -4.404 -7.517 -16.788 1.00 0.00 H new ATOM 3257 N HIS B 105 -7.393 -12.888 -19.253 1.00 0.00 N ATOM 3258 CA HIS B 105 -6.788 -14.210 -19.220 1.00 0.00 C ATOM 3259 C HIS B 105 -7.789 -15.239 -18.720 1.00 0.00 C ATOM 3260 O HIS B 105 -7.800 -16.376 -19.190 1.00 0.00 O ATOM 3261 CB HIS B 105 -5.553 -14.235 -18.314 1.00 0.00 C ATOM 3262 CG HIS B 105 -4.256 -14.187 -19.057 1.00 0.00 C ATOM 3263 ND1 HIS B 105 -3.221 -13.349 -18.711 1.00 0.00 N ATOM 3264 CD2 HIS B 105 -3.822 -14.896 -20.124 1.00 0.00 C ATOM 3265 CE1 HIS B 105 -2.208 -13.541 -19.534 1.00 0.00 C ATOM 3266 NE2 HIS B 105 -2.544 -14.478 -20.402 1.00 0.00 N ATOM 0 H HIS B 105 -8.270 -12.822 -18.737 1.00 0.00 H new ATOM 0 HA HIS B 105 -6.484 -14.455 -20.238 1.00 0.00 H new ATOM 0 HB2 HIS B 105 -5.600 -13.388 -17.629 1.00 0.00 H new ATOM 0 HB3 HIS B 105 -5.579 -15.139 -17.706 1.00 0.00 H new ATOM 0 HD2 HIS B 105 -4.378 -15.652 -20.659 1.00 0.00 H new ATOM 0 HE1 HIS B 105 -1.263 -13.020 -19.503 1.00 0.00 H new ATOM 0 HE2 HIS B 105 -1.953 -14.832 -21.154 1.00 0.00 H new ATOM 3275 N HIS B 106 -8.632 -14.816 -17.769 1.00 0.00 N ATOM 3276 CA HIS B 106 -9.576 -15.706 -17.077 1.00 0.00 C ATOM 3277 C HIS B 106 -8.803 -16.684 -16.195 1.00 0.00 C ATOM 3278 O HIS B 106 -8.785 -16.560 -14.971 1.00 0.00 O ATOM 3279 CB HIS B 106 -10.469 -16.484 -18.063 1.00 0.00 C ATOM 3280 CG HIS B 106 -11.223 -15.626 -19.035 1.00 0.00 C ATOM 3281 ND1 HIS B 106 -11.005 -15.668 -20.397 1.00 0.00 N ATOM 3282 CD2 HIS B 106 -12.210 -14.718 -18.844 1.00 0.00 C ATOM 3283 CE1 HIS B 106 -11.821 -14.822 -20.997 1.00 0.00 C ATOM 3284 NE2 HIS B 106 -12.565 -14.234 -20.079 1.00 0.00 N ATOM 0 H HIS B 106 -8.679 -13.846 -17.457 1.00 0.00 H new ATOM 0 HA HIS B 106 -10.230 -15.085 -16.464 1.00 0.00 H new ATOM 0 HB2 HIS B 106 -9.847 -17.183 -18.622 1.00 0.00 H new ATOM 0 HB3 HIS B 106 -11.183 -17.079 -17.494 1.00 0.00 H new ATOM 0 HD2 HIS B 106 -12.638 -14.428 -17.896 1.00 0.00 H new ATOM 0 HE1 HIS B 106 -11.872 -14.641 -22.061 1.00 0.00 H new ATOM 0 HE2 HIS B 106 -13.286 -13.535 -20.258 1.00 0.00 H new ATOM 3293 N HIS B 107 -8.157 -17.638 -16.854 1.00 0.00 N ATOM 3294 CA HIS B 107 -7.268 -18.613 -16.226 1.00 0.00 C ATOM 3295 C HIS B 107 -6.755 -19.557 -17.307 1.00 0.00 C ATOM 3296 O HIS B 107 -5.561 -19.849 -17.382 1.00 0.00 O ATOM 3297 CB HIS B 107 -7.956 -19.396 -15.085 1.00 0.00 C ATOM 3298 CG HIS B 107 -9.153 -20.200 -15.493 1.00 0.00 C ATOM 3299 ND1 HIS B 107 -9.126 -21.569 -15.648 1.00 0.00 N ATOM 3300 CD2 HIS B 107 -10.423 -19.822 -15.762 1.00 0.00 C ATOM 3301 CE1 HIS B 107 -10.323 -21.994 -15.998 1.00 0.00 C ATOM 3302 NE2 HIS B 107 -11.132 -20.954 -16.076 1.00 0.00 N ATOM 0 H HIS B 107 -8.237 -17.760 -17.864 1.00 0.00 H new ATOM 0 HA HIS B 107 -6.437 -18.081 -15.762 1.00 0.00 H new ATOM 0 HB2 HIS B 107 -7.225 -20.067 -14.634 1.00 0.00 H new ATOM 0 HB3 HIS B 107 -8.259 -18.689 -14.313 1.00 0.00 H new ATOM 0 HD2 HIS B 107 -10.809 -18.814 -15.735 1.00 0.00 H new ATOM 0 HE1 HIS B 107 -10.596 -23.021 -16.189 1.00 0.00 H new ATOM 0 HE2 HIS B 107 -12.120 -20.986 -16.328 1.00 0.00 H new ATOM 3311 N HIS B 108 -7.679 -19.986 -18.163 1.00 0.00 N ATOM 3312 CA HIS B 108 -7.378 -20.811 -19.326 1.00 0.00 C ATOM 3313 C HIS B 108 -8.673 -21.063 -20.091 1.00 0.00 C ATOM 3314 O HIS B 108 -9.086 -20.175 -20.862 1.00 0.00 O ATOM 3315 CB HIS B 108 -6.733 -22.146 -18.920 1.00 0.00 C ATOM 3316 CG HIS B 108 -6.359 -23.013 -20.089 1.00 0.00 C ATOM 3317 ND1 HIS B 108 -5.195 -22.848 -20.806 1.00 0.00 N ATOM 3318 CD2 HIS B 108 -7.004 -24.057 -20.661 1.00 0.00 C ATOM 3319 CE1 HIS B 108 -5.142 -23.747 -21.770 1.00 0.00 C ATOM 3320 NE2 HIS B 108 -6.226 -24.491 -21.703 1.00 0.00 N ATOM 3321 OXT HIS B 108 -9.291 -22.127 -19.882 1.00 0.00 O ATOM 0 H HIS B 108 -8.670 -19.767 -18.066 1.00 0.00 H new ATOM 0 HA HIS B 108 -6.662 -20.285 -19.957 1.00 0.00 H new ATOM 0 HB2 HIS B 108 -5.840 -21.944 -18.328 1.00 0.00 H new ATOM 0 HB3 HIS B 108 -7.424 -22.693 -18.278 1.00 0.00 H new ATOM 0 HD2 HIS B 108 -7.953 -24.470 -20.354 1.00 0.00 H new ATOM 0 HE1 HIS B 108 -4.345 -23.854 -22.491 1.00 0.00 H new ATOM 0 HE2 HIS B 108 -6.451 -25.266 -22.327 1.00 0.00 H new TER 3330 HIS B 108