USER MOD reduce.3.24.130724 H: found=0, std=0, add=1418, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1421 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 25 HIS : no HD1:sc= -1.36 K(o=-3.4,f=-7.8!) USER MOD Set 1.2: B 26 LYS NZ :NH3+ -152:sc= -0.346 (180deg=1.04) USER MOD Set 1.3: B 71 GLN : amide:sc= -1.71! K(o=-3.4!,f=-1.6) USER MOD Set 2.1: A 25 HIS : no HD1:sc= -1.31 K(o=-3.4,f=-7.6!) USER MOD Set 2.2: A 26 LYS NZ :NH3+ -148:sc= -0.414 (180deg=1.04) USER MOD Set 2.3: A 71 GLN : amide:sc= -1.64! K(o=-3.4!,f=-1.5) USER MOD Single : A 1 SER N :NH3+ 163:sc= 1.22 (180deg=0.513) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl 155:sc= -1.46 (180deg=-2.63!) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= -1.02 K(o=-1,f=-4.6!) USER MOD Single : A 17 TYR OH : rot 30:sc= -1.5 USER MOD Single : A 18 SER OG : rot 53:sc= -0.0199 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -120:sc= -0.0288 (180deg=-0.53) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -137:sc= -0.411 (180deg=-2.47!) USER MOD Single : A 37 ASN : amide:sc= -3.8 K(o=-3.8,f=-5.9!) USER MOD Single : A 38 ASN : amide:sc= -0.489 K(o=-0.49,f=-1.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc=-0.00615 K(o=-0.0062,f=-0.79) USER MOD Single : A 55 LYS NZ :NH3+ 152:sc= -0.0152 (180deg=-0.592) USER MOD Single : A 57 MET CE :methyl 159:sc= -0.773 (180deg=-1.52!) USER MOD Single : A 59 THR OG1 : rot 52:sc= -0.631 USER MOD Single : A 62 ASN : amide:sc= -0.1 K(o=-0.1,f=-1.9!) USER MOD Single : A 68 CYS SG : rot 180:sc= -1.64 USER MOD Single : A 74 MET CE :methyl 143:sc= -2.66 (180deg=-4.96!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 122:sc= 1.06 USER MOD Single : A 82 THR OG1 : rot 94:sc= 1.19 USER MOD Single : A 84 CYS SG : rot 17:sc= -1.12 USER MOD Single : A 85 HIS : no HE2:sc= -3.14! C(o=-3.1!,f=-5.8!) USER MOD Single : B 1 SER N :NH3+ 161:sc= 1.18 (180deg=0.531) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl 157:sc= -1.43 (180deg=-2.52!) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 16 GLN : amide:sc= -0.991 K(o=-0.99,f=-4.5!) USER MOD Single : B 17 TYR OH : rot 30:sc= -1.51 USER MOD Single : B 18 SER OG : rot 53:sc= -0.0265 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -118:sc= -0.0244 (180deg=-0.517) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ -134:sc= -0.271 (180deg=-2.2!) USER MOD Single : B 37 ASN : amide:sc= -3.87 K(o=-3.9,f=-5.9!) USER MOD Single : B 38 ASN : amide:sc= -0.49 K(o=-0.49,f=-1.5!) USER MOD Single : B 48 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00715) USER MOD Single : B 50 GLN : amide:sc= -0.0084 K(o=-0.0084,f=-0.9) USER MOD Single : B 55 LYS NZ :NH3+ 152:sc= -0.0133 (180deg=-0.6) USER MOD Single : B 57 MET CE :methyl 163:sc= -0.679 (180deg=-1.41!) USER MOD Single : B 59 THR OG1 : rot 44:sc= -0.571 USER MOD Single : B 62 ASN : amide:sc= -0.0744 K(o=-0.074,f=-2!) USER MOD Single : B 68 CYS SG : rot 180:sc= -1.65 USER MOD Single : B 74 MET CE :methyl 140:sc= -2.68 (180deg=-5.07!) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 108:sc= 1.15 USER MOD Single : B 82 THR OG1 : rot 99:sc= 1.26 USER MOD Single : B 84 CYS SG : rot 19:sc= -1.12 USER MOD Single : B 85 HIS : no HE2:sc= -3.17! C(o=-3.2!,f=-5.8!) USER MOD Single : C 3 THR OG1 : rot 180:sc= 0.00196 USER MOD Single : C 4 LYS NZ :NH3+ -171:sc= -0.794 (180deg=-1.24) USER MOD Single : C 8 ASN : amide:sc= -0.419 X(o=-0.42,f=0) USER MOD Single : C 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 12 SER OG : rot -63:sc= 1.16 USER MOD Single : D 1 THR N :NH3+ -131:sc= 0.406 (180deg=0.00552) USER MOD Single : D 1 THR OG1 : rot 180:sc= 0.157 USER MOD Single : D 3 THR OG1 : rot 180:sc=0.000539 USER MOD Single : D 4 LYS NZ :NH3+ -171:sc= -0.997 (180deg=-1.22) USER MOD Single : D 8 ASN : amide:sc= -0.391 X(o=-0.39,f=0) USER MOD Single : D 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 12 SER OG : rot -65:sc= 1.15 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.246 -4.167 -12.732 1.00 0.00 N ATOM 2 CA SER A 1 -9.433 -5.051 -11.855 1.00 0.00 C ATOM 3 C SER A 1 -8.126 -4.377 -11.454 1.00 0.00 C ATOM 4 O SER A 1 -7.101 -5.039 -11.289 1.00 0.00 O ATOM 5 CB SER A 1 -9.146 -6.353 -12.607 1.00 0.00 C ATOM 6 OG SER A 1 -9.134 -7.461 -11.723 1.00 0.00 O ATOM 0 H1 SER A 1 -10.971 -4.732 -13.218 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.707 -3.435 -12.155 1.00 0.00 H new ATOM 0 H3 SER A 1 -9.629 -3.715 -13.437 1.00 0.00 H new ATOM 0 HA SER A 1 -9.990 -5.259 -10.941 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.902 -6.506 -13.377 1.00 0.00 H new ATOM 0 HB3 SER A 1 -8.185 -6.279 -13.115 1.00 0.00 H new ATOM 0 HG SER A 1 -8.950 -8.280 -12.228 1.00 0.00 H new ATOM 14 N GLU A 2 -8.169 -3.059 -11.298 1.00 0.00 N ATOM 15 CA GLU A 2 -6.986 -2.295 -10.915 1.00 0.00 C ATOM 16 C GLU A 2 -6.427 -2.779 -9.582 1.00 0.00 C ATOM 17 O GLU A 2 -5.245 -2.594 -9.290 1.00 0.00 O ATOM 18 CB GLU A 2 -7.322 -0.805 -10.829 1.00 0.00 C ATOM 19 CG GLU A 2 -7.233 -0.087 -12.165 1.00 0.00 C ATOM 20 CD GLU A 2 -7.676 1.360 -12.080 1.00 0.00 C ATOM 21 OE1 GLU A 2 -8.723 1.625 -11.453 1.00 0.00 O ATOM 22 OE2 GLU A 2 -6.975 2.229 -12.640 1.00 0.00 O ATOM 0 H GLU A 2 -9.010 -2.497 -11.431 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.226 -2.447 -11.681 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.330 -0.690 -10.430 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.643 -0.327 -10.123 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.206 -0.128 -12.527 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -7.850 -0.610 -12.896 1.00 0.00 H new ATOM 29 N LEU A 3 -7.282 -3.397 -8.775 1.00 0.00 N ATOM 30 CA LEU A 3 -6.871 -3.906 -7.472 1.00 0.00 C ATOM 31 C LEU A 3 -5.763 -4.944 -7.617 1.00 0.00 C ATOM 32 O LEU A 3 -4.651 -4.751 -7.128 1.00 0.00 O ATOM 33 CB LEU A 3 -8.069 -4.518 -6.740 1.00 0.00 C ATOM 34 CG LEU A 3 -8.751 -3.594 -5.728 1.00 0.00 C ATOM 35 CD1 LEU A 3 -7.844 -3.351 -4.533 1.00 0.00 C ATOM 36 CD2 LEU A 3 -9.137 -2.277 -6.384 1.00 0.00 C ATOM 0 H LEU A 3 -8.264 -3.558 -9.000 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.485 -3.070 -6.888 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.807 -4.829 -7.479 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.738 -5.418 -6.222 1.00 0.00 H new ATOM 0 HG LEU A 3 -9.660 -4.081 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -8.345 -2.692 -3.824 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -7.618 -4.301 -4.048 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -6.917 -2.885 -4.868 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -9.621 -1.633 -5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -8.243 -1.785 -6.766 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -9.825 -2.469 -7.207 1.00 0.00 H new ATOM 48 N GLU A 4 -6.077 -6.046 -8.290 1.00 0.00 N ATOM 49 CA GLU A 4 -5.110 -7.119 -8.498 1.00 0.00 C ATOM 50 C GLU A 4 -3.933 -6.642 -9.345 1.00 0.00 C ATOM 51 O GLU A 4 -2.783 -6.981 -9.072 1.00 0.00 O ATOM 52 CB GLU A 4 -5.788 -8.318 -9.167 1.00 0.00 C ATOM 53 CG GLU A 4 -5.754 -9.582 -8.324 1.00 0.00 C ATOM 54 CD GLU A 4 -6.232 -10.803 -9.085 1.00 0.00 C ATOM 55 OE1 GLU A 4 -7.438 -10.869 -9.403 1.00 0.00 O ATOM 56 OE2 GLU A 4 -5.401 -11.692 -9.362 1.00 0.00 O ATOM 0 H GLU A 4 -6.994 -6.220 -8.701 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.726 -7.423 -7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.825 -8.064 -9.385 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.301 -8.515 -10.122 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.736 -9.753 -7.973 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.377 -9.442 -7.441 1.00 0.00 H new ATOM 63 N LYS A 5 -4.230 -5.857 -10.376 1.00 0.00 N ATOM 64 CA LYS A 5 -3.195 -5.338 -11.264 1.00 0.00 C ATOM 65 C LYS A 5 -2.148 -4.546 -10.485 1.00 0.00 C ATOM 66 O LYS A 5 -0.971 -4.905 -10.469 1.00 0.00 O ATOM 67 CB LYS A 5 -3.820 -4.455 -12.348 1.00 0.00 C ATOM 68 CG LYS A 5 -4.073 -5.187 -13.657 1.00 0.00 C ATOM 69 CD LYS A 5 -5.522 -5.060 -14.102 1.00 0.00 C ATOM 70 CE LYS A 5 -5.864 -3.628 -14.483 1.00 0.00 C ATOM 71 NZ LYS A 5 -5.320 -3.265 -15.821 1.00 0.00 N ATOM 0 H LYS A 5 -5.178 -5.567 -10.617 1.00 0.00 H new ATOM 0 HA LYS A 5 -2.700 -6.187 -11.736 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.763 -4.052 -11.978 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.163 -3.606 -12.537 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.418 -4.786 -14.431 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.819 -6.241 -13.540 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.701 -5.717 -14.953 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -6.181 -5.391 -13.299 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.947 -3.501 -14.485 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.464 -2.947 -13.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.574 -2.282 -16.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.285 -3.361 -15.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -5.721 -3.898 -16.542 1.00 0.00 H new ATOM 85 N ALA A 6 -2.585 -3.468 -9.843 1.00 0.00 N ATOM 86 CA ALA A 6 -1.687 -2.622 -9.064 1.00 0.00 C ATOM 87 C ALA A 6 -0.963 -3.422 -7.989 1.00 0.00 C ATOM 88 O ALA A 6 0.203 -3.163 -7.691 1.00 0.00 O ATOM 89 CB ALA A 6 -2.462 -1.472 -8.438 1.00 0.00 C ATOM 0 H ALA A 6 -3.557 -3.159 -9.847 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.934 -2.217 -9.740 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.782 -0.847 -7.859 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.924 -0.874 -9.224 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.236 -1.870 -7.782 1.00 0.00 H new ATOM 95 N MET A 7 -1.658 -4.393 -7.409 1.00 0.00 N ATOM 96 CA MET A 7 -1.071 -5.226 -6.368 1.00 0.00 C ATOM 97 C MET A 7 0.169 -5.948 -6.888 1.00 0.00 C ATOM 98 O MET A 7 1.246 -5.838 -6.306 1.00 0.00 O ATOM 99 CB MET A 7 -2.095 -6.243 -5.856 1.00 0.00 C ATOM 100 CG MET A 7 -2.292 -6.200 -4.349 1.00 0.00 C ATOM 101 SD MET A 7 -3.413 -7.482 -3.758 1.00 0.00 S ATOM 102 CE MET A 7 -4.649 -6.494 -2.919 1.00 0.00 C ATOM 0 H MET A 7 -2.625 -4.622 -7.641 1.00 0.00 H new ATOM 0 HA MET A 7 -0.774 -4.579 -5.543 1.00 0.00 H new ATOM 0 HB2 MET A 7 -3.052 -6.060 -6.345 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.776 -7.245 -6.144 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.326 -6.313 -3.857 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.682 -5.223 -4.065 1.00 0.00 H new ATOM 0 HE1 MET A 7 -5.593 -7.039 -2.891 1.00 0.00 H new ATOM 0 HE2 MET A 7 -4.319 -6.287 -1.901 1.00 0.00 H new ATOM 0 HE3 MET A 7 -4.788 -5.554 -3.454 1.00 0.00 H new ATOM 112 N VAL A 8 0.002 -6.687 -7.983 1.00 0.00 N ATOM 113 CA VAL A 8 1.100 -7.439 -8.585 1.00 0.00 C ATOM 114 C VAL A 8 2.089 -6.526 -9.300 1.00 0.00 C ATOM 115 O VAL A 8 3.274 -6.844 -9.395 1.00 0.00 O ATOM 116 CB VAL A 8 0.579 -8.489 -9.584 1.00 0.00 C ATOM 117 CG1 VAL A 8 1.712 -9.389 -10.056 1.00 0.00 C ATOM 118 CG2 VAL A 8 -0.543 -9.311 -8.965 1.00 0.00 C ATOM 0 H VAL A 8 -0.888 -6.781 -8.473 1.00 0.00 H new ATOM 0 HA VAL A 8 1.613 -7.941 -7.765 1.00 0.00 H new ATOM 0 HB VAL A 8 0.177 -7.966 -10.451 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.323 -10.124 -10.761 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.476 -8.785 -10.545 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.149 -9.903 -9.200 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.896 -10.047 -9.688 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.172 -9.823 -8.078 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.365 -8.652 -8.686 1.00 0.00 H new ATOM 128 N ALA A 9 1.611 -5.390 -9.795 1.00 0.00 N ATOM 129 CA ALA A 9 2.483 -4.450 -10.486 1.00 0.00 C ATOM 130 C ALA A 9 3.662 -4.088 -9.593 1.00 0.00 C ATOM 131 O ALA A 9 4.817 -4.051 -10.033 1.00 0.00 O ATOM 132 CB ALA A 9 1.710 -3.202 -10.888 1.00 0.00 C ATOM 0 H ALA A 9 0.635 -5.100 -9.732 1.00 0.00 H new ATOM 0 HA ALA A 9 2.862 -4.920 -11.394 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.377 -2.511 -11.403 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.892 -3.479 -11.552 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.307 -2.721 -9.997 1.00 0.00 H new ATOM 138 N LEU A 10 3.361 -3.860 -8.323 1.00 0.00 N ATOM 139 CA LEU A 10 4.389 -3.535 -7.350 1.00 0.00 C ATOM 140 C LEU A 10 5.300 -4.735 -7.170 1.00 0.00 C ATOM 141 O LEU A 10 6.501 -4.671 -7.424 1.00 0.00 O ATOM 142 CB LEU A 10 3.759 -3.156 -6.009 1.00 0.00 C ATOM 143 CG LEU A 10 2.864 -1.917 -6.041 1.00 0.00 C ATOM 144 CD1 LEU A 10 1.633 -2.124 -5.173 1.00 0.00 C ATOM 145 CD2 LEU A 10 3.642 -0.690 -5.585 1.00 0.00 C ATOM 0 H LEU A 10 2.415 -3.894 -7.944 1.00 0.00 H new ATOM 0 HA LEU A 10 4.966 -2.684 -7.711 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.171 -4.001 -5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.556 -2.991 -5.284 1.00 0.00 H new ATOM 0 HG LEU A 10 2.534 -1.755 -7.067 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.008 -1.231 -5.209 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.066 -2.978 -5.543 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.941 -2.311 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.992 0.184 -5.613 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.000 -0.844 -4.567 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.492 -0.531 -6.248 1.00 0.00 H new ATOM 157 N ILE A 11 4.696 -5.836 -6.746 1.00 0.00 N ATOM 158 CA ILE A 11 5.420 -7.086 -6.538 1.00 0.00 C ATOM 159 C ILE A 11 6.303 -7.402 -7.737 1.00 0.00 C ATOM 160 O ILE A 11 7.411 -7.909 -7.589 1.00 0.00 O ATOM 161 CB ILE A 11 4.470 -8.283 -6.295 1.00 0.00 C ATOM 162 CG1 ILE A 11 3.069 -7.813 -5.900 1.00 0.00 C ATOM 163 CG2 ILE A 11 5.039 -9.181 -5.219 1.00 0.00 C ATOM 164 CD1 ILE A 11 2.099 -8.942 -5.626 1.00 0.00 C ATOM 0 H ILE A 11 3.699 -5.891 -6.537 1.00 0.00 H new ATOM 0 HA ILE A 11 6.031 -6.942 -5.647 1.00 0.00 H new ATOM 0 HB ILE A 11 4.385 -8.842 -7.227 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.143 -7.187 -5.011 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.668 -7.188 -6.697 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.365 -10.022 -5.053 1.00 0.00 H new ATOM 0 HG22 ILE A 11 6.014 -9.554 -5.534 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.149 -8.616 -4.294 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.128 -8.529 -5.352 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.993 -9.556 -6.520 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.476 -9.555 -4.808 1.00 0.00 H new ATOM 176 N ASP A 12 5.804 -7.091 -8.928 1.00 0.00 N ATOM 177 CA ASP A 12 6.553 -7.337 -10.152 1.00 0.00 C ATOM 178 C ASP A 12 7.924 -6.674 -10.075 1.00 0.00 C ATOM 179 O ASP A 12 8.935 -7.260 -10.463 1.00 0.00 O ATOM 180 CB ASP A 12 5.779 -6.811 -11.363 1.00 0.00 C ATOM 181 CG ASP A 12 5.256 -7.929 -12.244 1.00 0.00 C ATOM 182 OD1 ASP A 12 6.060 -8.517 -12.996 1.00 0.00 O ATOM 183 OD2 ASP A 12 4.041 -8.216 -12.183 1.00 0.00 O ATOM 0 H ASP A 12 4.886 -6.669 -9.071 1.00 0.00 H new ATOM 0 HA ASP A 12 6.690 -8.412 -10.265 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.943 -6.201 -11.020 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.427 -6.161 -11.951 1.00 0.00 H new ATOM 188 N VAL A 13 7.945 -5.446 -9.569 1.00 0.00 N ATOM 189 CA VAL A 13 9.189 -4.694 -9.435 1.00 0.00 C ATOM 190 C VAL A 13 10.162 -5.369 -8.462 1.00 0.00 C ATOM 191 O VAL A 13 11.348 -5.514 -8.762 1.00 0.00 O ATOM 192 CB VAL A 13 8.922 -3.252 -8.963 1.00 0.00 C ATOM 193 CG1 VAL A 13 10.162 -2.391 -9.145 1.00 0.00 C ATOM 194 CG2 VAL A 13 7.737 -2.655 -9.708 1.00 0.00 C ATOM 0 H VAL A 13 7.115 -4.949 -9.245 1.00 0.00 H new ATOM 0 HA VAL A 13 9.644 -4.671 -10.425 1.00 0.00 H new ATOM 0 HB VAL A 13 8.678 -3.278 -7.901 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.953 -1.376 -8.806 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.983 -2.807 -8.561 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.440 -2.372 -10.199 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.564 -1.636 -9.360 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.948 -2.643 -10.777 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.848 -3.258 -9.521 1.00 0.00 H new ATOM 204 N PHE A 14 9.660 -5.774 -7.296 1.00 0.00 N ATOM 205 CA PHE A 14 10.491 -6.426 -6.281 1.00 0.00 C ATOM 206 C PHE A 14 10.774 -7.883 -6.654 1.00 0.00 C ATOM 207 O PHE A 14 11.769 -8.462 -6.217 1.00 0.00 O ATOM 208 CB PHE A 14 9.822 -6.310 -4.892 1.00 0.00 C ATOM 209 CG PHE A 14 9.547 -7.616 -4.190 1.00 0.00 C ATOM 210 CD1 PHE A 14 8.808 -8.613 -4.807 1.00 0.00 C ATOM 211 CD2 PHE A 14 10.030 -7.845 -2.911 1.00 0.00 C ATOM 212 CE1 PHE A 14 8.560 -9.809 -4.168 1.00 0.00 C ATOM 213 CE2 PHE A 14 9.786 -9.040 -2.271 1.00 0.00 C ATOM 214 CZ PHE A 14 9.050 -10.024 -2.898 1.00 0.00 C ATOM 0 H PHE A 14 8.682 -5.663 -7.029 1.00 0.00 H new ATOM 0 HA PHE A 14 11.453 -5.916 -6.236 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.460 -5.701 -4.251 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.880 -5.774 -5.006 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.421 -8.451 -5.802 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.604 -7.078 -2.411 1.00 0.00 H new ATOM 0 HE1 PHE A 14 7.983 -10.576 -4.662 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.172 -9.207 -1.276 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.858 -10.960 -2.395 1.00 0.00 H new ATOM 224 N HIS A 15 9.894 -8.467 -7.461 1.00 0.00 N ATOM 225 CA HIS A 15 10.051 -9.853 -7.889 1.00 0.00 C ATOM 226 C HIS A 15 11.030 -9.961 -9.054 1.00 0.00 C ATOM 227 O HIS A 15 11.552 -11.039 -9.337 1.00 0.00 O ATOM 228 CB HIS A 15 8.697 -10.442 -8.290 1.00 0.00 C ATOM 229 CG HIS A 15 8.655 -11.938 -8.246 1.00 0.00 C ATOM 230 ND1 HIS A 15 8.840 -12.730 -9.359 1.00 0.00 N ATOM 231 CD2 HIS A 15 8.447 -12.787 -7.211 1.00 0.00 C ATOM 232 CE1 HIS A 15 8.747 -14.002 -9.012 1.00 0.00 C ATOM 233 NE2 HIS A 15 8.510 -14.064 -7.716 1.00 0.00 N ATOM 0 H HIS A 15 9.065 -8.002 -7.832 1.00 0.00 H new ATOM 0 HA HIS A 15 10.453 -10.420 -7.049 1.00 0.00 H new ATOM 0 HB2 HIS A 15 7.928 -10.046 -7.627 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.450 -10.110 -9.298 1.00 0.00 H new ATOM 0 HD2 HIS A 15 8.266 -12.512 -6.182 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.848 -14.847 -9.677 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.392 -14.921 -7.176 1.00 0.00 H new ATOM 242 N GLN A 16 11.282 -8.839 -9.722 1.00 0.00 N ATOM 243 CA GLN A 16 12.203 -8.818 -10.848 1.00 0.00 C ATOM 244 C GLN A 16 13.636 -8.673 -10.353 1.00 0.00 C ATOM 245 O GLN A 16 14.540 -9.360 -10.828 1.00 0.00 O ATOM 246 CB GLN A 16 11.854 -7.671 -11.800 1.00 0.00 C ATOM 247 CG GLN A 16 11.590 -8.124 -13.227 1.00 0.00 C ATOM 248 CD GLN A 16 10.386 -9.040 -13.336 1.00 0.00 C ATOM 249 OE1 GLN A 16 10.340 -10.099 -12.711 1.00 0.00 O ATOM 250 NE2 GLN A 16 9.405 -8.635 -14.133 1.00 0.00 N ATOM 0 H GLN A 16 10.861 -7.936 -9.502 1.00 0.00 H new ATOM 0 HA GLN A 16 12.112 -9.760 -11.389 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.972 -7.153 -11.423 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.671 -6.950 -11.802 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.435 -7.249 -13.859 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.471 -8.641 -13.609 1.00 0.00 H new ATOM 0 HE21 GLN A 16 9.486 -7.749 -14.632 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.570 -9.210 -14.246 1.00 0.00 H new ATOM 259 N TYR A 17 13.835 -7.777 -9.392 1.00 0.00 N ATOM 260 CA TYR A 17 15.160 -7.549 -8.833 1.00 0.00 C ATOM 261 C TYR A 17 15.480 -8.567 -7.744 1.00 0.00 C ATOM 262 O TYR A 17 16.464 -9.301 -7.840 1.00 0.00 O ATOM 263 CB TYR A 17 15.273 -6.129 -8.281 1.00 0.00 C ATOM 264 CG TYR A 17 15.960 -5.173 -9.230 1.00 0.00 C ATOM 265 CD1 TYR A 17 15.289 -4.654 -10.329 1.00 0.00 C ATOM 266 CD2 TYR A 17 17.281 -4.792 -9.026 1.00 0.00 C ATOM 267 CE1 TYR A 17 15.915 -3.780 -11.200 1.00 0.00 C ATOM 268 CE2 TYR A 17 17.912 -3.920 -9.893 1.00 0.00 C ATOM 269 CZ TYR A 17 17.226 -3.417 -10.977 1.00 0.00 C ATOM 270 OH TYR A 17 17.851 -2.549 -11.842 1.00 0.00 O ATOM 0 H TYR A 17 13.098 -7.200 -8.986 1.00 0.00 H new ATOM 0 HA TYR A 17 15.887 -7.671 -9.636 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.275 -5.753 -8.057 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.823 -6.155 -7.340 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.262 -4.937 -10.507 1.00 0.00 H new ATOM 0 HD2 TYR A 17 17.822 -5.183 -8.177 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.379 -3.384 -12.050 1.00 0.00 H new ATOM 0 HE2 TYR A 17 18.939 -3.634 -9.721 1.00 0.00 H new ATOM 0 HH TYR A 17 17.188 -1.940 -12.230 1.00 0.00 H new ATOM 280 N SER A 18 14.647 -8.608 -6.711 1.00 0.00 N ATOM 281 CA SER A 18 14.850 -9.539 -5.606 1.00 0.00 C ATOM 282 C SER A 18 14.868 -10.980 -6.104 1.00 0.00 C ATOM 283 O SER A 18 13.858 -11.492 -6.587 1.00 0.00 O ATOM 284 CB SER A 18 13.755 -9.365 -4.552 1.00 0.00 C ATOM 285 OG SER A 18 14.255 -9.607 -3.249 1.00 0.00 O ATOM 0 H SER A 18 13.827 -8.010 -6.615 1.00 0.00 H new ATOM 0 HA SER A 18 15.816 -9.317 -5.153 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.351 -8.354 -4.607 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.933 -10.049 -4.762 1.00 0.00 H new ATOM 0 HG SER A 18 15.047 -9.051 -3.094 1.00 0.00 H new ATOM 291 N GLY A 19 16.020 -11.629 -5.982 1.00 0.00 N ATOM 292 CA GLY A 19 16.146 -13.006 -6.423 1.00 0.00 C ATOM 293 C GLY A 19 17.424 -13.251 -7.202 1.00 0.00 C ATOM 294 O GLY A 19 18.108 -14.250 -6.987 1.00 0.00 O ATOM 0 H GLY A 19 16.869 -11.227 -5.586 1.00 0.00 H new ATOM 0 HA2 GLY A 19 16.121 -13.666 -5.556 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.289 -13.265 -7.045 1.00 0.00 H new ATOM 355 N LYS A 24 15.945 -13.198 -2.242 1.00 0.00 N ATOM 356 CA LYS A 24 14.736 -13.303 -3.054 1.00 0.00 C ATOM 357 C LYS A 24 13.503 -12.916 -2.241 1.00 0.00 C ATOM 358 O LYS A 24 12.505 -13.637 -2.219 1.00 0.00 O ATOM 359 CB LYS A 24 14.578 -14.723 -3.605 1.00 0.00 C ATOM 360 CG LYS A 24 13.564 -14.830 -4.733 1.00 0.00 C ATOM 361 CD LYS A 24 13.583 -16.210 -5.368 1.00 0.00 C ATOM 362 CE LYS A 24 12.869 -17.236 -4.502 1.00 0.00 C ATOM 363 NZ LYS A 24 13.757 -18.377 -4.147 1.00 0.00 N ATOM 0 HA LYS A 24 14.831 -12.612 -3.891 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.546 -15.074 -3.963 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.278 -15.387 -2.794 1.00 0.00 H new ATOM 0 HG2 LYS A 24 12.566 -14.619 -4.348 1.00 0.00 H new ATOM 0 HG3 LYS A 24 13.780 -14.076 -5.491 1.00 0.00 H new ATOM 0 HD2 LYS A 24 13.108 -16.167 -6.348 1.00 0.00 H new ATOM 0 HD3 LYS A 24 14.615 -16.523 -5.528 1.00 0.00 H new ATOM 0 HE2 LYS A 24 12.512 -16.756 -3.591 1.00 0.00 H new ATOM 0 HE3 LYS A 24 11.992 -17.609 -5.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 13.233 -19.054 -3.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 14.077 -18.851 -5.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 14.582 -18.024 -3.621 1.00 0.00 H new ATOM 377 N HIS A 25 13.586 -11.770 -1.574 1.00 0.00 N ATOM 378 CA HIS A 25 12.486 -11.273 -0.755 1.00 0.00 C ATOM 379 C HIS A 25 12.767 -9.851 -0.281 1.00 0.00 C ATOM 380 O HIS A 25 11.861 -9.032 -0.158 1.00 0.00 O ATOM 381 CB HIS A 25 12.258 -12.188 0.448 1.00 0.00 C ATOM 382 CG HIS A 25 10.957 -11.941 1.146 1.00 0.00 C ATOM 383 ND1 HIS A 25 10.444 -12.787 2.106 1.00 0.00 N ATOM 384 CD2 HIS A 25 10.062 -10.932 1.020 1.00 0.00 C ATOM 385 CE1 HIS A 25 9.289 -12.311 2.539 1.00 0.00 C ATOM 386 NE2 HIS A 25 9.035 -11.187 1.896 1.00 0.00 N ATOM 0 H HIS A 25 14.407 -11.165 -1.585 1.00 0.00 H new ATOM 0 HA HIS A 25 11.585 -11.265 -1.368 1.00 0.00 H new ATOM 0 HB2 HIS A 25 12.293 -13.226 0.117 1.00 0.00 H new ATOM 0 HB3 HIS A 25 13.074 -12.052 1.158 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.141 -10.085 0.355 1.00 0.00 H new ATOM 0 HE1 HIS A 25 8.660 -12.765 3.291 1.00 0.00 H new ATOM 0 HE2 HIS A 25 8.210 -10.602 2.028 1.00 0.00 H new ATOM 395 N LYS A 26 14.032 -9.559 -0.013 1.00 0.00 N ATOM 396 CA LYS A 26 14.429 -8.238 0.449 1.00 0.00 C ATOM 397 C LYS A 26 15.245 -7.527 -0.620 1.00 0.00 C ATOM 398 O LYS A 26 15.746 -8.154 -1.553 1.00 0.00 O ATOM 399 CB LYS A 26 15.251 -8.351 1.733 1.00 0.00 C ATOM 400 CG LYS A 26 14.503 -7.926 2.988 1.00 0.00 C ATOM 401 CD LYS A 26 14.081 -9.127 3.823 1.00 0.00 C ATOM 402 CE LYS A 26 13.311 -10.144 2.995 1.00 0.00 C ATOM 403 NZ LYS A 26 12.125 -10.676 3.723 1.00 0.00 N ATOM 0 H LYS A 26 14.802 -10.221 -0.108 1.00 0.00 H new ATOM 0 HA LYS A 26 13.528 -7.659 0.652 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.580 -9.383 1.851 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.148 -7.740 1.633 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.137 -7.271 3.586 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.622 -7.348 2.709 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.964 -9.600 4.252 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.462 -8.792 4.656 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.986 -9.681 2.063 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.972 -10.969 2.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.955 -11.661 3.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.301 -10.639 4.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.290 -10.100 3.494 1.00 0.00 H new ATOM 417 N LEU A 27 15.377 -6.216 -0.474 1.00 0.00 N ATOM 418 CA LEU A 27 16.135 -5.416 -1.426 1.00 0.00 C ATOM 419 C LEU A 27 17.097 -4.493 -0.687 1.00 0.00 C ATOM 420 O LEU A 27 16.756 -3.929 0.351 1.00 0.00 O ATOM 421 CB LEU A 27 15.194 -4.594 -2.316 1.00 0.00 C ATOM 422 CG LEU A 27 14.312 -5.387 -3.302 1.00 0.00 C ATOM 423 CD1 LEU A 27 15.086 -6.538 -3.931 1.00 0.00 C ATOM 424 CD2 LEU A 27 13.044 -5.898 -2.619 1.00 0.00 C ATOM 0 H LEU A 27 14.969 -5.684 0.295 1.00 0.00 H new ATOM 0 HA LEU A 27 16.708 -6.091 -2.062 1.00 0.00 H new ATOM 0 HB2 LEU A 27 14.541 -4.006 -1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.796 -3.888 -2.888 1.00 0.00 H new ATOM 0 HG LEU A 27 14.016 -4.705 -4.099 1.00 0.00 H new ATOM 0 HD11 LEU A 27 14.438 -7.078 -4.621 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.946 -6.145 -4.473 1.00 0.00 H new ATOM 0 HD13 LEU A 27 15.429 -7.216 -3.149 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.442 -6.453 -3.338 1.00 0.00 H new ATOM 0 HD22 LEU A 27 13.315 -6.553 -1.791 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.469 -5.053 -2.240 1.00 0.00 H new ATOM 436 N LYS A 28 18.304 -4.350 -1.218 1.00 0.00 N ATOM 437 CA LYS A 28 19.316 -3.504 -0.593 1.00 0.00 C ATOM 438 C LYS A 28 19.473 -2.179 -1.332 1.00 0.00 C ATOM 439 O LYS A 28 18.764 -1.905 -2.299 1.00 0.00 O ATOM 440 CB LYS A 28 20.659 -4.236 -0.543 1.00 0.00 C ATOM 441 CG LYS A 28 21.366 -4.121 0.798 1.00 0.00 C ATOM 442 CD LYS A 28 22.455 -5.173 0.947 1.00 0.00 C ATOM 443 CE LYS A 28 23.603 -4.928 -0.018 1.00 0.00 C ATOM 444 NZ LYS A 28 23.420 -5.665 -1.299 1.00 0.00 N ATOM 0 H LYS A 28 18.607 -4.807 -2.078 1.00 0.00 H new ATOM 0 HA LYS A 28 18.985 -3.286 0.422 1.00 0.00 H new ATOM 0 HB2 LYS A 28 20.497 -5.290 -0.770 1.00 0.00 H new ATOM 0 HB3 LYS A 28 21.309 -3.838 -1.322 1.00 0.00 H new ATOM 0 HG2 LYS A 28 21.803 -3.127 0.896 1.00 0.00 H new ATOM 0 HG3 LYS A 28 20.640 -4.231 1.604 1.00 0.00 H new ATOM 0 HD2 LYS A 28 22.831 -5.166 1.970 1.00 0.00 H new ATOM 0 HD3 LYS A 28 22.033 -6.162 0.769 1.00 0.00 H new ATOM 0 HE2 LYS A 28 23.684 -3.860 -0.222 1.00 0.00 H new ATOM 0 HE3 LYS A 28 24.540 -5.236 0.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 24.215 -6.320 -1.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.530 -6.203 -1.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 23.386 -4.988 -2.087 1.00 0.00 H new ATOM 458 N LYS A 29 20.413 -1.361 -0.864 1.00 0.00 N ATOM 459 CA LYS A 29 20.676 -0.060 -1.473 1.00 0.00 C ATOM 460 C LYS A 29 20.911 -0.196 -2.974 1.00 0.00 C ATOM 461 O LYS A 29 20.671 0.738 -3.737 1.00 0.00 O ATOM 462 CB LYS A 29 21.890 0.596 -0.812 1.00 0.00 C ATOM 463 CG LYS A 29 21.665 0.963 0.647 1.00 0.00 C ATOM 464 CD LYS A 29 22.902 0.692 1.488 1.00 0.00 C ATOM 465 CE LYS A 29 22.535 0.135 2.855 1.00 0.00 C ATOM 466 NZ LYS A 29 22.123 1.210 3.800 1.00 0.00 N ATOM 0 H LYS A 29 21.006 -1.577 -0.063 1.00 0.00 H new ATOM 0 HA LYS A 29 19.800 0.570 -1.319 1.00 0.00 H new ATOM 0 HB2 LYS A 29 22.741 -0.082 -0.880 1.00 0.00 H new ATOM 0 HB3 LYS A 29 22.154 1.496 -1.368 1.00 0.00 H new ATOM 0 HG2 LYS A 29 21.398 2.017 0.721 1.00 0.00 H new ATOM 0 HG3 LYS A 29 20.824 0.392 1.041 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.549 -0.014 0.968 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.470 1.614 1.610 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.724 -0.585 2.748 1.00 0.00 H new ATOM 0 HE3 LYS A 29 23.387 -0.405 3.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.881 0.790 4.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.906 1.883 3.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.294 1.709 3.418 1.00 0.00 H new ATOM 480 N SER A 30 21.377 -1.366 -3.393 1.00 0.00 N ATOM 481 CA SER A 30 21.636 -1.620 -4.803 1.00 0.00 C ATOM 482 C SER A 30 20.354 -2.027 -5.521 1.00 0.00 C ATOM 483 O SER A 30 20.074 -1.560 -6.624 1.00 0.00 O ATOM 484 CB SER A 30 22.695 -2.714 -4.961 1.00 0.00 C ATOM 485 OG SER A 30 23.688 -2.611 -3.956 1.00 0.00 O ATOM 0 H SER A 30 21.583 -2.152 -2.777 1.00 0.00 H new ATOM 0 HA SER A 30 22.009 -0.700 -5.253 1.00 0.00 H new ATOM 0 HB2 SER A 30 22.221 -3.694 -4.909 1.00 0.00 H new ATOM 0 HB3 SER A 30 23.159 -2.636 -5.944 1.00 0.00 H new ATOM 0 HG SER A 30 24.352 -3.322 -4.078 1.00 0.00 H new ATOM 491 N GLU A 31 19.582 -2.903 -4.887 1.00 0.00 N ATOM 492 CA GLU A 31 18.332 -3.378 -5.465 1.00 0.00 C ATOM 493 C GLU A 31 17.198 -2.383 -5.236 1.00 0.00 C ATOM 494 O GLU A 31 16.656 -1.823 -6.187 1.00 0.00 O ATOM 495 CB GLU A 31 17.957 -4.740 -4.879 1.00 0.00 C ATOM 496 CG GLU A 31 19.035 -5.797 -5.060 1.00 0.00 C ATOM 497 CD GLU A 31 19.705 -6.180 -3.754 1.00 0.00 C ATOM 498 OE1 GLU A 31 18.988 -6.332 -2.743 1.00 0.00 O ATOM 499 OE2 GLU A 31 20.944 -6.327 -3.744 1.00 0.00 O ATOM 0 H GLU A 31 19.801 -3.298 -3.972 1.00 0.00 H new ATOM 0 HA GLU A 31 18.483 -3.479 -6.540 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.748 -4.624 -3.815 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.037 -5.087 -5.348 1.00 0.00 H new ATOM 0 HG2 GLU A 31 18.594 -6.686 -5.512 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.788 -5.426 -5.755 1.00 0.00 H new ATOM 506 N LEU A 32 16.837 -2.167 -3.969 1.00 0.00 N ATOM 507 CA LEU A 32 15.757 -1.242 -3.622 1.00 0.00 C ATOM 508 C LEU A 32 15.856 0.055 -4.420 1.00 0.00 C ATOM 509 O LEU A 32 14.918 0.437 -5.121 1.00 0.00 O ATOM 510 CB LEU A 32 15.778 -0.940 -2.122 1.00 0.00 C ATOM 511 CG LEU A 32 14.626 -0.067 -1.611 1.00 0.00 C ATOM 512 CD1 LEU A 32 14.851 1.391 -1.985 1.00 0.00 C ATOM 513 CD2 LEU A 32 13.294 -0.561 -2.160 1.00 0.00 C ATOM 0 H LEU A 32 17.276 -2.620 -3.168 1.00 0.00 H new ATOM 0 HA LEU A 32 14.812 -1.722 -3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.764 -1.885 -1.578 1.00 0.00 H new ATOM 0 HB3 LEU A 32 16.720 -0.447 -1.881 1.00 0.00 H new ATOM 0 HG LEU A 32 14.597 -0.141 -0.524 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.023 1.994 -1.613 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.783 1.741 -1.540 1.00 0.00 H new ATOM 0 HD13 LEU A 32 14.909 1.484 -3.069 1.00 0.00 H new ATOM 0 HD21 LEU A 32 12.489 0.072 -1.786 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.312 -0.520 -3.249 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.127 -1.589 -1.839 1.00 0.00 H new ATOM 525 N LYS A 33 16.995 0.728 -4.312 1.00 0.00 N ATOM 526 CA LYS A 33 17.211 1.980 -5.028 1.00 0.00 C ATOM 527 C LYS A 33 17.084 1.773 -6.529 1.00 0.00 C ATOM 528 O LYS A 33 16.439 2.559 -7.223 1.00 0.00 O ATOM 529 CB LYS A 33 18.590 2.542 -4.711 1.00 0.00 C ATOM 530 CG LYS A 33 18.858 2.700 -3.228 1.00 0.00 C ATOM 531 CD LYS A 33 20.146 3.462 -2.995 1.00 0.00 C ATOM 532 CE LYS A 33 20.520 3.494 -1.522 1.00 0.00 C ATOM 533 NZ LYS A 33 21.956 3.831 -1.322 1.00 0.00 N ATOM 0 H LYS A 33 17.782 0.429 -3.737 1.00 0.00 H new ATOM 0 HA LYS A 33 16.448 2.688 -4.702 1.00 0.00 H new ATOM 0 HB2 LYS A 33 19.347 1.886 -5.140 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.697 3.512 -5.196 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.028 3.227 -2.757 1.00 0.00 H new ATOM 0 HG3 LYS A 33 18.920 1.719 -2.758 1.00 0.00 H new ATOM 0 HD2 LYS A 33 20.951 2.999 -3.565 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.038 4.481 -3.366 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.900 4.227 -1.006 1.00 0.00 H new ATOM 0 HE3 LYS A 33 20.309 2.524 -1.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.360 3.211 -0.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 22.472 3.695 -2.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 22.041 4.823 -1.020 1.00 0.00 H new ATOM 547 N GLU A 34 17.715 0.714 -7.027 1.00 0.00 N ATOM 548 CA GLU A 34 17.682 0.401 -8.454 1.00 0.00 C ATOM 549 C GLU A 34 16.277 0.580 -9.029 1.00 0.00 C ATOM 550 O GLU A 34 16.109 1.190 -10.083 1.00 0.00 O ATOM 551 CB GLU A 34 18.174 -1.028 -8.699 1.00 0.00 C ATOM 552 CG GLU A 34 19.583 -1.094 -9.266 1.00 0.00 C ATOM 553 CD GLU A 34 19.632 -0.790 -10.750 1.00 0.00 C ATOM 554 OE1 GLU A 34 18.857 0.077 -11.204 1.00 0.00 O ATOM 555 OE2 GLU A 34 20.446 -1.420 -11.458 1.00 0.00 O ATOM 0 H GLU A 34 18.256 0.057 -6.464 1.00 0.00 H new ATOM 0 HA GLU A 34 18.348 1.098 -8.964 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.142 -1.581 -7.760 1.00 0.00 H new ATOM 0 HB3 GLU A 34 17.490 -1.527 -9.386 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.218 -0.386 -8.733 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.995 -2.087 -9.089 1.00 0.00 H new ATOM 562 N LEU A 35 15.268 0.064 -8.328 1.00 0.00 N ATOM 563 CA LEU A 35 13.888 0.196 -8.788 1.00 0.00 C ATOM 564 C LEU A 35 13.461 1.644 -8.752 1.00 0.00 C ATOM 565 O LEU A 35 12.767 2.127 -9.646 1.00 0.00 O ATOM 566 CB LEU A 35 12.938 -0.650 -7.942 1.00 0.00 C ATOM 567 CG LEU A 35 13.135 -2.154 -8.083 1.00 0.00 C ATOM 568 CD1 LEU A 35 13.425 -2.511 -9.532 1.00 0.00 C ATOM 569 CD2 LEU A 35 14.260 -2.612 -7.172 1.00 0.00 C ATOM 0 H LEU A 35 15.378 -0.443 -7.450 1.00 0.00 H new ATOM 0 HA LEU A 35 13.842 -0.166 -9.815 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.064 -0.377 -6.894 1.00 0.00 H new ATOM 0 HB3 LEU A 35 11.912 -0.404 -8.215 1.00 0.00 H new ATOM 0 HG LEU A 35 12.221 -2.668 -7.786 1.00 0.00 H new ATOM 0 HD11 LEU A 35 13.564 -3.588 -9.620 1.00 0.00 H new ATOM 0 HD12 LEU A 35 12.588 -2.200 -10.158 1.00 0.00 H new ATOM 0 HD13 LEU A 35 14.331 -2.000 -9.858 1.00 0.00 H new ATOM 0 HD21 LEU A 35 14.397 -3.688 -7.276 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.182 -2.100 -7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 35 14.009 -2.377 -6.138 1.00 0.00 H new ATOM 581 N ILE A 36 13.902 2.336 -7.720 1.00 0.00 N ATOM 582 CA ILE A 36 13.587 3.746 -7.570 1.00 0.00 C ATOM 583 C ILE A 36 14.015 4.486 -8.833 1.00 0.00 C ATOM 584 O ILE A 36 13.201 5.120 -9.504 1.00 0.00 O ATOM 585 CB ILE A 36 14.256 4.364 -6.310 1.00 0.00 C ATOM 586 CG1 ILE A 36 13.217 4.493 -5.190 1.00 0.00 C ATOM 587 CG2 ILE A 36 14.893 5.717 -6.621 1.00 0.00 C ATOM 588 CD1 ILE A 36 13.693 5.287 -3.993 1.00 0.00 C ATOM 0 H ILE A 36 14.478 1.947 -6.974 1.00 0.00 H new ATOM 0 HA ILE A 36 12.511 3.848 -7.430 1.00 0.00 H new ATOM 0 HB ILE A 36 15.056 3.701 -5.982 1.00 0.00 H new ATOM 0 HG12 ILE A 36 12.321 4.966 -5.593 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.929 3.495 -4.859 1.00 0.00 H new ATOM 0 HG21 ILE A 36 15.351 6.120 -5.718 1.00 0.00 H new ATOM 0 HG22 ILE A 36 15.655 5.592 -7.390 1.00 0.00 H new ATOM 0 HG23 ILE A 36 14.128 6.406 -6.978 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.900 5.331 -3.247 1.00 0.00 H new ATOM 0 HD12 ILE A 36 14.570 4.805 -3.562 1.00 0.00 H new ATOM 0 HD13 ILE A 36 13.952 6.298 -4.307 1.00 0.00 H new ATOM 600 N ASN A 37 15.290 4.365 -9.175 1.00 0.00 N ATOM 601 CA ASN A 37 15.800 4.990 -10.384 1.00 0.00 C ATOM 602 C ASN A 37 15.238 4.275 -11.609 1.00 0.00 C ATOM 603 O ASN A 37 15.162 4.848 -12.696 1.00 0.00 O ATOM 604 CB ASN A 37 17.334 4.977 -10.415 1.00 0.00 C ATOM 605 CG ASN A 37 17.925 3.683 -9.886 1.00 0.00 C ATOM 606 OD1 ASN A 37 18.021 2.690 -10.607 1.00 0.00 O ATOM 607 ND2 ASN A 37 18.324 3.691 -8.619 1.00 0.00 N ATOM 0 H ASN A 37 15.983 3.845 -8.637 1.00 0.00 H new ATOM 0 HA ASN A 37 15.478 6.031 -10.394 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.673 5.133 -11.439 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.711 5.811 -9.824 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.729 2.851 -8.207 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.225 4.537 -8.058 1.00 0.00 H new ATOM 614 N ASN A 38 14.821 3.019 -11.420 1.00 0.00 N ATOM 615 CA ASN A 38 14.242 2.240 -12.506 1.00 0.00 C ATOM 616 C ASN A 38 12.900 2.836 -12.910 1.00 0.00 C ATOM 617 O ASN A 38 12.618 3.002 -14.096 1.00 0.00 O ATOM 618 CB ASN A 38 14.058 0.770 -12.099 1.00 0.00 C ATOM 619 CG ASN A 38 13.613 -0.095 -13.262 1.00 0.00 C ATOM 620 OD1 ASN A 38 13.261 0.410 -14.327 1.00 0.00 O ATOM 621 ND2 ASN A 38 13.626 -1.408 -13.061 1.00 0.00 N ATOM 0 H ASN A 38 14.875 2.527 -10.528 1.00 0.00 H new ATOM 0 HA ASN A 38 14.928 2.275 -13.353 1.00 0.00 H new ATOM 0 HB2 ASN A 38 14.997 0.385 -11.700 1.00 0.00 H new ATOM 0 HB3 ASN A 38 13.321 0.706 -11.298 1.00 0.00 H new ATOM 0 HD21 ASN A 38 13.336 -2.041 -13.807 1.00 0.00 H new ATOM 0 HD22 ASN A 38 13.926 -1.783 -12.161 1.00 0.00 H new ATOM 628 N GLU A 39 12.074 3.160 -11.914 1.00 0.00 N ATOM 629 CA GLU A 39 10.763 3.738 -12.180 1.00 0.00 C ATOM 630 C GLU A 39 10.031 4.127 -10.892 1.00 0.00 C ATOM 631 O GLU A 39 8.955 3.605 -10.600 1.00 0.00 O ATOM 632 CB GLU A 39 9.921 2.749 -12.984 1.00 0.00 C ATOM 633 CG GLU A 39 9.510 1.512 -12.200 1.00 0.00 C ATOM 634 CD GLU A 39 9.541 0.252 -13.043 1.00 0.00 C ATOM 635 OE1 GLU A 39 8.980 0.270 -14.159 1.00 0.00 O ATOM 636 OE2 GLU A 39 10.125 -0.753 -12.586 1.00 0.00 O ATOM 0 H GLU A 39 12.290 3.032 -10.925 1.00 0.00 H new ATOM 0 HA GLU A 39 10.913 4.652 -12.755 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.024 3.256 -13.341 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.484 2.439 -13.865 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.176 1.390 -11.346 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.505 1.655 -11.803 1.00 0.00 H new ATOM 643 N LEU A 40 10.606 5.052 -10.127 1.00 0.00 N ATOM 644 CA LEU A 40 9.977 5.496 -8.885 1.00 0.00 C ATOM 645 C LEU A 40 8.862 6.510 -9.150 1.00 0.00 C ATOM 646 O LEU A 40 8.046 6.786 -8.270 1.00 0.00 O ATOM 647 CB LEU A 40 11.010 6.090 -7.922 1.00 0.00 C ATOM 648 CG LEU A 40 11.393 7.547 -8.176 1.00 0.00 C ATOM 649 CD1 LEU A 40 12.492 7.981 -7.220 1.00 0.00 C ATOM 650 CD2 LEU A 40 11.831 7.738 -9.617 1.00 0.00 C ATOM 0 H LEU A 40 11.495 5.504 -10.341 1.00 0.00 H new ATOM 0 HA LEU A 40 9.534 4.616 -8.420 1.00 0.00 H new ATOM 0 HB2 LEU A 40 10.622 6.007 -6.907 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.914 5.483 -7.968 1.00 0.00 H new ATOM 0 HG LEU A 40 10.517 8.171 -7.999 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.753 9.021 -7.414 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.141 7.881 -6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.371 7.353 -7.366 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.100 8.782 -9.780 1.00 0.00 H new ATOM 0 HD22 LEU A 40 12.694 7.104 -9.822 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.014 7.465 -10.285 1.00 0.00 H new ATOM 779 N LYS A 48 15.326 12.405 -3.347 1.00 0.00 N ATOM 780 CA LYS A 48 15.749 13.768 -3.667 1.00 0.00 C ATOM 781 C LYS A 48 17.264 13.851 -3.843 1.00 0.00 C ATOM 782 O LYS A 48 17.772 14.758 -4.501 1.00 0.00 O ATOM 783 CB LYS A 48 15.301 14.737 -2.569 1.00 0.00 C ATOM 784 CG LYS A 48 13.891 14.478 -2.056 1.00 0.00 C ATOM 785 CD LYS A 48 13.898 13.993 -0.615 1.00 0.00 C ATOM 786 CE LYS A 48 12.692 13.117 -0.316 1.00 0.00 C ATOM 787 NZ LYS A 48 11.415 13.876 -0.414 1.00 0.00 N ATOM 0 HA LYS A 48 15.278 14.049 -4.609 1.00 0.00 H new ATOM 0 HB2 LYS A 48 15.999 14.672 -1.734 1.00 0.00 H new ATOM 0 HB3 LYS A 48 15.356 15.756 -2.952 1.00 0.00 H new ATOM 0 HG2 LYS A 48 13.303 15.393 -2.129 1.00 0.00 H new ATOM 0 HG3 LYS A 48 13.404 13.735 -2.688 1.00 0.00 H new ATOM 0 HD2 LYS A 48 14.813 13.432 -0.423 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.902 14.850 0.058 1.00 0.00 H new ATOM 0 HE2 LYS A 48 12.670 12.279 -1.013 1.00 0.00 H new ATOM 0 HE3 LYS A 48 12.788 12.697 0.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 10.618 13.243 -0.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 11.424 14.660 0.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 11.310 14.256 -1.376 1.00 0.00 H new ATOM 801 N GLU A 49 17.977 12.902 -3.247 1.00 0.00 N ATOM 802 CA GLU A 49 19.431 12.865 -3.331 1.00 0.00 C ATOM 803 C GLU A 49 19.952 11.473 -2.994 1.00 0.00 C ATOM 804 O GLU A 49 19.173 10.543 -2.791 1.00 0.00 O ATOM 805 CB GLU A 49 20.041 13.893 -2.375 1.00 0.00 C ATOM 806 CG GLU A 49 21.290 14.569 -2.917 1.00 0.00 C ATOM 807 CD GLU A 49 22.374 14.717 -1.867 1.00 0.00 C ATOM 808 OE1 GLU A 49 22.287 15.661 -1.054 1.00 0.00 O ATOM 809 OE2 GLU A 49 23.309 13.889 -1.859 1.00 0.00 O ATOM 0 H GLU A 49 17.569 12.145 -2.698 1.00 0.00 H new ATOM 0 HA GLU A 49 19.722 13.110 -4.352 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.295 14.655 -2.151 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.285 13.400 -1.434 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.678 13.990 -3.755 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.027 15.553 -3.304 1.00 0.00 H new ATOM 816 N GLN A 50 21.270 11.334 -2.927 1.00 0.00 N ATOM 817 CA GLN A 50 21.881 10.052 -2.605 1.00 0.00 C ATOM 818 C GLN A 50 21.773 9.769 -1.110 1.00 0.00 C ATOM 819 O GLN A 50 21.438 8.657 -0.696 1.00 0.00 O ATOM 820 CB GLN A 50 23.349 10.042 -3.033 1.00 0.00 C ATOM 821 CG GLN A 50 23.558 9.612 -4.476 1.00 0.00 C ATOM 822 CD GLN A 50 24.978 9.842 -4.952 1.00 0.00 C ATOM 823 OE1 GLN A 50 25.627 10.814 -4.562 1.00 0.00 O ATOM 824 NE2 GLN A 50 25.469 8.948 -5.802 1.00 0.00 N ATOM 0 H GLN A 50 21.934 12.091 -3.091 1.00 0.00 H new ATOM 0 HA GLN A 50 21.348 9.271 -3.148 1.00 0.00 H new ATOM 0 HB2 GLN A 50 23.766 11.040 -2.896 1.00 0.00 H new ATOM 0 HB3 GLN A 50 23.905 9.371 -2.378 1.00 0.00 H new ATOM 0 HG2 GLN A 50 23.312 8.555 -4.576 1.00 0.00 H new ATOM 0 HG3 GLN A 50 22.870 10.161 -5.118 1.00 0.00 H new ATOM 0 HE21 GLN A 50 24.896 8.158 -6.099 1.00 0.00 H new ATOM 0 HE22 GLN A 50 26.419 9.051 -6.158 1.00 0.00 H new ATOM 833 N GLU A 51 22.059 10.788 -0.308 1.00 0.00 N ATOM 834 CA GLU A 51 21.999 10.658 1.142 1.00 0.00 C ATOM 835 C GLU A 51 20.593 10.301 1.607 1.00 0.00 C ATOM 836 O GLU A 51 20.419 9.459 2.488 1.00 0.00 O ATOM 837 CB GLU A 51 22.455 11.956 1.814 1.00 0.00 C ATOM 838 CG GLU A 51 21.890 13.212 1.169 1.00 0.00 C ATOM 839 CD GLU A 51 21.086 14.058 2.137 1.00 0.00 C ATOM 840 OE1 GLU A 51 20.287 13.483 2.906 1.00 0.00 O ATOM 841 OE2 GLU A 51 21.256 15.295 2.127 1.00 0.00 O ATOM 0 H GLU A 51 22.335 11.713 -0.638 1.00 0.00 H new ATOM 0 HA GLU A 51 22.671 9.850 1.431 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.161 11.934 2.863 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.544 12.004 1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.709 13.808 0.766 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.257 12.930 0.328 1.00 0.00 H new ATOM 848 N VAL A 52 19.589 10.945 1.019 1.00 0.00 N ATOM 849 CA VAL A 52 18.207 10.681 1.397 1.00 0.00 C ATOM 850 C VAL A 52 17.838 9.225 1.134 1.00 0.00 C ATOM 851 O VAL A 52 17.205 8.581 1.968 1.00 0.00 O ATOM 852 CB VAL A 52 17.208 11.613 0.669 1.00 0.00 C ATOM 853 CG1 VAL A 52 17.758 13.028 0.581 1.00 0.00 C ATOM 854 CG2 VAL A 52 16.863 11.083 -0.715 1.00 0.00 C ATOM 0 H VAL A 52 19.705 11.646 0.287 1.00 0.00 H new ATOM 0 HA VAL A 52 18.134 10.884 2.465 1.00 0.00 H new ATOM 0 HB VAL A 52 16.289 11.636 1.255 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.040 13.666 0.066 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.931 13.414 1.585 1.00 0.00 H new ATOM 0 HG13 VAL A 52 18.698 13.019 0.029 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.160 11.760 -1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 52 17.771 11.013 -1.314 1.00 0.00 H new ATOM 0 HG23 VAL A 52 16.411 10.095 -0.624 1.00 0.00 H new ATOM 864 N VAL A 53 18.229 8.707 -0.032 1.00 0.00 N ATOM 865 CA VAL A 53 17.923 7.328 -0.386 1.00 0.00 C ATOM 866 C VAL A 53 18.277 6.375 0.749 1.00 0.00 C ATOM 867 O VAL A 53 17.438 5.604 1.212 1.00 0.00 O ATOM 868 CB VAL A 53 18.643 6.851 -1.653 1.00 0.00 C ATOM 869 CG1 VAL A 53 17.970 5.583 -2.154 1.00 0.00 C ATOM 870 CG2 VAL A 53 18.646 7.929 -2.725 1.00 0.00 C ATOM 0 H VAL A 53 18.754 9.221 -0.740 1.00 0.00 H new ATOM 0 HA VAL A 53 16.850 7.316 -0.576 1.00 0.00 H new ATOM 0 HB VAL A 53 19.685 6.638 -1.414 1.00 0.00 H new ATOM 0 HG11 VAL A 53 18.475 5.235 -3.055 1.00 0.00 H new ATOM 0 HG12 VAL A 53 18.028 4.812 -1.385 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.924 5.791 -2.381 1.00 0.00 H new ATOM 0 HG21 VAL A 53 19.164 7.560 -3.610 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.619 8.186 -2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 53 19.157 8.815 -2.349 1.00 0.00 H new ATOM 880 N ASP A 54 19.524 6.433 1.204 1.00 0.00 N ATOM 881 CA ASP A 54 19.964 5.572 2.294 1.00 0.00 C ATOM 882 C ASP A 54 19.047 5.747 3.498 1.00 0.00 C ATOM 883 O ASP A 54 18.800 4.805 4.250 1.00 0.00 O ATOM 884 CB ASP A 54 21.410 5.888 2.681 1.00 0.00 C ATOM 885 CG ASP A 54 22.399 5.452 1.618 1.00 0.00 C ATOM 886 OD1 ASP A 54 22.237 5.865 0.450 1.00 0.00 O ATOM 887 OD2 ASP A 54 23.338 4.700 1.953 1.00 0.00 O ATOM 0 H ASP A 54 20.241 7.060 0.839 1.00 0.00 H new ATOM 0 HA ASP A 54 19.917 4.536 1.959 1.00 0.00 H new ATOM 0 HB2 ASP A 54 21.512 6.960 2.851 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.649 5.392 3.622 1.00 0.00 H new ATOM 892 N LYS A 55 18.534 6.963 3.658 1.00 0.00 N ATOM 893 CA LYS A 55 17.631 7.281 4.750 1.00 0.00 C ATOM 894 C LYS A 55 16.235 6.747 4.456 1.00 0.00 C ATOM 895 O LYS A 55 15.589 6.183 5.333 1.00 0.00 O ATOM 896 CB LYS A 55 17.581 8.793 4.979 1.00 0.00 C ATOM 897 CG LYS A 55 17.684 9.189 6.443 1.00 0.00 C ATOM 898 CD LYS A 55 17.650 10.700 6.618 1.00 0.00 C ATOM 899 CE LYS A 55 18.809 11.195 7.470 1.00 0.00 C ATOM 900 NZ LYS A 55 18.336 11.921 8.681 1.00 0.00 N ATOM 0 H LYS A 55 18.733 7.748 3.038 1.00 0.00 H new ATOM 0 HA LYS A 55 18.004 6.804 5.656 1.00 0.00 H new ATOM 0 HB2 LYS A 55 18.394 9.263 4.426 1.00 0.00 H new ATOM 0 HB3 LYS A 55 16.649 9.184 4.570 1.00 0.00 H new ATOM 0 HG2 LYS A 55 16.863 8.739 7.001 1.00 0.00 H new ATOM 0 HG3 LYS A 55 18.609 8.794 6.863 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.686 11.180 5.640 1.00 0.00 H new ATOM 0 HD3 LYS A 55 16.707 10.991 7.081 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.426 10.348 7.772 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.442 11.854 6.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 19.042 11.829 9.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.202 12.927 8.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.433 11.515 8.999 1.00 0.00 H new ATOM 914 N VAL A 56 15.775 6.918 3.217 1.00 0.00 N ATOM 915 CA VAL A 56 14.455 6.433 2.830 1.00 0.00 C ATOM 916 C VAL A 56 14.422 4.910 2.886 1.00 0.00 C ATOM 917 O VAL A 56 13.526 4.331 3.501 1.00 0.00 O ATOM 918 CB VAL A 56 14.032 6.927 1.426 1.00 0.00 C ATOM 919 CG1 VAL A 56 15.083 6.603 0.394 1.00 0.00 C ATOM 920 CG2 VAL A 56 12.681 6.348 1.031 1.00 0.00 C ATOM 0 H VAL A 56 16.293 7.384 2.472 1.00 0.00 H new ATOM 0 HA VAL A 56 13.738 6.841 3.542 1.00 0.00 H new ATOM 0 HB VAL A 56 13.934 8.012 1.469 1.00 0.00 H new ATOM 0 HG11 VAL A 56 14.757 6.962 -0.582 1.00 0.00 H new ATOM 0 HG12 VAL A 56 16.021 7.088 0.665 1.00 0.00 H new ATOM 0 HG13 VAL A 56 15.232 5.524 0.352 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.406 6.710 0.040 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.742 5.260 1.016 1.00 0.00 H new ATOM 0 HG23 VAL A 56 11.927 6.659 1.754 1.00 0.00 H new ATOM 930 N MET A 57 15.416 4.256 2.278 1.00 0.00 N ATOM 931 CA MET A 57 15.476 2.799 2.319 1.00 0.00 C ATOM 932 C MET A 57 15.587 2.337 3.773 1.00 0.00 C ATOM 933 O MET A 57 15.205 1.219 4.118 1.00 0.00 O ATOM 934 CB MET A 57 16.653 2.277 1.475 1.00 0.00 C ATOM 935 CG MET A 57 17.899 1.911 2.273 1.00 0.00 C ATOM 936 SD MET A 57 17.808 0.260 3.004 1.00 0.00 S ATOM 937 CE MET A 57 17.544 -0.761 1.554 1.00 0.00 C ATOM 0 H MET A 57 16.174 4.704 1.763 1.00 0.00 H new ATOM 0 HA MET A 57 14.562 2.388 1.889 1.00 0.00 H new ATOM 0 HB2 MET A 57 16.323 1.399 0.921 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.920 3.036 0.740 1.00 0.00 H new ATOM 0 HG2 MET A 57 18.771 1.966 1.621 1.00 0.00 H new ATOM 0 HG3 MET A 57 18.046 2.646 3.065 1.00 0.00 H new ATOM 0 HE1 MET A 57 17.834 -1.788 1.775 1.00 0.00 H new ATOM 0 HE2 MET A 57 16.490 -0.733 1.276 1.00 0.00 H new ATOM 0 HE3 MET A 57 18.147 -0.383 0.728 1.00 0.00 H new ATOM 947 N GLU A 58 16.107 3.227 4.620 1.00 0.00 N ATOM 948 CA GLU A 58 16.269 2.948 6.041 1.00 0.00 C ATOM 949 C GLU A 58 14.996 3.306 6.808 1.00 0.00 C ATOM 950 O GLU A 58 14.629 2.640 7.776 1.00 0.00 O ATOM 951 CB GLU A 58 17.453 3.746 6.594 1.00 0.00 C ATOM 952 CG GLU A 58 18.766 2.980 6.569 1.00 0.00 C ATOM 953 CD GLU A 58 19.869 3.688 7.331 1.00 0.00 C ATOM 954 OE1 GLU A 58 20.292 4.777 6.890 1.00 0.00 O ATOM 955 OE2 GLU A 58 20.310 3.154 8.371 1.00 0.00 O ATOM 0 H GLU A 58 16.425 4.155 4.339 1.00 0.00 H new ATOM 0 HA GLU A 58 16.461 1.883 6.167 1.00 0.00 H new ATOM 0 HB2 GLU A 58 17.565 4.663 6.015 1.00 0.00 H new ATOM 0 HB3 GLU A 58 17.234 4.042 7.620 1.00 0.00 H new ATOM 0 HG2 GLU A 58 18.612 1.989 6.997 1.00 0.00 H new ATOM 0 HG3 GLU A 58 19.079 2.836 5.535 1.00 0.00 H new ATOM 962 N THR A 59 14.331 4.368 6.363 1.00 0.00 N ATOM 963 CA THR A 59 13.099 4.837 6.989 1.00 0.00 C ATOM 964 C THR A 59 11.999 3.789 6.868 1.00 0.00 C ATOM 965 O THR A 59 11.107 3.709 7.712 1.00 0.00 O ATOM 966 CB THR A 59 12.651 6.152 6.337 1.00 0.00 C ATOM 967 OG1 THR A 59 13.657 7.142 6.460 1.00 0.00 O ATOM 968 CG2 THR A 59 11.377 6.724 6.921 1.00 0.00 C ATOM 0 H THR A 59 14.629 4.925 5.562 1.00 0.00 H new ATOM 0 HA THR A 59 13.291 5.010 8.048 1.00 0.00 H new ATOM 0 HB THR A 59 12.465 5.897 5.294 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.508 6.787 6.128 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.126 7.652 6.408 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.565 6.008 6.793 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.521 6.924 7.983 1.00 0.00 H new ATOM 976 N LEU A 60 12.073 2.987 5.813 1.00 0.00 N ATOM 977 CA LEU A 60 11.088 1.940 5.574 1.00 0.00 C ATOM 978 C LEU A 60 11.474 0.655 6.301 1.00 0.00 C ATOM 979 O LEU A 60 10.614 -0.147 6.660 1.00 0.00 O ATOM 980 CB LEU A 60 10.956 1.674 4.075 1.00 0.00 C ATOM 981 CG LEU A 60 10.877 2.929 3.204 1.00 0.00 C ATOM 982 CD1 LEU A 60 11.654 2.732 1.913 1.00 0.00 C ATOM 983 CD2 LEU A 60 9.427 3.282 2.908 1.00 0.00 C ATOM 0 H LEU A 60 12.807 3.042 5.107 1.00 0.00 H new ATOM 0 HA LEU A 60 10.128 2.279 5.962 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.808 1.077 3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.062 1.074 3.904 1.00 0.00 H new ATOM 0 HG LEU A 60 11.327 3.757 3.752 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.586 3.635 1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.699 2.528 2.145 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.234 1.891 1.360 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.390 4.177 2.287 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.952 2.455 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.899 3.467 3.844 1.00 0.00 H new ATOM 995 N ASP A 61 12.775 0.465 6.512 1.00 0.00 N ATOM 996 CA ASP A 61 13.279 -0.725 7.195 1.00 0.00 C ATOM 997 C ASP A 61 12.488 -1.005 8.469 1.00 0.00 C ATOM 998 O ASP A 61 12.767 -0.436 9.524 1.00 0.00 O ATOM 999 CB ASP A 61 14.762 -0.556 7.531 1.00 0.00 C ATOM 1000 CG ASP A 61 15.459 -1.887 7.742 1.00 0.00 C ATOM 1001 OD1 ASP A 61 15.065 -2.622 8.670 1.00 0.00 O ATOM 1002 OD2 ASP A 61 16.398 -2.191 6.977 1.00 0.00 O ATOM 0 H ASP A 61 13.500 1.120 6.220 1.00 0.00 H new ATOM 0 HA ASP A 61 13.158 -1.574 6.522 1.00 0.00 H new ATOM 0 HB2 ASP A 61 15.256 -0.014 6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.862 0.051 8.431 1.00 0.00 H new ATOM 1007 N ASN A 62 11.500 -1.888 8.363 1.00 0.00 N ATOM 1008 CA ASN A 62 10.668 -2.248 9.505 1.00 0.00 C ATOM 1009 C ASN A 62 10.696 -3.755 9.740 1.00 0.00 C ATOM 1010 O ASN A 62 10.813 -4.215 10.876 1.00 0.00 O ATOM 1011 CB ASN A 62 9.229 -1.780 9.285 1.00 0.00 C ATOM 1012 CG ASN A 62 8.478 -1.588 10.587 1.00 0.00 C ATOM 1013 OD1 ASN A 62 9.080 -1.495 11.657 1.00 0.00 O ATOM 1014 ND2 ASN A 62 7.154 -1.528 10.503 1.00 0.00 N ATOM 0 H ASN A 62 11.256 -2.368 7.497 1.00 0.00 H new ATOM 0 HA ASN A 62 11.070 -1.751 10.388 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.236 -0.841 8.731 1.00 0.00 H new ATOM 0 HB3 ASN A 62 8.703 -2.510 8.669 1.00 0.00 H new ATOM 0 HD21 ASN A 62 6.595 -1.400 11.346 1.00 0.00 H new ATOM 0 HD22 ASN A 62 6.696 -1.610 9.595 1.00 0.00 H new ATOM 1021 N ASP A 63 10.591 -4.516 8.657 1.00 0.00 N ATOM 1022 CA ASP A 63 10.605 -5.971 8.740 1.00 0.00 C ATOM 1023 C ASP A 63 11.420 -6.569 7.598 1.00 0.00 C ATOM 1024 O ASP A 63 11.040 -7.586 7.017 1.00 0.00 O ATOM 1025 CB ASP A 63 9.176 -6.520 8.709 1.00 0.00 C ATOM 1026 CG ASP A 63 8.973 -7.657 9.690 1.00 0.00 C ATOM 1027 OD1 ASP A 63 9.672 -8.684 9.561 1.00 0.00 O ATOM 1028 OD2 ASP A 63 8.114 -7.522 10.587 1.00 0.00 O ATOM 0 H ASP A 63 10.495 -4.149 7.710 1.00 0.00 H new ATOM 0 HA ASP A 63 11.072 -6.254 9.684 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.476 -5.717 8.938 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.945 -6.867 7.702 1.00 0.00 H new ATOM 1033 N GLY A 64 12.543 -5.931 7.281 1.00 0.00 N ATOM 1034 CA GLY A 64 13.394 -6.415 6.211 1.00 0.00 C ATOM 1035 C GLY A 64 14.733 -6.925 6.709 1.00 0.00 C ATOM 1036 O GLY A 64 15.613 -7.251 5.913 1.00 0.00 O ATOM 0 H GLY A 64 12.878 -5.088 7.747 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.881 -7.216 5.679 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.561 -5.611 5.494 1.00 0.00 H new ATOM 1040 N ASP A 65 14.891 -6.991 8.028 1.00 0.00 N ATOM 1041 CA ASP A 65 16.137 -7.462 8.623 1.00 0.00 C ATOM 1042 C ASP A 65 17.315 -6.603 8.170 1.00 0.00 C ATOM 1043 O ASP A 65 18.462 -7.050 8.182 1.00 0.00 O ATOM 1044 CB ASP A 65 16.383 -8.925 8.248 1.00 0.00 C ATOM 1045 CG ASP A 65 17.039 -9.707 9.369 1.00 0.00 C ATOM 1046 OD1 ASP A 65 18.117 -9.283 9.837 1.00 0.00 O ATOM 1047 OD2 ASP A 65 16.475 -10.743 9.780 1.00 0.00 O ATOM 0 H ASP A 65 14.174 -6.725 8.703 1.00 0.00 H new ATOM 0 HA ASP A 65 16.048 -7.381 9.706 1.00 0.00 H new ATOM 0 HB2 ASP A 65 15.435 -9.395 7.988 1.00 0.00 H new ATOM 0 HB3 ASP A 65 17.014 -8.968 7.361 1.00 0.00 H new ATOM 1052 N GLY A 66 17.022 -5.370 7.770 1.00 0.00 N ATOM 1053 CA GLY A 66 18.065 -4.468 7.319 1.00 0.00 C ATOM 1054 C GLY A 66 18.000 -4.191 5.827 1.00 0.00 C ATOM 1055 O GLY A 66 18.894 -3.554 5.269 1.00 0.00 O ATOM 0 H GLY A 66 16.080 -4.979 7.750 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.985 -3.527 7.862 1.00 0.00 H new ATOM 0 HA3 GLY A 66 19.038 -4.895 7.563 1.00 0.00 H new ATOM 1059 N GLU A 67 16.939 -4.666 5.179 1.00 0.00 N ATOM 1060 CA GLU A 67 16.757 -4.464 3.753 1.00 0.00 C ATOM 1061 C GLU A 67 15.315 -4.074 3.462 1.00 0.00 C ATOM 1062 O GLU A 67 14.507 -3.922 4.378 1.00 0.00 O ATOM 1063 CB GLU A 67 17.128 -5.732 2.982 1.00 0.00 C ATOM 1064 CG GLU A 67 18.441 -5.620 2.227 1.00 0.00 C ATOM 1065 CD GLU A 67 18.761 -6.867 1.424 1.00 0.00 C ATOM 1066 OE1 GLU A 67 18.960 -7.934 2.039 1.00 0.00 O ATOM 1067 OE2 GLU A 67 18.814 -6.773 0.179 1.00 0.00 O ATOM 0 H GLU A 67 16.191 -5.196 5.626 1.00 0.00 H new ATOM 0 HA GLU A 67 17.414 -3.657 3.428 1.00 0.00 H new ATOM 0 HB2 GLU A 67 17.189 -6.567 3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.331 -5.965 2.276 1.00 0.00 H new ATOM 0 HG2 GLU A 67 18.398 -4.762 1.556 1.00 0.00 H new ATOM 0 HG3 GLU A 67 19.248 -5.431 2.935 1.00 0.00 H new ATOM 1074 N CYS A 68 14.996 -3.911 2.187 1.00 0.00 N ATOM 1075 CA CYS A 68 13.648 -3.534 1.786 1.00 0.00 C ATOM 1076 C CYS A 68 12.959 -4.672 1.043 1.00 0.00 C ATOM 1077 O CYS A 68 13.173 -4.859 -0.150 1.00 0.00 O ATOM 1078 CB CYS A 68 13.689 -2.284 0.904 1.00 0.00 C ATOM 1079 SG CYS A 68 12.620 -0.943 1.476 1.00 0.00 S ATOM 0 H CYS A 68 15.650 -4.033 1.414 1.00 0.00 H new ATOM 0 HA CYS A 68 13.076 -3.318 2.688 1.00 0.00 H new ATOM 0 HB2 CYS A 68 14.715 -1.920 0.855 1.00 0.00 H new ATOM 0 HB3 CYS A 68 13.399 -2.558 -0.110 1.00 0.00 H new ATOM 0 HG CYS A 68 12.725 0.070 0.668 1.00 0.00 H new ATOM 1085 N ASP A 69 12.117 -5.418 1.750 1.00 0.00 N ATOM 1086 CA ASP A 69 11.385 -6.519 1.142 1.00 0.00 C ATOM 1087 C ASP A 69 10.005 -6.033 0.718 1.00 0.00 C ATOM 1088 O ASP A 69 9.697 -4.847 0.838 1.00 0.00 O ATOM 1089 CB ASP A 69 11.249 -7.699 2.109 1.00 0.00 C ATOM 1090 CG ASP A 69 11.110 -7.277 3.561 1.00 0.00 C ATOM 1091 OD1 ASP A 69 10.779 -6.100 3.812 1.00 0.00 O ATOM 1092 OD2 ASP A 69 11.325 -8.131 4.447 1.00 0.00 O ATOM 0 H ASP A 69 11.926 -5.279 2.742 1.00 0.00 H new ATOM 0 HA ASP A 69 11.941 -6.864 0.270 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.379 -8.292 1.826 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.122 -8.344 2.008 1.00 0.00 H new ATOM 1097 N PHE A 70 9.166 -6.944 0.243 1.00 0.00 N ATOM 1098 CA PHE A 70 7.816 -6.580 -0.167 1.00 0.00 C ATOM 1099 C PHE A 70 7.050 -5.969 1.002 1.00 0.00 C ATOM 1100 O PHE A 70 6.053 -5.268 0.816 1.00 0.00 O ATOM 1101 CB PHE A 70 7.070 -7.805 -0.691 1.00 0.00 C ATOM 1102 CG PHE A 70 5.788 -7.464 -1.383 1.00 0.00 C ATOM 1103 CD1 PHE A 70 5.770 -6.521 -2.395 1.00 0.00 C ATOM 1104 CD2 PHE A 70 4.603 -8.080 -1.021 1.00 0.00 C ATOM 1105 CE1 PHE A 70 4.590 -6.197 -3.036 1.00 0.00 C ATOM 1106 CE2 PHE A 70 3.420 -7.762 -1.657 1.00 0.00 C ATOM 1107 CZ PHE A 70 3.413 -6.819 -2.665 1.00 0.00 C ATOM 0 H PHE A 70 9.393 -7.932 0.133 1.00 0.00 H new ATOM 0 HA PHE A 70 7.889 -5.842 -0.966 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.715 -8.347 -1.382 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.859 -8.477 0.141 1.00 0.00 H new ATOM 0 HD1 PHE A 70 6.688 -6.033 -2.687 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.604 -8.818 -0.232 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.587 -5.460 -3.825 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.501 -8.250 -1.366 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.488 -6.567 -3.163 1.00 0.00 H new ATOM 1117 N GLN A 71 7.531 -6.240 2.208 1.00 0.00 N ATOM 1118 CA GLN A 71 6.905 -5.719 3.418 1.00 0.00 C ATOM 1119 C GLN A 71 7.045 -4.203 3.477 1.00 0.00 C ATOM 1120 O GLN A 71 6.114 -3.490 3.863 1.00 0.00 O ATOM 1121 CB GLN A 71 7.543 -6.345 4.663 1.00 0.00 C ATOM 1122 CG GLN A 71 7.918 -7.810 4.497 1.00 0.00 C ATOM 1123 CD GLN A 71 6.778 -8.649 3.957 1.00 0.00 C ATOM 1124 OE1 GLN A 71 6.963 -9.454 3.043 1.00 0.00 O ATOM 1125 NE2 GLN A 71 5.590 -8.464 4.519 1.00 0.00 N ATOM 0 H GLN A 71 8.354 -6.819 2.376 1.00 0.00 H new ATOM 0 HA GLN A 71 5.846 -5.978 3.394 1.00 0.00 H new ATOM 0 HB2 GLN A 71 8.437 -5.779 4.924 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.851 -6.250 5.500 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.772 -7.888 3.824 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.234 -8.211 5.460 1.00 0.00 H new ATOM 0 HE21 GLN A 71 5.483 -7.786 5.274 1.00 0.00 H new ATOM 0 HE22 GLN A 71 4.784 -9.000 4.196 1.00 0.00 H new ATOM 1134 N GLU A 72 8.214 -3.715 3.080 1.00 0.00 N ATOM 1135 CA GLU A 72 8.480 -2.284 3.076 1.00 0.00 C ATOM 1136 C GLU A 72 7.730 -1.615 1.935 1.00 0.00 C ATOM 1137 O GLU A 72 7.335 -0.456 2.032 1.00 0.00 O ATOM 1138 CB GLU A 72 9.982 -2.023 2.966 1.00 0.00 C ATOM 1139 CG GLU A 72 10.817 -2.936 3.844 1.00 0.00 C ATOM 1140 CD GLU A 72 10.312 -3.012 5.272 1.00 0.00 C ATOM 1141 OE1 GLU A 72 9.533 -2.123 5.675 1.00 0.00 O ATOM 1142 OE2 GLU A 72 10.695 -3.962 5.988 1.00 0.00 O ATOM 0 H GLU A 72 8.992 -4.290 2.757 1.00 0.00 H new ATOM 0 HA GLU A 72 8.129 -1.857 4.015 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.290 -2.148 1.928 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.184 -0.987 3.236 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.824 -3.937 3.414 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.848 -2.583 3.848 1.00 0.00 H new ATOM 1149 N PHE A 73 7.513 -2.369 0.861 1.00 0.00 N ATOM 1150 CA PHE A 73 6.779 -1.868 -0.295 1.00 0.00 C ATOM 1151 C PHE A 73 5.441 -1.297 0.151 1.00 0.00 C ATOM 1152 O PHE A 73 5.080 -0.172 -0.197 1.00 0.00 O ATOM 1153 CB PHE A 73 6.543 -3.004 -1.295 1.00 0.00 C ATOM 1154 CG PHE A 73 7.420 -2.974 -2.515 1.00 0.00 C ATOM 1155 CD1 PHE A 73 8.591 -2.227 -2.552 1.00 0.00 C ATOM 1156 CD2 PHE A 73 7.067 -3.708 -3.632 1.00 0.00 C ATOM 1157 CE1 PHE A 73 9.386 -2.218 -3.683 1.00 0.00 C ATOM 1158 CE2 PHE A 73 7.854 -3.704 -4.762 1.00 0.00 C ATOM 1159 CZ PHE A 73 9.017 -2.959 -4.790 1.00 0.00 C ATOM 0 H PHE A 73 7.836 -3.332 0.768 1.00 0.00 H new ATOM 0 HA PHE A 73 7.365 -1.083 -0.774 1.00 0.00 H new ATOM 0 HB2 PHE A 73 6.692 -3.954 -0.783 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.501 -2.975 -1.615 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.883 -1.648 -1.689 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.160 -4.294 -3.618 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.294 -1.633 -3.702 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.562 -4.283 -5.626 1.00 0.00 H new ATOM 0 HZ PHE A 73 9.636 -2.956 -5.675 1.00 0.00 H new ATOM 1169 N MET A 74 4.715 -2.085 0.935 1.00 0.00 N ATOM 1170 CA MET A 74 3.420 -1.667 1.448 1.00 0.00 C ATOM 1171 C MET A 74 3.563 -0.403 2.286 1.00 0.00 C ATOM 1172 O MET A 74 2.936 0.616 1.998 1.00 0.00 O ATOM 1173 CB MET A 74 2.797 -2.784 2.285 1.00 0.00 C ATOM 1174 CG MET A 74 2.678 -4.105 1.544 1.00 0.00 C ATOM 1175 SD MET A 74 1.477 -4.044 0.198 1.00 0.00 S ATOM 1176 CE MET A 74 2.441 -3.250 -1.086 1.00 0.00 C ATOM 0 H MET A 74 5.003 -3.018 1.229 1.00 0.00 H new ATOM 0 HA MET A 74 2.766 -1.453 0.603 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.398 -2.933 3.182 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.806 -2.471 2.614 1.00 0.00 H new ATOM 0 HG2 MET A 74 3.653 -4.381 1.143 1.00 0.00 H new ATOM 0 HG3 MET A 74 2.390 -4.886 2.247 1.00 0.00 H new ATOM 0 HE1 MET A 74 2.187 -3.685 -2.053 1.00 0.00 H new ATOM 0 HE2 MET A 74 2.221 -2.183 -1.099 1.00 0.00 H new ATOM 0 HE3 MET A 74 3.503 -3.399 -0.889 1.00 0.00 H new ATOM 1186 N ALA A 75 4.399 -0.473 3.318 1.00 0.00 N ATOM 1187 CA ALA A 75 4.628 0.675 4.189 1.00 0.00 C ATOM 1188 C ALA A 75 5.144 1.869 3.392 1.00 0.00 C ATOM 1189 O ALA A 75 4.856 3.019 3.718 1.00 0.00 O ATOM 1190 CB ALA A 75 5.608 0.312 5.295 1.00 0.00 C ATOM 0 H ALA A 75 4.927 -1.308 3.571 1.00 0.00 H new ATOM 0 HA ALA A 75 3.677 0.955 4.641 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.769 1.178 5.937 1.00 0.00 H new ATOM 0 HB2 ALA A 75 5.201 -0.508 5.887 1.00 0.00 H new ATOM 0 HB3 ALA A 75 6.557 0.005 4.854 1.00 0.00 H new ATOM 1196 N PHE A 76 5.903 1.584 2.340 1.00 0.00 N ATOM 1197 CA PHE A 76 6.459 2.626 1.485 1.00 0.00 C ATOM 1198 C PHE A 76 5.349 3.453 0.856 1.00 0.00 C ATOM 1199 O PHE A 76 5.104 4.592 1.256 1.00 0.00 O ATOM 1200 CB PHE A 76 7.323 2.001 0.386 1.00 0.00 C ATOM 1201 CG PHE A 76 8.122 2.996 -0.404 1.00 0.00 C ATOM 1202 CD1 PHE A 76 7.499 3.963 -1.179 1.00 0.00 C ATOM 1203 CD2 PHE A 76 9.503 2.960 -0.369 1.00 0.00 C ATOM 1204 CE1 PHE A 76 8.244 4.875 -1.903 1.00 0.00 C ATOM 1205 CE2 PHE A 76 10.254 3.869 -1.090 1.00 0.00 C ATOM 1206 CZ PHE A 76 9.623 4.829 -1.858 1.00 0.00 C ATOM 0 H PHE A 76 6.148 0.635 2.058 1.00 0.00 H new ATOM 0 HA PHE A 76 7.077 3.280 2.100 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.005 1.281 0.839 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.679 1.445 -0.295 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.420 4.004 -1.217 1.00 0.00 H new ATOM 0 HD2 PHE A 76 10.002 2.212 0.229 1.00 0.00 H new ATOM 0 HE1 PHE A 76 7.748 5.623 -2.503 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.333 3.829 -1.053 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.207 5.541 -2.422 1.00 0.00 H new ATOM 1216 N VAL A 77 4.680 2.874 -0.133 1.00 0.00 N ATOM 1217 CA VAL A 77 3.597 3.560 -0.820 1.00 0.00 C ATOM 1218 C VAL A 77 2.493 3.964 0.150 1.00 0.00 C ATOM 1219 O VAL A 77 1.782 4.933 -0.084 1.00 0.00 O ATOM 1220 CB VAL A 77 2.982 2.680 -1.926 1.00 0.00 C ATOM 1221 CG1 VAL A 77 3.840 2.716 -3.181 1.00 0.00 C ATOM 1222 CG2 VAL A 77 2.796 1.250 -1.436 1.00 0.00 C ATOM 0 H VAL A 77 4.869 1.932 -0.476 1.00 0.00 H new ATOM 0 HA VAL A 77 4.032 4.453 -1.269 1.00 0.00 H new ATOM 0 HB VAL A 77 2.000 3.082 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.388 2.088 -3.949 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.910 3.741 -3.545 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.838 2.344 -2.950 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.361 0.646 -2.232 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.763 0.834 -1.152 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.131 1.245 -0.572 1.00 0.00 H new ATOM 1232 N ALA A 78 2.346 3.201 1.226 1.00 0.00 N ATOM 1233 CA ALA A 78 1.304 3.468 2.220 1.00 0.00 C ATOM 1234 C ALA A 78 1.641 4.645 3.134 1.00 0.00 C ATOM 1235 O ALA A 78 0.800 5.515 3.364 1.00 0.00 O ATOM 1236 CB ALA A 78 1.046 2.221 3.052 1.00 0.00 C ATOM 0 H ALA A 78 2.932 2.393 1.436 1.00 0.00 H new ATOM 0 HA ALA A 78 0.404 3.742 1.669 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.270 2.429 3.788 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.720 1.410 2.401 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.963 1.929 3.564 1.00 0.00 H new ATOM 1242 N MET A 79 2.855 4.667 3.671 1.00 0.00 N ATOM 1243 CA MET A 79 3.265 5.740 4.572 1.00 0.00 C ATOM 1244 C MET A 79 3.436 7.046 3.812 1.00 0.00 C ATOM 1245 O MET A 79 2.778 8.045 4.105 1.00 0.00 O ATOM 1246 CB MET A 79 4.572 5.378 5.281 1.00 0.00 C ATOM 1247 CG MET A 79 4.410 4.311 6.352 1.00 0.00 C ATOM 1248 SD MET A 79 5.577 4.511 7.712 1.00 0.00 S ATOM 1249 CE MET A 79 7.125 4.142 6.889 1.00 0.00 C ATOM 0 H MET A 79 3.570 3.959 3.500 1.00 0.00 H new ATOM 0 HA MET A 79 2.482 5.869 5.319 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.293 5.031 4.541 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.990 6.276 5.736 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.393 4.345 6.743 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.546 3.327 5.903 1.00 0.00 H new ATOM 0 HE1 MET A 79 7.945 4.224 7.602 1.00 0.00 H new ATOM 0 HE2 MET A 79 7.092 3.129 6.489 1.00 0.00 H new ATOM 0 HE3 MET A 79 7.281 4.849 6.074 1.00 0.00 H new ATOM 1259 N VAL A 80 4.324 7.023 2.832 1.00 0.00 N ATOM 1260 CA VAL A 80 4.600 8.190 2.010 1.00 0.00 C ATOM 1261 C VAL A 80 3.310 8.788 1.443 1.00 0.00 C ATOM 1262 O VAL A 80 3.187 10.007 1.303 1.00 0.00 O ATOM 1263 CB VAL A 80 5.555 7.811 0.860 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.787 8.990 -0.077 1.00 0.00 C ATOM 1265 CG2 VAL A 80 6.875 7.300 1.417 1.00 0.00 C ATOM 0 H VAL A 80 4.872 6.199 2.584 1.00 0.00 H new ATOM 0 HA VAL A 80 5.073 8.943 2.640 1.00 0.00 H new ATOM 0 HB VAL A 80 5.088 7.014 0.281 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.464 8.691 -0.877 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.836 9.307 -0.506 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.227 9.817 0.481 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.539 7.036 0.594 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.339 8.078 2.023 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.693 6.419 2.033 1.00 0.00 H new ATOM 1275 N THR A 81 2.352 7.922 1.122 1.00 0.00 N ATOM 1276 CA THR A 81 1.071 8.357 0.572 1.00 0.00 C ATOM 1277 C THR A 81 0.219 9.053 1.631 1.00 0.00 C ATOM 1278 O THR A 81 -0.158 10.216 1.473 1.00 0.00 O ATOM 1279 CB THR A 81 0.324 7.145 -0.002 1.00 0.00 C ATOM 1280 OG1 THR A 81 0.818 6.820 -1.288 1.00 0.00 O ATOM 1281 CG2 THR A 81 -1.177 7.322 -0.128 1.00 0.00 C ATOM 0 H THR A 81 2.439 6.912 1.234 1.00 0.00 H new ATOM 0 HA THR A 81 1.262 9.078 -0.223 1.00 0.00 H new ATOM 0 HB THR A 81 0.505 6.351 0.723 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.149 5.898 -1.288 1.00 0.00 H new ATOM 0 HG21 THR A 81 -1.617 6.415 -0.542 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.604 7.516 0.856 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.390 8.163 -0.788 1.00 0.00 H new ATOM 1289 N THR A 82 -0.095 8.317 2.695 1.00 0.00 N ATOM 1290 CA THR A 82 -0.929 8.824 3.786 1.00 0.00 C ATOM 1291 C THR A 82 -0.561 10.247 4.190 1.00 0.00 C ATOM 1292 O THR A 82 -1.400 10.986 4.706 1.00 0.00 O ATOM 1293 CB THR A 82 -0.829 7.901 5.001 1.00 0.00 C ATOM 1294 OG1 THR A 82 -1.123 6.564 4.639 1.00 0.00 O ATOM 1295 CG2 THR A 82 -1.762 8.288 6.128 1.00 0.00 C ATOM 0 H THR A 82 0.219 7.356 2.826 1.00 0.00 H new ATOM 0 HA THR A 82 -1.955 8.843 3.418 1.00 0.00 H new ATOM 0 HB THR A 82 0.198 7.999 5.354 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.291 6.092 4.428 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.639 7.592 6.957 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.527 9.298 6.464 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.793 8.254 5.775 1.00 0.00 H new ATOM 1303 N ALA A 83 0.683 10.634 3.966 1.00 0.00 N ATOM 1304 CA ALA A 83 1.116 11.974 4.318 1.00 0.00 C ATOM 1305 C ALA A 83 0.766 12.979 3.231 1.00 0.00 C ATOM 1306 O ALA A 83 -0.099 13.834 3.417 1.00 0.00 O ATOM 1307 CB ALA A 83 2.605 12.003 4.599 1.00 0.00 C ATOM 0 H ALA A 83 1.404 10.046 3.547 1.00 0.00 H new ATOM 0 HA ALA A 83 0.583 12.260 5.225 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.906 13.017 4.861 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.832 11.332 5.427 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.149 11.680 3.711 1.00 0.00 H new ATOM 1313 N CYS A 84 1.464 12.888 2.107 1.00 0.00 N ATOM 1314 CA CYS A 84 1.241 13.813 1.003 1.00 0.00 C ATOM 1315 C CYS A 84 0.164 13.334 0.041 1.00 0.00 C ATOM 1316 O CYS A 84 -0.809 14.044 -0.206 1.00 0.00 O ATOM 1317 CB CYS A 84 2.546 14.069 0.247 1.00 0.00 C ATOM 1318 SG CYS A 84 2.776 15.787 -0.266 1.00 0.00 S ATOM 0 H CYS A 84 2.185 12.188 1.936 1.00 0.00 H new ATOM 0 HA CYS A 84 0.886 14.745 1.443 1.00 0.00 H new ATOM 0 HB2 CYS A 84 3.384 13.775 0.879 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.573 13.430 -0.636 1.00 0.00 H new ATOM 0 HG CYS A 84 1.967 16.552 0.405 1.00 0.00 H new ATOM 1324 N HIS A 85 0.327 12.133 -0.506 1.00 0.00 N ATOM 1325 CA HIS A 85 -0.662 11.604 -1.441 1.00 0.00 C ATOM 1326 C HIS A 85 -2.054 11.653 -0.823 1.00 0.00 C ATOM 1327 O HIS A 85 -3.064 11.618 -1.526 1.00 0.00 O ATOM 1328 CB HIS A 85 -0.310 10.179 -1.859 1.00 0.00 C ATOM 1329 CG HIS A 85 -0.714 9.857 -3.263 1.00 0.00 C ATOM 1330 ND1 HIS A 85 0.054 9.091 -4.113 1.00 0.00 N ATOM 1331 CD2 HIS A 85 -1.812 10.214 -3.972 1.00 0.00 C ATOM 1332 CE1 HIS A 85 -0.551 8.992 -5.282 1.00 0.00 C ATOM 1333 NE2 HIS A 85 -1.686 9.665 -5.224 1.00 0.00 N ATOM 0 H HIS A 85 1.119 11.517 -0.323 1.00 0.00 H new ATOM 0 HA HIS A 85 -0.656 12.228 -2.335 1.00 0.00 H new ATOM 0 HB2 HIS A 85 0.765 10.032 -1.755 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.795 9.478 -1.179 1.00 0.00 H new ATOM 0 HD1 HIS A 85 0.951 8.667 -3.876 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -2.634 10.818 -3.618 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -0.181 8.452 -6.141 1.00 0.00 H new ATOM 1342 N GLU A 86 -2.089 11.749 0.501 1.00 0.00 N ATOM 1343 CA GLU A 86 -3.334 11.822 1.244 1.00 0.00 C ATOM 1344 C GLU A 86 -4.228 12.937 0.709 1.00 0.00 C ATOM 1345 O GLU A 86 -5.313 12.682 0.188 1.00 0.00 O ATOM 1346 CB GLU A 86 -3.009 12.056 2.723 1.00 0.00 C ATOM 1347 CG GLU A 86 -4.200 12.494 3.565 1.00 0.00 C ATOM 1348 CD GLU A 86 -4.073 13.922 4.059 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -2.928 14.397 4.218 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -5.118 14.566 4.289 1.00 0.00 O ATOM 0 H GLU A 86 -1.254 11.778 1.086 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.878 10.885 1.128 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.601 11.137 3.143 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.229 12.814 2.796 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.112 12.397 2.976 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.301 11.826 4.420 1.00 0.00 H new ATOM 1357 N PHE A 87 -3.759 14.171 0.839 1.00 0.00 N ATOM 1358 CA PHE A 87 -4.509 15.327 0.365 1.00 0.00 C ATOM 1359 C PHE A 87 -3.722 16.073 -0.706 1.00 0.00 C ATOM 1360 O PHE A 87 -4.300 16.718 -1.579 1.00 0.00 O ATOM 1361 CB PHE A 87 -4.840 16.263 1.530 1.00 0.00 C ATOM 1362 CG PHE A 87 -6.283 16.679 1.569 1.00 0.00 C ATOM 1363 CD1 PHE A 87 -7.295 15.743 1.413 1.00 0.00 C ATOM 1364 CD2 PHE A 87 -6.629 18.007 1.758 1.00 0.00 C ATOM 1365 CE1 PHE A 87 -8.622 16.125 1.447 1.00 0.00 C ATOM 1366 CE2 PHE A 87 -7.955 18.395 1.792 1.00 0.00 C ATOM 1367 CZ PHE A 87 -8.953 17.452 1.637 1.00 0.00 C ATOM 0 H PHE A 87 -2.862 14.397 1.269 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.442 14.975 -0.074 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.587 15.768 2.467 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.215 17.153 1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.042 14.704 1.263 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -5.853 18.748 1.880 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.400 15.386 1.325 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -8.211 19.434 1.940 1.00 0.00 H new ATOM 0 HZ PHE A 87 -9.990 17.752 1.664 1.00 0.00 H new ATOM 1377 N PHE A 88 -2.397 15.971 -0.638 1.00 0.00 N ATOM 1378 CA PHE A 88 -1.533 16.625 -1.607 1.00 0.00 C ATOM 1379 C PHE A 88 -1.457 15.815 -2.899 1.00 0.00 C ATOM 1380 O PHE A 88 -1.100 16.346 -3.951 1.00 0.00 O ATOM 1381 CB PHE A 88 -0.130 16.825 -1.027 1.00 0.00 C ATOM 1382 CG PHE A 88 0.034 18.125 -0.292 1.00 0.00 C ATOM 1383 CD1 PHE A 88 -0.202 19.331 -0.932 1.00 0.00 C ATOM 1384 CD2 PHE A 88 0.424 18.140 1.038 1.00 0.00 C ATOM 1385 CE1 PHE A 88 -0.054 20.528 -0.258 1.00 0.00 C ATOM 1386 CE2 PHE A 88 0.575 19.334 1.717 1.00 0.00 C ATOM 1387 CZ PHE A 88 0.336 20.530 1.067 1.00 0.00 C ATOM 0 H PHE A 88 -1.902 15.441 0.079 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.960 17.601 -1.836 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.095 16.002 -0.349 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.599 16.779 -1.836 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.505 19.335 -1.969 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.612 17.208 1.550 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.243 21.462 -0.767 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.879 19.333 2.753 1.00 0.00 H new ATOM 0 HZ PHE A 88 0.454 21.465 1.594 1.00 0.00 H new ATOM 1447 N SER B 1 6.904 1.710 -15.290 1.00 0.00 N ATOM 1448 CA SER B 1 6.300 2.749 -14.413 1.00 0.00 C ATOM 1449 C SER B 1 5.136 2.181 -13.607 1.00 0.00 C ATOM 1450 O SER B 1 4.164 2.881 -13.323 1.00 0.00 O ATOM 1451 CB SER B 1 5.819 3.906 -15.289 1.00 0.00 C ATOM 1452 OG SER B 1 5.991 5.149 -14.630 1.00 0.00 O ATOM 0 H1 SER B 1 7.456 2.169 -16.042 1.00 0.00 H new ATOM 0 H2 SER B 1 7.529 1.099 -14.725 1.00 0.00 H new ATOM 0 H3 SER B 1 6.150 1.134 -15.716 1.00 0.00 H new ATOM 0 HA SER B 1 7.050 3.100 -13.705 1.00 0.00 H new ATOM 0 HB2 SER B 1 6.371 3.909 -16.229 1.00 0.00 H new ATOM 0 HB3 SER B 1 4.767 3.765 -15.538 1.00 0.00 H new ATOM 0 HG SER B 1 5.678 5.873 -15.211 1.00 0.00 H new ATOM 1460 N GLU B 2 5.241 0.908 -13.242 1.00 0.00 N ATOM 1461 CA GLU B 2 4.196 0.245 -12.469 1.00 0.00 C ATOM 1462 C GLU B 2 3.955 0.962 -11.145 1.00 0.00 C ATOM 1463 O GLU B 2 2.877 0.855 -10.558 1.00 0.00 O ATOM 1464 CB GLU B 2 4.574 -1.214 -12.210 1.00 0.00 C ATOM 1465 CG GLU B 2 4.189 -2.150 -13.344 1.00 0.00 C ATOM 1466 CD GLU B 2 4.669 -3.570 -13.117 1.00 0.00 C ATOM 1467 OE1 GLU B 2 5.841 -3.745 -12.722 1.00 0.00 O ATOM 1468 OE2 GLU B 2 3.873 -4.508 -13.335 1.00 0.00 O ATOM 0 H GLU B 2 6.039 0.314 -13.469 1.00 0.00 H new ATOM 0 HA GLU B 2 3.274 0.279 -13.050 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.650 -1.279 -12.045 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.090 -1.549 -11.293 1.00 0.00 H new ATOM 0 HG2 GLU B 2 3.105 -2.151 -13.457 1.00 0.00 H new ATOM 0 HG3 GLU B 2 4.607 -1.774 -14.278 1.00 0.00 H new ATOM 1475 N LEU B 3 4.961 1.691 -10.678 1.00 0.00 N ATOM 1476 CA LEU B 3 4.856 2.425 -9.424 1.00 0.00 C ATOM 1477 C LEU B 3 3.724 3.445 -9.483 1.00 0.00 C ATOM 1478 O LEU B 3 2.760 3.361 -8.721 1.00 0.00 O ATOM 1479 CB LEU B 3 6.179 3.128 -9.108 1.00 0.00 C ATOM 1480 CG LEU B 3 7.096 2.379 -8.140 1.00 0.00 C ATOM 1481 CD1 LEU B 3 6.498 2.364 -6.742 1.00 0.00 C ATOM 1482 CD2 LEU B 3 7.345 0.961 -8.632 1.00 0.00 C ATOM 0 H LEU B 3 5.860 1.789 -11.150 1.00 0.00 H new ATOM 0 HA LEU B 3 4.634 1.711 -8.631 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.718 3.292 -10.041 1.00 0.00 H new ATOM 0 HB3 LEU B 3 5.960 4.110 -8.690 1.00 0.00 H new ATOM 0 HG LEU B 3 8.052 2.900 -8.097 1.00 0.00 H new ATOM 0 HD11 LEU B 3 7.164 1.827 -6.067 1.00 0.00 H new ATOM 0 HD12 LEU B 3 6.372 3.388 -6.389 1.00 0.00 H new ATOM 0 HD13 LEU B 3 5.528 1.867 -6.766 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.999 0.442 -7.931 1.00 0.00 H new ATOM 0 HD22 LEU B 3 6.396 0.429 -8.704 1.00 0.00 H new ATOM 0 HD23 LEU B 3 7.818 0.994 -9.614 1.00 0.00 H new ATOM 1494 N GLU B 4 3.850 4.409 -10.389 1.00 0.00 N ATOM 1495 CA GLU B 4 2.839 5.449 -10.546 1.00 0.00 C ATOM 1496 C GLU B 4 1.507 4.858 -11.001 1.00 0.00 C ATOM 1497 O GLU B 4 0.445 5.264 -10.528 1.00 0.00 O ATOM 1498 CB GLU B 4 3.316 6.501 -11.550 1.00 0.00 C ATOM 1499 CG GLU B 4 3.455 7.892 -10.953 1.00 0.00 C ATOM 1500 CD GLU B 4 3.716 8.953 -12.002 1.00 0.00 C ATOM 1501 OE1 GLU B 4 4.814 8.939 -12.599 1.00 0.00 O ATOM 1502 OE2 GLU B 4 2.826 9.799 -12.226 1.00 0.00 O ATOM 0 H GLU B 4 4.642 4.492 -11.026 1.00 0.00 H new ATOM 0 HA GLU B 4 2.688 5.922 -9.576 1.00 0.00 H new ATOM 0 HB2 GLU B 4 4.278 6.192 -11.958 1.00 0.00 H new ATOM 0 HB3 GLU B 4 2.614 6.541 -12.383 1.00 0.00 H new ATOM 0 HG2 GLU B 4 2.545 8.142 -10.408 1.00 0.00 H new ATOM 0 HG3 GLU B 4 4.271 7.893 -10.230 1.00 0.00 H new ATOM 1509 N LYS B 5 1.571 3.902 -11.921 1.00 0.00 N ATOM 1510 CA LYS B 5 0.367 3.258 -12.441 1.00 0.00 C ATOM 1511 C LYS B 5 -0.452 2.634 -11.315 1.00 0.00 C ATOM 1512 O LYS B 5 -1.600 3.014 -11.086 1.00 0.00 O ATOM 1513 CB LYS B 5 0.741 2.190 -13.472 1.00 0.00 C ATOM 1514 CG LYS B 5 0.665 2.681 -14.909 1.00 0.00 C ATOM 1515 CD LYS B 5 1.974 2.449 -15.651 1.00 0.00 C ATOM 1516 CE LYS B 5 2.246 0.967 -15.851 1.00 0.00 C ATOM 1517 NZ LYS B 5 1.413 0.391 -16.942 1.00 0.00 N ATOM 0 H LYS B 5 2.442 3.555 -12.323 1.00 0.00 H new ATOM 0 HA LYS B 5 -0.243 4.022 -12.923 1.00 0.00 H new ATOM 0 HB2 LYS B 5 1.753 1.839 -13.269 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.077 1.334 -13.353 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.144 2.166 -15.428 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.424 3.744 -14.919 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.938 2.947 -16.620 1.00 0.00 H new ATOM 0 HD3 LYS B 5 2.795 2.898 -15.092 1.00 0.00 H new ATOM 0 HE2 LYS B 5 3.301 0.820 -16.084 1.00 0.00 H new ATOM 0 HE3 LYS B 5 2.047 0.433 -14.922 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 1.629 -0.621 -17.046 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 0.406 0.508 -16.709 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 1.621 0.883 -17.834 1.00 0.00 H new ATOM 1531 N ALA B 6 0.145 1.673 -10.617 1.00 0.00 N ATOM 1532 CA ALA B 6 -0.529 0.992 -9.516 1.00 0.00 C ATOM 1533 C ALA B 6 -0.998 1.980 -8.455 1.00 0.00 C ATOM 1534 O ALA B 6 -2.056 1.801 -7.853 1.00 0.00 O ATOM 1535 CB ALA B 6 0.395 -0.048 -8.901 1.00 0.00 C ATOM 0 H ALA B 6 1.095 1.348 -10.794 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.411 0.493 -9.917 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.117 -0.550 -8.081 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.673 -0.781 -9.658 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.293 0.441 -8.523 1.00 0.00 H new ATOM 1541 N MET B 7 -0.209 3.023 -8.230 1.00 0.00 N ATOM 1542 CA MET B 7 -0.553 4.033 -7.240 1.00 0.00 C ATOM 1543 C MET B 7 -1.893 4.681 -7.571 1.00 0.00 C ATOM 1544 O MET B 7 -2.801 4.697 -6.744 1.00 0.00 O ATOM 1545 CB MET B 7 0.541 5.102 -7.162 1.00 0.00 C ATOM 1546 CG MET B 7 1.086 5.313 -5.758 1.00 0.00 C ATOM 1547 SD MET B 7 2.286 6.656 -5.673 1.00 0.00 S ATOM 1548 CE MET B 7 3.704 5.801 -4.990 1.00 0.00 C ATOM 0 H MET B 7 0.671 3.191 -8.718 1.00 0.00 H new ATOM 0 HA MET B 7 -0.635 3.542 -6.271 1.00 0.00 H new ATOM 0 HB2 MET B 7 1.361 4.820 -7.823 1.00 0.00 H new ATOM 0 HB3 MET B 7 0.142 6.046 -7.534 1.00 0.00 H new ATOM 0 HG2 MET B 7 0.260 5.526 -5.080 1.00 0.00 H new ATOM 0 HG3 MET B 7 1.553 4.391 -5.411 1.00 0.00 H new ATOM 0 HE1 MET B 7 4.614 6.343 -5.246 1.00 0.00 H new ATOM 0 HE2 MET B 7 3.608 5.746 -3.906 1.00 0.00 H new ATOM 0 HE3 MET B 7 3.754 4.793 -5.402 1.00 0.00 H new ATOM 1558 N VAL B 8 -2.001 5.217 -8.786 1.00 0.00 N ATOM 1559 CA VAL B 8 -3.225 5.876 -9.235 1.00 0.00 C ATOM 1560 C VAL B 8 -4.334 4.874 -9.532 1.00 0.00 C ATOM 1561 O VAL B 8 -5.514 5.196 -9.403 1.00 0.00 O ATOM 1562 CB VAL B 8 -2.975 6.728 -10.494 1.00 0.00 C ATOM 1563 CG1 VAL B 8 -4.205 7.556 -10.836 1.00 0.00 C ATOM 1564 CG2 VAL B 8 -1.756 7.622 -10.306 1.00 0.00 C ATOM 0 H VAL B 8 -1.252 5.207 -9.479 1.00 0.00 H new ATOM 0 HA VAL B 8 -3.542 6.522 -8.416 1.00 0.00 H new ATOM 0 HB VAL B 8 -2.777 6.055 -11.328 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -4.007 8.150 -11.728 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -5.050 6.893 -11.022 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -4.440 8.219 -10.003 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.597 8.215 -11.207 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.920 8.287 -9.458 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.877 7.005 -10.119 1.00 0.00 H new ATOM 1574 N ALA B 9 -3.962 3.660 -9.921 1.00 0.00 N ATOM 1575 CA ALA B 9 -4.952 2.633 -10.217 1.00 0.00 C ATOM 1576 C ALA B 9 -5.882 2.455 -9.026 1.00 0.00 C ATOM 1577 O ALA B 9 -7.106 2.368 -9.171 1.00 0.00 O ATOM 1578 CB ALA B 9 -4.268 1.319 -10.568 1.00 0.00 C ATOM 0 H ALA B 9 -2.993 3.365 -10.038 1.00 0.00 H new ATOM 0 HA ALA B 9 -5.542 2.947 -11.078 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -5.022 0.563 -10.786 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.633 1.461 -11.443 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.658 0.990 -9.727 1.00 0.00 H new ATOM 1584 N LEU B 10 -5.288 2.442 -7.841 1.00 0.00 N ATOM 1585 CA LEU B 10 -6.055 2.311 -6.613 1.00 0.00 C ATOM 1586 C LEU B 10 -6.922 3.541 -6.435 1.00 0.00 C ATOM 1587 O LEU B 10 -8.148 3.460 -6.385 1.00 0.00 O ATOM 1588 CB LEU B 10 -5.120 2.154 -5.413 1.00 0.00 C ATOM 1589 CG LEU B 10 -4.233 0.909 -5.439 1.00 0.00 C ATOM 1590 CD1 LEU B 10 -2.838 1.237 -4.931 1.00 0.00 C ATOM 1591 CD2 LEU B 10 -4.858 -0.204 -4.610 1.00 0.00 C ATOM 0 H LEU B 10 -4.280 2.520 -7.705 1.00 0.00 H new ATOM 0 HA LEU B 10 -6.685 1.423 -6.677 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -4.481 3.035 -5.353 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -5.721 2.134 -4.504 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.149 0.565 -6.470 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.221 0.339 -4.957 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -2.391 2.003 -5.565 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.901 1.605 -3.907 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.215 -1.084 -4.638 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.971 0.130 -3.579 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.836 -0.457 -5.019 1.00 0.00 H new ATOM 1603 N ILE B 11 -6.259 4.688 -6.361 1.00 0.00 N ATOM 1604 CA ILE B 11 -6.940 5.968 -6.206 1.00 0.00 C ATOM 1605 C ILE B 11 -8.085 6.092 -7.203 1.00 0.00 C ATOM 1606 O ILE B 11 -9.138 6.640 -6.890 1.00 0.00 O ATOM 1607 CB ILE B 11 -5.985 7.170 -6.401 1.00 0.00 C ATOM 1608 CG1 ILE B 11 -4.521 6.746 -6.270 1.00 0.00 C ATOM 1609 CG2 ILE B 11 -6.305 8.251 -5.393 1.00 0.00 C ATOM 1610 CD1 ILE B 11 -3.537 7.885 -6.426 1.00 0.00 C ATOM 0 H ILE B 11 -5.242 4.758 -6.406 1.00 0.00 H new ATOM 0 HA ILE B 11 -7.323 5.991 -5.186 1.00 0.00 H new ATOM 0 HB ILE B 11 -6.132 7.559 -7.409 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.373 6.282 -5.295 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.304 5.986 -7.021 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.629 9.094 -5.536 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -7.334 8.584 -5.531 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.183 7.856 -4.385 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.521 7.505 -6.320 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.655 8.336 -7.411 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -3.725 8.636 -5.659 1.00 0.00 H new ATOM 1622 N ASP B 12 -7.872 5.571 -8.406 1.00 0.00 N ATOM 1623 CA ASP B 12 -8.891 5.618 -9.445 1.00 0.00 C ATOM 1624 C ASP B 12 -10.191 5.006 -8.938 1.00 0.00 C ATOM 1625 O ASP B 12 -11.276 5.536 -9.175 1.00 0.00 O ATOM 1626 CB ASP B 12 -8.409 4.877 -10.695 1.00 0.00 C ATOM 1627 CG ASP B 12 -8.129 5.816 -11.852 1.00 0.00 C ATOM 1628 OD1 ASP B 12 -9.100 6.283 -12.484 1.00 0.00 O ATOM 1629 OD2 ASP B 12 -6.941 6.084 -12.124 1.00 0.00 O ATOM 0 H ASP B 12 -7.005 5.112 -8.684 1.00 0.00 H new ATOM 0 HA ASP B 12 -9.074 6.660 -9.706 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.504 4.319 -10.457 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -9.163 4.149 -10.996 1.00 0.00 H new ATOM 1634 N VAL B 13 -10.068 3.884 -8.238 1.00 0.00 N ATOM 1635 CA VAL B 13 -11.231 3.190 -7.691 1.00 0.00 C ATOM 1636 C VAL B 13 -11.965 4.042 -6.647 1.00 0.00 C ATOM 1637 O VAL B 13 -13.189 4.156 -6.683 1.00 0.00 O ATOM 1638 CB VAL B 13 -10.832 1.846 -7.053 1.00 0.00 C ATOM 1639 CG1 VAL B 13 -12.063 0.992 -6.790 1.00 0.00 C ATOM 1640 CG2 VAL B 13 -9.841 1.106 -7.941 1.00 0.00 C ATOM 0 H VAL B 13 -9.175 3.434 -8.035 1.00 0.00 H new ATOM 0 HA VAL B 13 -11.903 3.006 -8.529 1.00 0.00 H new ATOM 0 HB VAL B 13 -10.348 2.049 -6.097 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -11.761 0.047 -6.339 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -12.734 1.519 -6.112 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -12.578 0.797 -7.731 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.571 0.159 -7.474 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.296 0.915 -8.913 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.946 1.714 -8.073 1.00 0.00 H new ATOM 1650 N PHE B 14 -11.212 4.632 -5.719 1.00 0.00 N ATOM 1651 CA PHE B 14 -11.798 5.466 -4.666 1.00 0.00 C ATOM 1652 C PHE B 14 -12.190 6.842 -5.206 1.00 0.00 C ATOM 1653 O PHE B 14 -13.066 7.509 -4.654 1.00 0.00 O ATOM 1654 CB PHE B 14 -10.821 5.576 -3.472 1.00 0.00 C ATOM 1655 CG PHE B 14 -10.415 6.977 -3.089 1.00 0.00 C ATOM 1656 CD1 PHE B 14 -9.862 7.837 -4.023 1.00 0.00 C ATOM 1657 CD2 PHE B 14 -10.592 7.432 -1.790 1.00 0.00 C ATOM 1658 CE1 PHE B 14 -9.495 9.120 -3.675 1.00 0.00 C ATOM 1659 CE2 PHE B 14 -10.229 8.714 -1.440 1.00 0.00 C ATOM 1660 CZ PHE B 14 -9.680 9.560 -2.381 1.00 0.00 C ATOM 0 H PHE B 14 -10.196 4.549 -5.674 1.00 0.00 H new ATOM 0 HA PHE B 14 -12.713 4.992 -4.312 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -11.280 5.100 -2.605 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -9.921 5.008 -3.708 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.716 7.498 -5.038 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -11.018 6.775 -1.046 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -9.064 9.779 -4.414 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.375 9.057 -0.426 1.00 0.00 H new ATOM 0 HZ PHE B 14 -9.396 10.565 -2.105 1.00 0.00 H new ATOM 1670 N HIS B 15 -11.535 7.261 -6.284 1.00 0.00 N ATOM 1671 CA HIS B 15 -11.814 8.556 -6.895 1.00 0.00 C ATOM 1672 C HIS B 15 -13.041 8.483 -7.799 1.00 0.00 C ATOM 1673 O HIS B 15 -13.637 9.506 -8.133 1.00 0.00 O ATOM 1674 CB HIS B 15 -10.603 9.039 -7.697 1.00 0.00 C ATOM 1675 CG HIS B 15 -10.583 10.519 -7.920 1.00 0.00 C ATOM 1676 ND1 HIS B 15 -11.039 11.112 -9.078 1.00 0.00 N ATOM 1677 CD2 HIS B 15 -10.158 11.530 -7.124 1.00 0.00 C ATOM 1678 CE1 HIS B 15 -10.895 12.423 -8.987 1.00 0.00 C ATOM 1679 NE2 HIS B 15 -10.363 12.702 -7.812 1.00 0.00 N ATOM 0 H HIS B 15 -10.807 6.722 -6.753 1.00 0.00 H new ATOM 0 HA HIS B 15 -12.018 9.267 -6.095 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.692 8.746 -7.175 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.593 8.534 -8.663 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -9.737 11.433 -6.134 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -11.166 13.143 -9.745 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -10.140 13.637 -7.470 1.00 0.00 H new ATOM 1688 N GLN B 16 -13.418 7.268 -8.188 1.00 0.00 N ATOM 1689 CA GLN B 16 -14.575 7.072 -9.047 1.00 0.00 C ATOM 1690 C GLN B 16 -15.850 7.044 -8.214 1.00 0.00 C ATOM 1691 O GLN B 16 -16.855 7.658 -8.576 1.00 0.00 O ATOM 1692 CB GLN B 16 -14.435 5.772 -9.842 1.00 0.00 C ATOM 1693 CG GLN B 16 -14.521 5.967 -11.347 1.00 0.00 C ATOM 1694 CD GLN B 16 -13.395 6.826 -11.890 1.00 0.00 C ATOM 1695 OE1 GLN B 16 -13.226 7.976 -11.484 1.00 0.00 O ATOM 1696 NE2 GLN B 16 -12.619 6.270 -12.813 1.00 0.00 N ATOM 0 H GLN B 16 -12.938 6.408 -7.921 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.632 7.904 -9.749 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -13.479 5.308 -9.598 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -15.215 5.078 -9.529 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -14.499 4.994 -11.837 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.477 6.428 -11.596 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -12.796 5.313 -13.120 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -11.846 6.799 -13.215 1.00 0.00 H new ATOM 1705 N TYR B 17 -15.801 6.330 -7.094 1.00 0.00 N ATOM 1706 CA TYR B 17 -16.954 6.229 -6.210 1.00 0.00 C ATOM 1707 C TYR B 17 -17.033 7.426 -5.269 1.00 0.00 C ATOM 1708 O TYR B 17 -18.026 8.151 -5.257 1.00 0.00 O ATOM 1709 CB TYR B 17 -16.905 4.928 -5.412 1.00 0.00 C ATOM 1710 CG TYR B 17 -17.776 3.837 -5.995 1.00 0.00 C ATOM 1711 CD1 TYR B 17 -17.370 3.123 -7.115 1.00 0.00 C ATOM 1712 CD2 TYR B 17 -19.005 3.524 -5.427 1.00 0.00 C ATOM 1713 CE1 TYR B 17 -18.163 2.125 -7.653 1.00 0.00 C ATOM 1714 CE2 TYR B 17 -19.803 2.529 -5.958 1.00 0.00 C ATOM 1715 CZ TYR B 17 -19.378 1.833 -7.070 1.00 0.00 C ATOM 1716 OH TYR B 17 -20.170 0.842 -7.601 1.00 0.00 O ATOM 0 H TYR B 17 -14.979 5.815 -6.779 1.00 0.00 H new ATOM 0 HA TYR B 17 -17.851 6.226 -6.829 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -15.874 4.576 -5.367 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -17.219 5.126 -4.387 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -16.419 3.351 -7.574 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -19.342 4.067 -4.556 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -17.833 1.578 -8.524 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -20.755 2.297 -5.504 1.00 0.00 H new ATOM 0 HH TYR B 17 -19.604 0.161 -8.022 1.00 0.00 H new ATOM 1726 N SER B 18 -15.983 7.626 -4.480 1.00 0.00 N ATOM 1727 CA SER B 18 -15.942 8.736 -3.535 1.00 0.00 C ATOM 1728 C SER B 18 -16.104 10.071 -4.256 1.00 0.00 C ATOM 1729 O SER B 18 -15.246 10.471 -5.043 1.00 0.00 O ATOM 1730 CB SER B 18 -14.628 8.723 -2.754 1.00 0.00 C ATOM 1731 OG SER B 18 -14.815 9.197 -1.430 1.00 0.00 O ATOM 0 H SER B 18 -15.151 7.036 -4.476 1.00 0.00 H new ATOM 0 HA SER B 18 -16.771 8.616 -2.838 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.227 7.710 -2.727 1.00 0.00 H new ATOM 0 HB3 SER B 18 -13.892 9.343 -3.265 1.00 0.00 H new ATOM 0 HG SER B 18 -15.537 8.692 -1.001 1.00 0.00 H new ATOM 1737 N GLY B 19 -17.210 10.755 -3.981 1.00 0.00 N ATOM 1738 CA GLY B 19 -17.464 12.038 -4.611 1.00 0.00 C ATOM 1739 C GLY B 19 -18.893 12.170 -5.101 1.00 0.00 C ATOM 1740 O GLY B 19 -19.529 13.206 -4.907 1.00 0.00 O ATOM 0 H GLY B 19 -17.934 10.444 -3.334 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -17.251 12.837 -3.900 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -16.782 12.169 -5.451 1.00 0.00 H new ATOM 1801 N LYS B 24 -16.296 12.942 -0.689 1.00 0.00 N ATOM 1802 CA LYS B 24 -15.312 12.881 -1.766 1.00 0.00 C ATOM 1803 C LYS B 24 -13.917 12.614 -1.209 1.00 0.00 C ATOM 1804 O LYS B 24 -12.956 13.306 -1.545 1.00 0.00 O ATOM 1805 CB LYS B 24 -15.317 14.181 -2.575 1.00 0.00 C ATOM 1806 CG LYS B 24 -14.597 14.072 -3.909 1.00 0.00 C ATOM 1807 CD LYS B 24 -14.791 15.322 -4.751 1.00 0.00 C ATOM 1808 CE LYS B 24 -13.916 16.466 -4.263 1.00 0.00 C ATOM 1809 NZ LYS B 24 -14.719 17.669 -3.913 1.00 0.00 N ATOM 0 HA LYS B 24 -15.585 12.058 -2.426 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -16.349 14.484 -2.753 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.850 14.969 -1.983 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -13.533 13.910 -3.737 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -14.968 13.204 -4.454 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -14.555 15.101 -5.792 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -15.838 15.624 -4.719 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -13.348 16.142 -3.391 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -13.192 16.725 -5.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -14.086 18.426 -3.585 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -15.241 17.994 -4.752 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -15.392 17.429 -3.157 1.00 0.00 H new ATOM 1823 N HIS B 25 -13.818 11.601 -0.355 1.00 0.00 N ATOM 1824 CA HIS B 25 -12.547 11.229 0.257 1.00 0.00 C ATOM 1825 C HIS B 25 -12.680 9.915 1.023 1.00 0.00 C ATOM 1826 O HIS B 25 -11.753 9.112 1.068 1.00 0.00 O ATOM 1827 CB HIS B 25 -12.062 12.334 1.198 1.00 0.00 C ATOM 1828 CG HIS B 25 -10.630 12.182 1.607 1.00 0.00 C ATOM 1829 ND1 HIS B 25 -9.924 13.170 2.261 1.00 0.00 N ATOM 1830 CD2 HIS B 25 -9.768 11.148 1.450 1.00 0.00 C ATOM 1831 CE1 HIS B 25 -8.692 12.751 2.487 1.00 0.00 C ATOM 1832 NE2 HIS B 25 -8.572 11.528 2.006 1.00 0.00 N ATOM 0 H HIS B 25 -14.607 11.020 -0.070 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.815 11.096 -0.539 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -12.192 13.300 0.709 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -12.688 12.342 2.090 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -9.982 10.202 0.976 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -7.914 13.314 2.982 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -7.727 10.957 2.042 1.00 0.00 H new ATOM 1841 N LYS B 26 -13.841 9.701 1.623 1.00 0.00 N ATOM 1842 CA LYS B 26 -14.092 8.487 2.385 1.00 0.00 C ATOM 1843 C LYS B 26 -15.121 7.619 1.675 1.00 0.00 C ATOM 1844 O LYS B 26 -15.839 8.086 0.790 1.00 0.00 O ATOM 1845 CB LYS B 26 -14.594 8.837 3.786 1.00 0.00 C ATOM 1846 CG LYS B 26 -13.566 8.617 4.886 1.00 0.00 C ATOM 1847 CD LYS B 26 -12.986 9.934 5.381 1.00 0.00 C ATOM 1848 CE LYS B 26 -12.451 10.778 4.233 1.00 0.00 C ATOM 1849 NZ LYS B 26 -11.139 11.403 4.562 1.00 0.00 N ATOM 0 H LYS B 26 -14.625 10.353 1.597 1.00 0.00 H new ATOM 0 HA LYS B 26 -13.157 7.933 2.468 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -14.906 9.881 3.798 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -15.478 8.238 4.004 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -14.030 8.087 5.718 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -12.762 7.982 4.512 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.754 10.492 5.916 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.184 9.735 6.091 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -12.343 10.155 3.345 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -13.173 11.558 3.990 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.032 12.288 4.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -11.098 11.608 5.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -10.370 10.750 4.309 1.00 0.00 H new ATOM 1863 N LEU B 27 -15.188 6.356 2.069 1.00 0.00 N ATOM 1864 CA LEU B 27 -16.130 5.421 1.472 1.00 0.00 C ATOM 1865 C LEU B 27 -16.875 4.657 2.563 1.00 0.00 C ATOM 1866 O LEU B 27 -16.289 4.274 3.573 1.00 0.00 O ATOM 1867 CB LEU B 27 -15.406 4.438 0.543 1.00 0.00 C ATOM 1868 CG LEU B 27 -14.796 5.032 -0.742 1.00 0.00 C ATOM 1869 CD1 LEU B 27 -15.718 6.073 -1.361 1.00 0.00 C ATOM 1870 CD2 LEU B 27 -13.415 5.627 -0.473 1.00 0.00 C ATOM 0 H LEU B 27 -14.601 5.955 2.800 1.00 0.00 H new ATOM 0 HA LEU B 27 -16.848 5.989 0.881 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -14.608 3.957 1.109 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -16.110 3.656 0.257 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.681 4.217 -1.456 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.260 6.473 -2.265 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -16.673 5.610 -1.612 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -15.883 6.882 -0.649 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.010 6.038 -1.397 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -13.499 6.419 0.271 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.750 4.848 -0.100 1.00 0.00 H new ATOM 1882 N LYS B 28 -18.168 4.450 2.360 1.00 0.00 N ATOM 1883 CA LYS B 28 -18.989 3.745 3.340 1.00 0.00 C ATOM 1884 C LYS B 28 -19.288 2.316 2.898 1.00 0.00 C ATOM 1885 O LYS B 28 -18.818 1.866 1.854 1.00 0.00 O ATOM 1886 CB LYS B 28 -20.299 4.502 3.576 1.00 0.00 C ATOM 1887 CG LYS B 28 -20.671 4.634 5.044 1.00 0.00 C ATOM 1888 CD LYS B 28 -21.715 5.717 5.260 1.00 0.00 C ATOM 1889 CE LYS B 28 -23.051 5.332 4.646 1.00 0.00 C ATOM 1890 NZ LYS B 28 -23.188 5.835 3.251 1.00 0.00 N ATOM 0 H LYS B 28 -18.672 4.758 1.529 1.00 0.00 H new ATOM 0 HA LYS B 28 -18.424 3.698 4.271 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -20.217 5.498 3.140 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -21.105 3.989 3.051 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -21.053 3.681 5.411 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -19.779 4.866 5.627 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -21.842 5.894 6.328 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -21.367 6.652 4.821 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -23.154 4.247 4.652 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -23.860 5.732 5.257 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -23.988 6.498 3.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -22.314 6.324 2.971 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -23.358 5.035 2.609 1.00 0.00 H new ATOM 1904 N LYS B 29 -20.076 1.611 3.704 1.00 0.00 N ATOM 1905 CA LYS B 29 -20.446 0.231 3.408 1.00 0.00 C ATOM 1906 C LYS B 29 -21.028 0.111 2.002 1.00 0.00 C ATOM 1907 O LYS B 29 -20.954 -0.947 1.377 1.00 0.00 O ATOM 1908 CB LYS B 29 -21.458 -0.278 4.436 1.00 0.00 C ATOM 1909 CG LYS B 29 -20.892 -0.394 5.842 1.00 0.00 C ATOM 1910 CD LYS B 29 -21.903 0.043 6.890 1.00 0.00 C ATOM 1911 CE LYS B 29 -21.239 0.818 8.018 1.00 0.00 C ATOM 1912 NZ LYS B 29 -20.595 -0.085 9.011 1.00 0.00 N ATOM 0 H LYS B 29 -20.472 1.975 4.571 1.00 0.00 H new ATOM 0 HA LYS B 29 -19.545 -0.379 3.461 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -22.316 0.395 4.453 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -21.825 -1.254 4.119 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -20.594 -1.425 6.031 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -19.994 0.218 5.925 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -22.668 0.663 6.423 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -22.408 -0.833 7.297 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -20.491 1.493 7.603 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -21.983 1.437 8.520 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -20.155 0.483 9.763 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -21.313 -0.712 9.427 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.867 -0.658 8.538 1.00 0.00 H new ATOM 1926 N SER B 30 -21.603 1.201 1.509 1.00 0.00 N ATOM 1927 CA SER B 30 -22.189 1.214 0.176 1.00 0.00 C ATOM 1928 C SER B 30 -21.119 1.465 -0.879 1.00 0.00 C ATOM 1929 O SER B 30 -21.093 0.809 -1.920 1.00 0.00 O ATOM 1930 CB SER B 30 -23.276 2.286 0.085 1.00 0.00 C ATOM 1931 OG SER B 30 -24.007 2.378 1.296 1.00 0.00 O ATOM 0 H SER B 30 -21.676 2.086 2.012 1.00 0.00 H new ATOM 0 HA SER B 30 -22.638 0.238 -0.010 1.00 0.00 H new ATOM 0 HB2 SER B 30 -22.822 3.250 -0.143 1.00 0.00 H new ATOM 0 HB3 SER B 30 -23.954 2.051 -0.735 1.00 0.00 H new ATOM 0 HG SER B 30 -24.694 3.072 1.211 1.00 0.00 H new ATOM 1937 N GLU B 31 -20.237 2.421 -0.603 1.00 0.00 N ATOM 1938 CA GLU B 31 -19.166 2.763 -1.531 1.00 0.00 C ATOM 1939 C GLU B 31 -17.990 1.799 -1.404 1.00 0.00 C ATOM 1940 O GLU B 31 -17.672 1.077 -2.346 1.00 0.00 O ATOM 1941 CB GLU B 31 -18.693 4.199 -1.292 1.00 0.00 C ATOM 1942 CG GLU B 31 -19.806 5.231 -1.394 1.00 0.00 C ATOM 1943 CD GLU B 31 -20.158 5.844 -0.053 1.00 0.00 C ATOM 1944 OE1 GLU B 31 -19.229 6.153 0.722 1.00 0.00 O ATOM 1945 OE2 GLU B 31 -21.365 6.017 0.221 1.00 0.00 O ATOM 0 H GLU B 31 -20.243 2.972 0.255 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.564 2.680 -2.542 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.239 4.263 -0.303 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.916 4.442 -2.016 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -19.502 6.020 -2.082 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -20.693 4.762 -1.819 1.00 0.00 H new ATOM 1952 N LEU B 32 -17.340 1.798 -0.240 1.00 0.00 N ATOM 1953 CA LEU B 32 -16.190 0.925 -0.001 1.00 0.00 C ATOM 1954 C LEU B 32 -16.445 -0.488 -0.518 1.00 0.00 C ATOM 1955 O LEU B 32 -15.689 -1.002 -1.342 1.00 0.00 O ATOM 1956 CB LEU B 32 -15.852 0.886 1.493 1.00 0.00 C ATOM 1957 CG LEU B 32 -14.595 0.089 1.862 1.00 0.00 C ATOM 1958 CD1 LEU B 32 -14.871 -1.407 1.808 1.00 0.00 C ATOM 1959 CD2 LEU B 32 -13.439 0.455 0.942 1.00 0.00 C ATOM 0 H LEU B 32 -17.590 2.391 0.551 1.00 0.00 H new ATOM 0 HA LEU B 32 -15.342 1.336 -0.549 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -15.730 1.909 1.847 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -16.701 0.462 2.029 1.00 0.00 H new ATOM 0 HG LEU B 32 -14.315 0.347 2.883 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -13.966 -1.954 2.073 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -15.665 -1.656 2.512 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -15.180 -1.684 0.800 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -12.556 -0.121 1.220 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -13.709 0.229 -0.090 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -13.222 1.519 1.036 1.00 0.00 H new ATOM 1971 N LYS B 33 -17.514 -1.110 -0.033 1.00 0.00 N ATOM 1972 CA LYS B 33 -17.864 -2.461 -0.454 1.00 0.00 C ATOM 1973 C LYS B 33 -18.095 -2.518 -1.956 1.00 0.00 C ATOM 1974 O LYS B 33 -17.613 -3.424 -2.635 1.00 0.00 O ATOM 1975 CB LYS B 33 -19.120 -2.931 0.268 1.00 0.00 C ATOM 1976 CG LYS B 33 -19.030 -2.827 1.777 1.00 0.00 C ATOM 1977 CD LYS B 33 -20.213 -3.511 2.432 1.00 0.00 C ATOM 1978 CE LYS B 33 -20.232 -3.283 3.934 1.00 0.00 C ATOM 1979 NZ LYS B 33 -21.575 -3.551 4.519 1.00 0.00 N ATOM 0 H LYS B 33 -18.152 -0.701 0.650 1.00 0.00 H new ATOM 0 HA LYS B 33 -17.032 -3.117 -0.200 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -19.969 -2.342 -0.078 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -19.319 -3.967 -0.005 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -18.102 -3.283 2.123 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -19.000 -1.778 2.073 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -21.138 -3.136 1.995 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -20.175 -4.581 2.227 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.494 -3.929 4.409 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -19.941 -2.255 4.149 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -21.831 -2.780 5.169 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -22.280 -3.610 3.757 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -21.553 -4.451 5.040 1.00 0.00 H new ATOM 1993 N GLU B 34 -18.846 -1.547 -2.467 1.00 0.00 N ATOM 1994 CA GLU B 34 -19.154 -1.485 -3.894 1.00 0.00 C ATOM 1995 C GLU B 34 -17.918 -1.789 -4.741 1.00 0.00 C ATOM 1996 O GLU B 34 -17.989 -2.576 -5.684 1.00 0.00 O ATOM 1997 CB GLU B 34 -19.719 -0.110 -4.259 1.00 0.00 C ATOM 1998 CG GLU B 34 -21.223 -0.114 -4.483 1.00 0.00 C ATOM 1999 CD GLU B 34 -21.611 -0.667 -5.840 1.00 0.00 C ATOM 2000 OE1 GLU B 34 -20.945 -1.614 -6.307 1.00 0.00 O ATOM 2001 OE2 GLU B 34 -22.581 -0.152 -6.436 1.00 0.00 O ATOM 0 H GLU B 34 -19.253 -0.792 -1.915 1.00 0.00 H new ATOM 0 HA GLU B 34 -19.906 -2.245 -4.107 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.480 0.596 -3.463 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.226 0.249 -5.162 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.701 -0.707 -3.703 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -21.603 0.903 -4.388 1.00 0.00 H new ATOM 2008 N LEU B 35 -16.785 -1.180 -4.395 1.00 0.00 N ATOM 2009 CA LEU B 35 -15.548 -1.418 -5.133 1.00 0.00 C ATOM 2010 C LEU B 35 -15.095 -2.846 -4.949 1.00 0.00 C ATOM 2011 O LEU B 35 -14.617 -3.490 -5.883 1.00 0.00 O ATOM 2012 CB LEU B 35 -14.444 -0.459 -4.691 1.00 0.00 C ATOM 2013 CG LEU B 35 -14.699 1.002 -5.038 1.00 0.00 C ATOM 2014 CD1 LEU B 35 -15.327 1.111 -6.419 1.00 0.00 C ATOM 2015 CD2 LEU B 35 -15.591 1.632 -3.982 1.00 0.00 C ATOM 0 H LEU B 35 -16.699 -0.526 -3.617 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.750 -1.239 -6.189 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.315 -0.546 -3.612 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.505 -0.770 -5.150 1.00 0.00 H new ATOM 0 HG LEU B 35 -13.751 1.540 -5.055 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -15.505 2.160 -6.656 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.653 0.681 -7.160 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -16.274 0.571 -6.432 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -15.771 2.677 -4.234 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -16.541 1.099 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -15.102 1.572 -3.010 1.00 0.00 H new ATOM 2027 N ILE B 36 -15.269 -3.341 -3.740 1.00 0.00 N ATOM 2028 CA ILE B 36 -14.899 -4.712 -3.428 1.00 0.00 C ATOM 2029 C ILE B 36 -15.594 -5.649 -4.410 1.00 0.00 C ATOM 2030 O ILE B 36 -14.947 -6.404 -5.134 1.00 0.00 O ATOM 2031 CB ILE B 36 -15.242 -5.091 -1.960 1.00 0.00 C ATOM 2032 CG1 ILE B 36 -13.967 -5.047 -1.108 1.00 0.00 C ATOM 2033 CG2 ILE B 36 -15.907 -6.463 -1.877 1.00 0.00 C ATOM 2034 CD1 ILE B 36 -14.135 -5.612 0.284 1.00 0.00 C ATOM 0 H ILE B 36 -15.663 -2.818 -2.958 1.00 0.00 H new ATOM 0 HA ILE B 36 -13.818 -4.810 -3.528 1.00 0.00 H new ATOM 0 HB ILE B 36 -15.957 -4.365 -1.572 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -13.181 -5.601 -1.621 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -13.630 -4.013 -1.031 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -16.133 -6.696 -0.836 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -16.831 -6.455 -2.456 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -15.233 -7.219 -2.280 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -13.189 -5.544 0.821 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -14.897 -5.044 0.818 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -14.441 -6.656 0.218 1.00 0.00 H new ATOM 2046 N ASN B 37 -16.916 -5.562 -4.461 1.00 0.00 N ATOM 2047 CA ASN B 37 -17.681 -6.375 -5.392 1.00 0.00 C ATOM 2048 C ASN B 37 -17.434 -5.893 -6.819 1.00 0.00 C ATOM 2049 O ASN B 37 -17.603 -6.646 -7.777 1.00 0.00 O ATOM 2050 CB ASN B 37 -19.179 -6.335 -5.065 1.00 0.00 C ATOM 2051 CG ASN B 37 -19.657 -4.959 -4.644 1.00 0.00 C ATOM 2052 OD1 ASN B 37 -19.939 -4.102 -5.482 1.00 0.00 O ATOM 2053 ND2 ASN B 37 -19.750 -4.740 -3.337 1.00 0.00 N ATOM 0 H ASN B 37 -17.475 -4.943 -3.874 1.00 0.00 H new ATOM 0 HA ASN B 37 -17.350 -7.409 -5.299 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -19.745 -6.658 -5.939 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -19.390 -7.047 -4.267 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -20.065 -3.833 -2.993 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -19.506 -5.479 -2.677 1.00 0.00 H new ATOM 2060 N ASN B 38 -17.012 -4.632 -6.950 1.00 0.00 N ATOM 2061 CA ASN B 38 -16.717 -4.062 -8.258 1.00 0.00 C ATOM 2062 C ASN B 38 -15.496 -4.746 -8.855 1.00 0.00 C ATOM 2063 O ASN B 38 -15.494 -5.119 -10.028 1.00 0.00 O ATOM 2064 CB ASN B 38 -16.473 -2.549 -8.164 1.00 0.00 C ATOM 2065 CG ASN B 38 -16.331 -1.905 -9.529 1.00 0.00 C ATOM 2066 OD1 ASN B 38 -16.227 -2.593 -10.545 1.00 0.00 O ATOM 2067 ND2 ASN B 38 -16.324 -0.577 -9.560 1.00 0.00 N ATOM 0 H ASN B 38 -16.869 -3.993 -6.168 1.00 0.00 H new ATOM 0 HA ASN B 38 -17.580 -4.227 -8.903 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -17.300 -2.082 -7.628 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.571 -2.364 -7.581 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -16.230 -0.088 -10.450 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -16.413 -0.046 -8.694 1.00 0.00 H new ATOM 2074 N GLU B 39 -14.452 -4.911 -8.039 1.00 0.00 N ATOM 2075 CA GLU B 39 -13.229 -5.553 -8.501 1.00 0.00 C ATOM 2076 C GLU B 39 -12.208 -5.730 -7.372 1.00 0.00 C ATOM 2077 O GLU B 39 -11.104 -5.187 -7.434 1.00 0.00 O ATOM 2078 CB GLU B 39 -12.618 -4.734 -9.636 1.00 0.00 C ATOM 2079 CG GLU B 39 -12.062 -3.389 -9.194 1.00 0.00 C ATOM 2080 CD GLU B 39 -12.315 -2.292 -10.211 1.00 0.00 C ATOM 2081 OE1 GLU B 39 -12.029 -2.515 -11.407 1.00 0.00 O ATOM 2082 OE2 GLU B 39 -12.797 -1.212 -9.811 1.00 0.00 O ATOM 0 H GLU B 39 -14.433 -4.610 -7.064 1.00 0.00 H new ATOM 0 HA GLU B 39 -13.491 -6.548 -8.860 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.819 -5.312 -10.099 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -13.376 -4.569 -10.401 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -12.513 -3.108 -8.242 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -10.989 -3.481 -9.024 1.00 0.00 H new ATOM 2089 N LEU B 40 -12.569 -6.497 -6.345 1.00 0.00 N ATOM 2090 CA LEU B 40 -11.659 -6.734 -5.227 1.00 0.00 C ATOM 2091 C LEU B 40 -10.616 -7.802 -5.568 1.00 0.00 C ATOM 2092 O LEU B 40 -9.612 -7.938 -4.870 1.00 0.00 O ATOM 2093 CB LEU B 40 -12.427 -7.133 -3.963 1.00 0.00 C ATOM 2094 CG LEU B 40 -12.830 -8.605 -3.868 1.00 0.00 C ATOM 2095 CD1 LEU B 40 -13.665 -8.845 -2.621 1.00 0.00 C ATOM 2096 CD2 LEU B 40 -13.588 -9.030 -5.112 1.00 0.00 C ATOM 0 H LEU B 40 -13.474 -6.960 -6.264 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.137 -5.797 -5.035 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.815 -6.886 -3.095 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -13.329 -6.524 -3.901 1.00 0.00 H new ATOM 0 HG LEU B 40 -11.926 -9.209 -3.797 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.944 -9.897 -2.567 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.085 -8.578 -1.738 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -14.566 -8.232 -2.663 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -13.867 -10.080 -5.027 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -14.487 -8.423 -5.215 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -12.955 -8.892 -5.989 1.00 0.00 H new ATOM 2225 N LYS B 48 -15.425 -12.479 2.507 1.00 0.00 N ATOM 2226 CA LYS B 48 -15.883 -13.868 2.533 1.00 0.00 C ATOM 2227 C LYS B 48 -17.395 -13.949 2.733 1.00 0.00 C ATOM 2228 O LYS B 48 -18.025 -14.944 2.375 1.00 0.00 O ATOM 2229 CB LYS B 48 -15.172 -14.642 3.648 1.00 0.00 C ATOM 2230 CG LYS B 48 -13.687 -14.329 3.763 1.00 0.00 C ATOM 2231 CD LYS B 48 -13.367 -13.603 5.062 1.00 0.00 C ATOM 2232 CE LYS B 48 -12.144 -12.712 4.915 1.00 0.00 C ATOM 2233 NZ LYS B 48 -10.910 -13.504 4.654 1.00 0.00 N ATOM 0 HA LYS B 48 -15.639 -14.316 1.570 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -15.656 -14.418 4.599 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -15.296 -15.710 3.472 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -13.114 -15.255 3.712 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -13.377 -13.716 2.917 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -14.224 -13.000 5.364 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -13.195 -14.331 5.854 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.303 -12.008 4.098 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.012 -12.123 5.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -10.090 -12.865 4.610 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -10.771 -14.193 5.420 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -11.005 -14.007 3.749 1.00 0.00 H new ATOM 2247 N GLU B 49 -17.969 -12.897 3.308 1.00 0.00 N ATOM 2248 CA GLU B 49 -19.403 -12.846 3.559 1.00 0.00 C ATOM 2249 C GLU B 49 -19.859 -11.406 3.764 1.00 0.00 C ATOM 2250 O GLU B 49 -19.074 -10.472 3.616 1.00 0.00 O ATOM 2251 CB GLU B 49 -19.751 -13.680 4.794 1.00 0.00 C ATOM 2252 CG GLU B 49 -21.077 -14.414 4.682 1.00 0.00 C ATOM 2253 CD GLU B 49 -21.884 -14.358 5.964 1.00 0.00 C ATOM 2254 OE1 GLU B 49 -21.592 -15.149 6.885 1.00 0.00 O ATOM 2255 OE2 GLU B 49 -22.809 -13.522 6.048 1.00 0.00 O ATOM 0 H GLU B 49 -17.460 -12.066 3.609 1.00 0.00 H new ATOM 0 HA GLU B 49 -19.919 -13.257 2.692 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -18.957 -14.407 4.966 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -19.780 -13.027 5.666 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -21.661 -13.980 3.870 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -20.891 -15.455 4.419 1.00 0.00 H new ATOM 2262 N GLN B 50 -21.127 -11.230 4.111 1.00 0.00 N ATOM 2263 CA GLN B 50 -21.674 -9.900 4.342 1.00 0.00 C ATOM 2264 C GLN B 50 -21.226 -9.366 5.699 1.00 0.00 C ATOM 2265 O GLN B 50 -20.826 -8.207 5.827 1.00 0.00 O ATOM 2266 CB GLN B 50 -23.201 -9.933 4.273 1.00 0.00 C ATOM 2267 CG GLN B 50 -23.749 -9.754 2.868 1.00 0.00 C ATOM 2268 CD GLN B 50 -25.237 -10.033 2.783 1.00 0.00 C ATOM 2269 OE1 GLN B 50 -25.756 -10.909 3.475 1.00 0.00 O ATOM 2270 NE2 GLN B 50 -25.931 -9.288 1.931 1.00 0.00 N ATOM 0 H GLN B 50 -21.795 -11.990 4.239 1.00 0.00 H new ATOM 0 HA GLN B 50 -21.300 -9.236 3.563 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -23.554 -10.883 4.674 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -23.603 -9.148 4.914 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -23.554 -8.735 2.533 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -23.219 -10.420 2.187 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -25.459 -8.573 1.377 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -26.936 -9.431 1.830 1.00 0.00 H new ATOM 2279 N GLU B 51 -21.296 -10.225 6.709 1.00 0.00 N ATOM 2280 CA GLU B 51 -20.901 -9.851 8.060 1.00 0.00 C ATOM 2281 C GLU B 51 -19.433 -9.448 8.117 1.00 0.00 C ATOM 2282 O GLU B 51 -19.076 -8.471 8.774 1.00 0.00 O ATOM 2283 CB GLU B 51 -21.160 -11.004 9.034 1.00 0.00 C ATOM 2284 CG GLU B 51 -20.736 -12.364 8.499 1.00 0.00 C ATOM 2285 CD GLU B 51 -19.712 -13.047 9.384 1.00 0.00 C ATOM 2286 OE1 GLU B 51 -18.767 -12.366 9.834 1.00 0.00 O ATOM 2287 OE2 GLU B 51 -19.853 -14.265 9.625 1.00 0.00 O ATOM 0 H GLU B 51 -21.623 -11.187 6.617 1.00 0.00 H new ATOM 0 HA GLU B 51 -21.504 -8.992 8.353 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -20.628 -10.808 9.965 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -22.223 -11.033 9.274 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -21.614 -13.003 8.406 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -20.322 -12.243 7.498 1.00 0.00 H new ATOM 2294 N VAL B 52 -18.581 -10.204 7.430 1.00 0.00 N ATOM 2295 CA VAL B 52 -17.155 -9.907 7.424 1.00 0.00 C ATOM 2296 C VAL B 52 -16.887 -8.525 6.836 1.00 0.00 C ATOM 2297 O VAL B 52 -16.091 -7.761 7.375 1.00 0.00 O ATOM 2298 CB VAL B 52 -16.334 -10.970 6.655 1.00 0.00 C ATOM 2299 CG1 VAL B 52 -16.860 -12.368 6.941 1.00 0.00 C ATOM 2300 CG2 VAL B 52 -16.333 -10.694 5.157 1.00 0.00 C ATOM 0 H VAL B 52 -18.851 -11.017 6.877 1.00 0.00 H new ATOM 0 HA VAL B 52 -16.832 -9.925 8.465 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.304 -10.910 7.006 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -16.268 -13.099 6.390 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -16.787 -12.573 8.009 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -17.902 -12.436 6.629 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -15.748 -11.459 4.647 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -17.357 -10.711 4.783 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -15.894 -9.715 4.968 1.00 0.00 H new ATOM 2310 N VAL B 53 -17.551 -8.208 5.722 1.00 0.00 N ATOM 2311 CA VAL B 53 -17.365 -6.916 5.075 1.00 0.00 C ATOM 2312 C VAL B 53 -17.463 -5.774 6.080 1.00 0.00 C ATOM 2313 O VAL B 53 -16.554 -4.953 6.193 1.00 0.00 O ATOM 2314 CB VAL B 53 -18.370 -6.650 3.948 1.00 0.00 C ATOM 2315 CG1 VAL B 53 -17.858 -5.501 3.094 1.00 0.00 C ATOM 2316 CG2 VAL B 53 -18.601 -7.896 3.107 1.00 0.00 C ATOM 0 H VAL B 53 -18.216 -8.825 5.256 1.00 0.00 H new ATOM 0 HA VAL B 53 -16.366 -6.958 4.641 1.00 0.00 H new ATOM 0 HB VAL B 53 -19.332 -6.379 4.383 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -18.565 -5.303 2.289 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -17.751 -4.609 3.711 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -16.890 -5.767 2.669 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -19.318 -7.674 2.317 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -17.658 -8.215 2.662 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -18.992 -8.694 3.738 1.00 0.00 H new ATOM 2326 N ASP B 54 -18.568 -5.728 6.816 1.00 0.00 N ATOM 2327 CA ASP B 54 -18.759 -4.684 7.814 1.00 0.00 C ATOM 2328 C ASP B 54 -17.583 -4.669 8.782 1.00 0.00 C ATOM 2329 O ASP B 54 -17.185 -3.617 9.282 1.00 0.00 O ATOM 2330 CB ASP B 54 -20.067 -4.900 8.576 1.00 0.00 C ATOM 2331 CG ASP B 54 -21.287 -4.635 7.716 1.00 0.00 C ATOM 2332 OD1 ASP B 54 -21.393 -5.245 6.631 1.00 0.00 O ATOM 2333 OD2 ASP B 54 -22.136 -3.816 8.126 1.00 0.00 O ATOM 0 H ASP B 54 -19.337 -6.394 6.742 1.00 0.00 H new ATOM 0 HA ASP B 54 -18.813 -3.722 7.305 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -20.103 -5.924 8.947 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -20.090 -4.244 9.446 1.00 0.00 H new ATOM 2338 N LYS B 55 -17.022 -5.850 9.025 1.00 0.00 N ATOM 2339 CA LYS B 55 -15.882 -5.993 9.914 1.00 0.00 C ATOM 2340 C LYS B 55 -14.604 -5.547 9.215 1.00 0.00 C ATOM 2341 O LYS B 55 -13.783 -4.854 9.806 1.00 0.00 O ATOM 2342 CB LYS B 55 -15.749 -7.445 10.381 1.00 0.00 C ATOM 2343 CG LYS B 55 -15.499 -7.581 11.874 1.00 0.00 C ATOM 2344 CD LYS B 55 -15.394 -9.040 12.294 1.00 0.00 C ATOM 2345 CE LYS B 55 -16.313 -9.357 13.464 1.00 0.00 C ATOM 2346 NZ LYS B 55 -15.554 -9.875 14.637 1.00 0.00 N ATOM 0 H LYS B 55 -17.344 -6.726 8.613 1.00 0.00 H new ATOM 0 HA LYS B 55 -16.043 -5.359 10.786 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -16.659 -7.986 10.122 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -14.931 -7.919 9.839 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -14.580 -7.059 12.139 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -16.308 -7.101 12.424 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -15.646 -9.681 11.449 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -14.364 -9.266 12.569 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -16.859 -8.458 13.752 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -17.054 -10.095 13.155 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -16.065 -9.640 15.512 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -15.457 -10.908 14.559 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -14.610 -9.439 14.660 1.00 0.00 H new ATOM 2360 N VAL B 56 -14.443 -5.938 7.951 1.00 0.00 N ATOM 2361 CA VAL B 56 -13.261 -5.553 7.190 1.00 0.00 C ATOM 2362 C VAL B 56 -13.246 -4.045 6.974 1.00 0.00 C ATOM 2363 O VAL B 56 -12.243 -3.388 7.253 1.00 0.00 O ATOM 2364 CB VAL B 56 -13.166 -6.289 5.832 1.00 0.00 C ATOM 2365 CG1 VAL B 56 -14.436 -6.126 5.033 1.00 0.00 C ATOM 2366 CG2 VAL B 56 -11.956 -5.816 5.038 1.00 0.00 C ATOM 0 H VAL B 56 -15.110 -6.515 7.439 1.00 0.00 H new ATOM 0 HA VAL B 56 -12.390 -5.848 7.775 1.00 0.00 H new ATOM 0 HB VAL B 56 -13.037 -7.352 6.038 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -14.339 -6.654 4.084 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -15.274 -6.539 5.594 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -14.613 -5.067 4.843 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -11.913 -6.349 4.088 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -12.040 -4.746 4.850 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -11.047 -6.014 5.607 1.00 0.00 H new ATOM 2376 N MET B 57 -14.367 -3.484 6.511 1.00 0.00 N ATOM 2377 CA MET B 57 -14.446 -2.041 6.315 1.00 0.00 C ATOM 2378 C MET B 57 -14.224 -1.334 7.653 1.00 0.00 C ATOM 2379 O MET B 57 -13.795 -0.181 7.701 1.00 0.00 O ATOM 2380 CB MET B 57 -15.797 -1.648 5.692 1.00 0.00 C ATOM 2381 CG MET B 57 -16.831 -1.124 6.683 1.00 0.00 C ATOM 2382 SD MET B 57 -16.607 0.624 7.078 1.00 0.00 S ATOM 2383 CE MET B 57 -16.709 1.376 5.454 1.00 0.00 C ATOM 0 H MET B 57 -15.214 -3.998 6.270 1.00 0.00 H new ATOM 0 HA MET B 57 -13.666 -1.729 5.621 1.00 0.00 H new ATOM 0 HB2 MET B 57 -15.623 -0.885 4.933 1.00 0.00 H new ATOM 0 HB3 MET B 57 -16.212 -2.517 5.181 1.00 0.00 H new ATOM 0 HG2 MET B 57 -17.829 -1.273 6.271 1.00 0.00 H new ATOM 0 HG3 MET B 57 -16.775 -1.708 7.601 1.00 0.00 H new ATOM 0 HE1 MET B 57 -16.891 2.446 5.559 1.00 0.00 H new ATOM 0 HE2 MET B 57 -15.772 1.218 4.920 1.00 0.00 H new ATOM 0 HE3 MET B 57 -17.526 0.922 4.894 1.00 0.00 H new ATOM 2393 N GLU B 58 -14.514 -2.054 8.738 1.00 0.00 N ATOM 2394 CA GLU B 58 -14.346 -1.532 10.088 1.00 0.00 C ATOM 2395 C GLU B 58 -12.923 -1.780 10.587 1.00 0.00 C ATOM 2396 O GLU B 58 -12.354 -0.964 11.313 1.00 0.00 O ATOM 2397 CB GLU B 58 -15.353 -2.200 11.031 1.00 0.00 C ATOM 2398 CG GLU B 58 -16.651 -1.423 11.183 1.00 0.00 C ATOM 2399 CD GLU B 58 -17.530 -1.967 12.291 1.00 0.00 C ATOM 2400 OE1 GLU B 58 -18.022 -3.108 12.154 1.00 0.00 O ATOM 2401 OE2 GLU B 58 -17.727 -1.253 13.296 1.00 0.00 O ATOM 0 H GLU B 58 -14.870 -3.009 8.703 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.525 -0.457 10.071 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -15.579 -3.199 10.659 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -14.894 -2.321 12.012 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -16.422 -0.377 11.386 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -17.200 -1.452 10.242 1.00 0.00 H new ATOM 2408 N THR B 59 -12.357 -2.916 10.187 1.00 0.00 N ATOM 2409 CA THR B 59 -11.003 -3.294 10.580 1.00 0.00 C ATOM 2410 C THR B 59 -9.984 -2.306 10.028 1.00 0.00 C ATOM 2411 O THR B 59 -8.922 -2.099 10.613 1.00 0.00 O ATOM 2412 CB THR B 59 -10.694 -4.710 10.076 1.00 0.00 C ATOM 2413 OG1 THR B 59 -11.622 -5.645 10.598 1.00 0.00 O ATOM 2414 CG2 THR B 59 -9.307 -5.200 10.438 1.00 0.00 C ATOM 0 H THR B 59 -12.821 -3.596 9.585 1.00 0.00 H new ATOM 0 HA THR B 59 -10.938 -3.277 11.668 1.00 0.00 H new ATOM 0 HB THR B 59 -10.763 -4.640 8.990 1.00 0.00 H new ATOM 0 HG1 THR B 59 -12.528 -5.277 10.534 1.00 0.00 H new ATOM 0 HG21 THR B 59 -9.164 -6.207 10.047 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.561 -4.533 10.005 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.197 -5.212 11.522 1.00 0.00 H new ATOM 2422 N LEU B 60 -10.320 -1.695 8.896 1.00 0.00 N ATOM 2423 CA LEU B 60 -9.439 -0.726 8.259 1.00 0.00 C ATOM 2424 C LEU B 60 -9.671 0.673 8.823 1.00 0.00 C ATOM 2425 O LEU B 60 -8.767 1.507 8.829 1.00 0.00 O ATOM 2426 CB LEU B 60 -9.665 -0.724 6.747 1.00 0.00 C ATOM 2427 CG LEU B 60 -9.767 -2.111 6.110 1.00 0.00 C ATOM 2428 CD1 LEU B 60 -10.828 -2.124 5.022 1.00 0.00 C ATOM 2429 CD2 LEU B 60 -8.419 -2.540 5.549 1.00 0.00 C ATOM 0 H LEU B 60 -11.198 -1.855 8.402 1.00 0.00 H new ATOM 0 HA LEU B 60 -8.408 -1.014 8.466 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -10.580 -0.173 6.532 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -8.847 -0.181 6.273 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.061 -2.823 6.882 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.885 -3.119 4.581 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -11.794 -1.862 5.453 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -10.567 -1.400 4.250 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -8.510 -3.529 5.100 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -8.096 -1.826 4.792 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -7.684 -2.573 6.353 1.00 0.00 H new ATOM 2441 N ASP B 61 -10.891 0.923 9.296 1.00 0.00 N ATOM 2442 CA ASP B 61 -11.245 2.222 9.863 1.00 0.00 C ATOM 2443 C ASP B 61 -10.185 2.702 10.850 1.00 0.00 C ATOM 2444 O ASP B 61 -10.199 2.329 12.024 1.00 0.00 O ATOM 2445 CB ASP B 61 -12.605 2.145 10.560 1.00 0.00 C ATOM 2446 CG ASP B 61 -13.261 3.505 10.695 1.00 0.00 C ATOM 2447 OD1 ASP B 61 -12.677 4.382 11.366 1.00 0.00 O ATOM 2448 OD2 ASP B 61 -14.360 3.693 10.131 1.00 0.00 O ATOM 0 H ASP B 61 -11.651 0.242 9.298 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.300 2.939 9.044 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -13.262 1.482 9.997 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -12.479 1.705 11.549 1.00 0.00 H new ATOM 2453 N ASN B 62 -9.268 3.533 10.366 1.00 0.00 N ATOM 2454 CA ASN B 62 -8.200 4.067 11.204 1.00 0.00 C ATOM 2455 C ASN B 62 -8.203 5.591 11.176 1.00 0.00 C ATOM 2456 O ASN B 62 -8.060 6.242 12.210 1.00 0.00 O ATOM 2457 CB ASN B 62 -6.843 3.539 10.736 1.00 0.00 C ATOM 2458 CG ASN B 62 -5.804 3.558 11.841 1.00 0.00 C ATOM 2459 OD1 ASN B 62 -6.137 3.662 13.021 1.00 0.00 O ATOM 2460 ND2 ASN B 62 -4.535 3.456 11.461 1.00 0.00 N ATOM 0 H ASN B 62 -9.243 3.852 9.397 1.00 0.00 H new ATOM 0 HA ASN B 62 -8.375 3.738 12.228 1.00 0.00 H new ATOM 0 HB2 ASN B 62 -6.960 2.520 10.368 1.00 0.00 H new ATOM 0 HB3 ASN B 62 -6.491 4.142 9.899 1.00 0.00 H new ATOM 0 HD21 ASN B 62 -3.791 3.462 12.159 1.00 0.00 H new ATOM 0 HD22 ASN B 62 -4.304 3.372 10.471 1.00 0.00 H new ATOM 2467 N ASP B 63 -8.369 6.153 9.984 1.00 0.00 N ATOM 2468 CA ASP B 63 -8.393 7.600 9.817 1.00 0.00 C ATOM 2469 C ASP B 63 -9.465 8.010 8.813 1.00 0.00 C ATOM 2470 O ASP B 63 -9.253 8.905 7.993 1.00 0.00 O ATOM 2471 CB ASP B 63 -7.024 8.105 9.360 1.00 0.00 C ATOM 2472 CG ASP B 63 -6.620 9.390 10.055 1.00 0.00 C ATOM 2473 OD1 ASP B 63 -7.350 10.394 9.918 1.00 0.00 O ATOM 2474 OD2 ASP B 63 -5.572 9.392 10.736 1.00 0.00 O ATOM 0 H ASP B 63 -8.489 5.627 9.118 1.00 0.00 H new ATOM 0 HA ASP B 63 -8.632 8.051 10.780 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -6.274 7.339 9.555 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -7.041 8.268 8.282 1.00 0.00 H new ATOM 2479 N GLY B 64 -10.618 7.350 8.881 1.00 0.00 N ATOM 2480 CA GLY B 64 -11.704 7.661 7.970 1.00 0.00 C ATOM 2481 C GLY B 64 -12.900 8.275 8.673 1.00 0.00 C ATOM 2482 O GLY B 64 -13.949 8.479 8.060 1.00 0.00 O ATOM 0 H GLY B 64 -10.819 6.607 9.550 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -11.345 8.349 7.205 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.016 6.750 7.459 1.00 0.00 H new ATOM 2486 N ASP B 65 -12.748 8.572 9.961 1.00 0.00 N ATOM 2487 CA ASP B 65 -13.831 9.163 10.740 1.00 0.00 C ATOM 2488 C ASP B 65 -15.063 8.262 10.730 1.00 0.00 C ATOM 2489 O ASP B 65 -16.184 8.726 10.934 1.00 0.00 O ATOM 2490 CB ASP B 65 -14.187 10.544 10.187 1.00 0.00 C ATOM 2491 CG ASP B 65 -14.580 11.520 11.278 1.00 0.00 C ATOM 2492 OD1 ASP B 65 -15.510 11.206 12.049 1.00 0.00 O ATOM 2493 OD2 ASP B 65 -13.956 12.600 11.360 1.00 0.00 O ATOM 0 H ASP B 65 -11.888 8.413 10.486 1.00 0.00 H new ATOM 0 HA ASP B 65 -13.491 9.269 11.770 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -13.335 10.943 9.637 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -15.008 10.447 9.477 1.00 0.00 H new ATOM 2498 N GLY B 66 -14.845 6.973 10.489 1.00 0.00 N ATOM 2499 CA GLY B 66 -15.945 6.027 10.456 1.00 0.00 C ATOM 2500 C GLY B 66 -16.225 5.497 9.060 1.00 0.00 C ATOM 2501 O GLY B 66 -17.211 4.792 8.845 1.00 0.00 O ATOM 0 H GLY B 66 -13.926 6.567 10.316 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -15.719 5.191 11.118 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.843 6.508 10.844 1.00 0.00 H new ATOM 2505 N GLU B 67 -15.356 5.832 8.111 1.00 0.00 N ATOM 2506 CA GLU B 67 -15.507 5.384 6.738 1.00 0.00 C ATOM 2507 C GLU B 67 -14.164 4.921 6.190 1.00 0.00 C ATOM 2508 O GLU B 67 -13.162 4.913 6.903 1.00 0.00 O ATOM 2509 CB GLU B 67 -16.073 6.509 5.869 1.00 0.00 C ATOM 2510 CG GLU B 67 -17.524 6.296 5.473 1.00 0.00 C ATOM 2511 CD GLU B 67 -18.047 7.392 4.564 1.00 0.00 C ATOM 2512 OE1 GLU B 67 -18.119 8.553 5.017 1.00 0.00 O ATOM 2513 OE2 GLU B 67 -18.386 7.088 3.401 1.00 0.00 O ATOM 0 H GLU B 67 -14.536 6.416 8.273 1.00 0.00 H new ATOM 0 HA GLU B 67 -16.204 4.547 6.718 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -15.986 7.453 6.408 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -15.468 6.600 4.967 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -17.622 5.334 4.970 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -18.139 6.250 6.372 1.00 0.00 H new ATOM 2520 N CYS B 68 -14.149 4.534 4.924 1.00 0.00 N ATOM 2521 CA CYS B 68 -12.925 4.068 4.290 1.00 0.00 C ATOM 2522 C CYS B 68 -12.451 5.047 3.223 1.00 0.00 C ATOM 2523 O CYS B 68 -12.943 5.031 2.098 1.00 0.00 O ATOM 2524 CB CYS B 68 -13.145 2.685 3.670 1.00 0.00 C ATOM 2525 SG CYS B 68 -11.944 1.441 4.199 1.00 0.00 S ATOM 0 H CYS B 68 -14.968 4.533 4.316 1.00 0.00 H new ATOM 0 HA CYS B 68 -12.153 4.000 5.057 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -14.147 2.339 3.925 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -13.105 2.775 2.584 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.213 0.306 3.625 1.00 0.00 H new ATOM 2531 N ASP B 69 -11.483 5.885 3.575 1.00 0.00 N ATOM 2532 CA ASP B 69 -10.935 6.850 2.633 1.00 0.00 C ATOM 2533 C ASP B 69 -9.683 6.270 1.988 1.00 0.00 C ATOM 2534 O ASP B 69 -9.330 5.117 2.237 1.00 0.00 O ATOM 2535 CB ASP B 69 -10.601 8.176 3.324 1.00 0.00 C ATOM 2536 CG ASP B 69 -10.118 8.008 4.752 1.00 0.00 C ATOM 2537 OD1 ASP B 69 -9.716 6.884 5.118 1.00 0.00 O ATOM 2538 OD2 ASP B 69 -10.137 9.005 5.504 1.00 0.00 O ATOM 0 H ASP B 69 -11.063 5.915 4.504 1.00 0.00 H new ATOM 0 HA ASP B 69 -11.686 7.052 1.869 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -9.834 8.694 2.748 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -11.486 8.812 3.320 1.00 0.00 H new ATOM 2543 N PHE B 70 -8.997 7.068 1.181 1.00 0.00 N ATOM 2544 CA PHE B 70 -7.772 6.613 0.536 1.00 0.00 C ATOM 2545 C PHE B 70 -6.742 6.197 1.582 1.00 0.00 C ATOM 2546 O PHE B 70 -5.802 5.455 1.291 1.00 0.00 O ATOM 2547 CB PHE B 70 -7.195 7.715 -0.349 1.00 0.00 C ATOM 2548 CG PHE B 70 -6.103 7.233 -1.252 1.00 0.00 C ATOM 2549 CD1 PHE B 70 -6.303 6.130 -2.062 1.00 0.00 C ATOM 2550 CD2 PHE B 70 -4.880 7.878 -1.288 1.00 0.00 C ATOM 2551 CE1 PHE B 70 -5.299 5.677 -2.896 1.00 0.00 C ATOM 2552 CE2 PHE B 70 -3.872 7.431 -2.119 1.00 0.00 C ATOM 2553 CZ PHE B 70 -4.081 6.329 -2.923 1.00 0.00 C ATOM 0 H PHE B 70 -9.265 8.027 0.958 1.00 0.00 H new ATOM 0 HA PHE B 70 -8.013 5.750 -0.085 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -7.995 8.143 -0.953 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -6.809 8.515 0.283 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -7.254 5.618 -2.042 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -4.712 8.740 -0.660 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -5.466 4.815 -3.525 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -2.921 7.943 -2.140 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.293 5.977 -3.573 1.00 0.00 H new ATOM 2563 N GLN B 71 -6.934 6.680 2.802 1.00 0.00 N ATOM 2564 CA GLN B 71 -6.034 6.363 3.904 1.00 0.00 C ATOM 2565 C GLN B 71 -6.123 4.883 4.252 1.00 0.00 C ATOM 2566 O GLN B 71 -5.113 4.229 4.525 1.00 0.00 O ATOM 2567 CB GLN B 71 -6.375 7.206 5.136 1.00 0.00 C ATOM 2568 CG GLN B 71 -6.811 8.628 4.813 1.00 0.00 C ATOM 2569 CD GLN B 71 -5.845 9.339 3.885 1.00 0.00 C ATOM 2570 OE1 GLN B 71 -6.253 9.977 2.915 1.00 0.00 O ATOM 2571 NE2 GLN B 71 -4.554 9.230 4.178 1.00 0.00 N ATOM 0 H GLN B 71 -7.708 7.295 3.055 1.00 0.00 H new ATOM 0 HA GLN B 71 -5.016 6.594 3.590 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -7.170 6.711 5.693 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -5.504 7.244 5.790 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -7.799 8.605 4.354 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -6.903 9.195 5.739 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -4.260 8.691 4.992 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -3.857 9.685 3.589 1.00 0.00 H new ATOM 2580 N GLU B 72 -7.343 4.357 4.229 1.00 0.00 N ATOM 2581 CA GLU B 72 -7.573 2.952 4.533 1.00 0.00 C ATOM 2582 C GLU B 72 -7.096 2.083 3.380 1.00 0.00 C ATOM 2583 O GLU B 72 -6.667 0.949 3.580 1.00 0.00 O ATOM 2584 CB GLU B 72 -9.053 2.707 4.823 1.00 0.00 C ATOM 2585 CG GLU B 72 -9.680 3.775 5.701 1.00 0.00 C ATOM 2586 CD GLU B 72 -8.855 4.084 6.937 1.00 0.00 C ATOM 2587 OE1 GLU B 72 -7.987 3.261 7.294 1.00 0.00 O ATOM 2588 OE2 GLU B 72 -9.080 5.150 7.548 1.00 0.00 O ATOM 0 H GLU B 72 -8.187 4.884 4.003 1.00 0.00 H new ATOM 0 HA GLU B 72 -7.004 2.685 5.423 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -9.597 2.657 3.880 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -9.165 1.737 5.307 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -9.808 4.687 5.119 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -10.674 3.449 6.006 1.00 0.00 H new ATOM 2595 N PHE B 73 -7.151 2.637 2.174 1.00 0.00 N ATOM 2596 CA PHE B 73 -6.697 1.929 0.981 1.00 0.00 C ATOM 2597 C PHE B 73 -5.280 1.415 1.195 1.00 0.00 C ATOM 2598 O PHE B 73 -4.989 0.241 0.972 1.00 0.00 O ATOM 2599 CB PHE B 73 -6.724 2.872 -0.225 1.00 0.00 C ATOM 2600 CG PHE B 73 -7.861 2.650 -1.183 1.00 0.00 C ATOM 2601 CD1 PHE B 73 -8.992 1.932 -0.818 1.00 0.00 C ATOM 2602 CD2 PHE B 73 -7.793 3.175 -2.461 1.00 0.00 C ATOM 2603 CE1 PHE B 73 -10.029 1.746 -1.713 1.00 0.00 C ATOM 2604 CE2 PHE B 73 -8.822 2.992 -3.359 1.00 0.00 C ATOM 2605 CZ PHE B 73 -9.944 2.277 -2.986 1.00 0.00 C ATOM 0 H PHE B 73 -7.506 3.576 1.996 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.362 1.086 0.793 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -6.770 3.899 0.137 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -5.785 2.768 -0.769 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -9.062 1.514 0.176 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.920 3.737 -2.759 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -10.904 1.187 -1.418 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -8.752 3.407 -4.354 1.00 0.00 H new ATOM 0 HZ PHE B 73 -10.752 2.133 -3.688 1.00 0.00 H new ATOM 2615 N MET B 74 -4.407 2.312 1.640 1.00 0.00 N ATOM 2616 CA MET B 74 -3.020 1.962 1.900 1.00 0.00 C ATOM 2617 C MET B 74 -2.938 0.864 2.953 1.00 0.00 C ATOM 2618 O MET B 74 -2.373 -0.201 2.708 1.00 0.00 O ATOM 2619 CB MET B 74 -2.243 3.193 2.364 1.00 0.00 C ATOM 2620 CG MET B 74 -2.328 4.364 1.399 1.00 0.00 C ATOM 2621 SD MET B 74 -1.473 4.049 -0.158 1.00 0.00 S ATOM 2622 CE MET B 74 -2.692 3.065 -1.026 1.00 0.00 C ATOM 0 H MET B 74 -4.638 3.288 1.828 1.00 0.00 H new ATOM 0 HA MET B 74 -2.576 1.593 0.975 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.622 3.506 3.337 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.196 2.921 2.502 1.00 0.00 H new ATOM 0 HG2 MET B 74 -3.376 4.586 1.195 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.901 5.249 1.870 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.717 3.359 -2.075 1.00 0.00 H new ATOM 0 HE2 MET B 74 -2.428 2.010 -0.951 1.00 0.00 H new ATOM 0 HE3 MET B 74 -3.674 3.226 -0.580 1.00 0.00 H new ATOM 2632 N ALA B 75 -3.513 1.128 4.123 1.00 0.00 N ATOM 2633 CA ALA B 75 -3.508 0.152 5.207 1.00 0.00 C ATOM 2634 C ALA B 75 -4.171 -1.151 4.770 1.00 0.00 C ATOM 2635 O ALA B 75 -3.789 -2.233 5.211 1.00 0.00 O ATOM 2636 CB ALA B 75 -4.211 0.720 6.432 1.00 0.00 C ATOM 0 H ALA B 75 -3.986 2.005 4.344 1.00 0.00 H new ATOM 0 HA ALA B 75 -2.472 -0.065 5.466 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -4.200 -0.019 7.233 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -3.695 1.621 6.762 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -5.242 0.965 6.179 1.00 0.00 H new ATOM 2642 N PHE B 76 -5.161 -1.035 3.892 1.00 0.00 N ATOM 2643 CA PHE B 76 -5.880 -2.198 3.382 1.00 0.00 C ATOM 2644 C PHE B 76 -4.929 -3.144 2.664 1.00 0.00 C ATOM 2645 O PHE B 76 -4.576 -4.201 3.185 1.00 0.00 O ATOM 2646 CB PHE B 76 -6.988 -1.754 2.424 1.00 0.00 C ATOM 2647 CG PHE B 76 -7.929 -2.853 2.026 1.00 0.00 C ATOM 2648 CD1 PHE B 76 -7.484 -3.951 1.305 1.00 0.00 C ATOM 2649 CD2 PHE B 76 -9.264 -2.784 2.376 1.00 0.00 C ATOM 2650 CE1 PHE B 76 -8.358 -4.959 0.942 1.00 0.00 C ATOM 2651 CE2 PHE B 76 -10.144 -3.788 2.018 1.00 0.00 C ATOM 2652 CZ PHE B 76 -9.690 -4.877 1.301 1.00 0.00 C ATOM 0 H PHE B 76 -5.485 -0.144 3.517 1.00 0.00 H new ATOM 0 HA PHE B 76 -6.325 -2.723 4.227 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.559 -0.953 2.892 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.532 -1.337 1.526 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.443 -4.019 1.024 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -9.625 -1.934 2.937 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -8.001 -5.809 0.379 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -11.185 -3.721 2.299 1.00 0.00 H new ATOM 0 HZ PHE B 76 -10.375 -5.664 1.021 1.00 0.00 H new ATOM 2662 N VAL B 77 -4.522 -2.757 1.462 1.00 0.00 N ATOM 2663 CA VAL B 77 -3.616 -3.572 0.669 1.00 0.00 C ATOM 2664 C VAL B 77 -2.307 -3.827 1.409 1.00 0.00 C ATOM 2665 O VAL B 77 -1.650 -4.835 1.184 1.00 0.00 O ATOM 2666 CB VAL B 77 -3.293 -2.908 -0.684 1.00 0.00 C ATOM 2667 CG1 VAL B 77 -4.420 -3.143 -1.678 1.00 0.00 C ATOM 2668 CG2 VAL B 77 -3.029 -1.419 -0.505 1.00 0.00 C ATOM 0 H VAL B 77 -4.806 -1.884 1.017 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.127 -4.519 0.493 1.00 0.00 H new ATOM 0 HB VAL B 77 -2.387 -3.365 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.173 -2.667 -2.627 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -4.551 -4.214 -1.833 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.344 -2.717 -1.288 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -2.803 -0.971 -1.473 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -3.912 -0.941 -0.081 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -2.182 -1.278 0.167 1.00 0.00 H new ATOM 2678 N ALA B 78 -1.928 -2.894 2.274 1.00 0.00 N ATOM 2679 CA ALA B 78 -0.679 -3.007 3.027 1.00 0.00 C ATOM 2680 C ALA B 78 -0.767 -4.001 4.185 1.00 0.00 C ATOM 2681 O ALA B 78 0.121 -4.836 4.357 1.00 0.00 O ATOM 2682 CB ALA B 78 -0.260 -1.641 3.549 1.00 0.00 C ATOM 0 H ALA B 78 -2.465 -2.050 2.473 1.00 0.00 H new ATOM 0 HA ALA B 78 0.071 -3.390 2.336 1.00 0.00 H new ATOM 0 HB1 ALA B 78 0.671 -1.735 4.108 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.112 -0.961 2.710 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -1.038 -1.247 4.203 1.00 0.00 H new ATOM 2688 N MET B 79 -1.823 -3.906 4.984 1.00 0.00 N ATOM 2689 CA MET B 79 -1.989 -4.801 6.127 1.00 0.00 C ATOM 2690 C MET B 79 -2.305 -6.214 5.664 1.00 0.00 C ATOM 2691 O MET B 79 -1.577 -7.161 5.963 1.00 0.00 O ATOM 2692 CB MET B 79 -3.102 -4.295 7.048 1.00 0.00 C ATOM 2693 CG MET B 79 -2.716 -3.064 7.851 1.00 0.00 C ATOM 2694 SD MET B 79 -3.529 -3.003 9.460 1.00 0.00 S ATOM 2695 CE MET B 79 -5.234 -2.750 8.969 1.00 0.00 C ATOM 0 H MET B 79 -2.573 -3.225 4.865 1.00 0.00 H new ATOM 0 HA MET B 79 -1.051 -4.816 6.681 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.982 -4.065 6.448 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.384 -5.093 7.735 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.635 -3.052 7.993 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.973 -2.169 7.284 1.00 0.00 H new ATOM 0 HE1 MET B 79 -5.863 -2.691 9.857 1.00 0.00 H new ATOM 0 HE2 MET B 79 -5.316 -1.822 8.404 1.00 0.00 H new ATOM 0 HE3 MET B 79 -5.561 -3.583 8.347 1.00 0.00 H new ATOM 2705 N VAL B 80 -3.398 -6.341 4.928 1.00 0.00 N ATOM 2706 CA VAL B 80 -3.835 -7.626 4.406 1.00 0.00 C ATOM 2707 C VAL B 80 -2.701 -8.339 3.665 1.00 0.00 C ATOM 2708 O VAL B 80 -2.589 -9.565 3.710 1.00 0.00 O ATOM 2709 CB VAL B 80 -5.039 -7.431 3.464 1.00 0.00 C ATOM 2710 CG1 VAL B 80 -5.458 -8.748 2.822 1.00 0.00 C ATOM 2711 CG2 VAL B 80 -6.203 -6.805 4.217 1.00 0.00 C ATOM 0 H VAL B 80 -4.004 -5.560 4.677 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.133 -8.249 5.249 1.00 0.00 H new ATOM 0 HB VAL B 80 -4.737 -6.755 2.664 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -6.309 -8.577 2.163 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.627 -9.151 2.243 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.738 -9.459 3.599 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -7.046 -6.673 3.539 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -6.497 -7.457 5.039 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.901 -5.835 4.613 1.00 0.00 H new ATOM 2721 N THR B 81 -1.861 -7.560 2.986 1.00 0.00 N ATOM 2722 CA THR B 81 -0.736 -8.109 2.235 1.00 0.00 C ATOM 2723 C THR B 81 0.354 -8.629 3.169 1.00 0.00 C ATOM 2724 O THR B 81 0.707 -9.810 3.129 1.00 0.00 O ATOM 2725 CB THR B 81 -0.169 -7.030 1.303 1.00 0.00 C ATOM 2726 OG1 THR B 81 -0.957 -6.922 0.131 1.00 0.00 O ATOM 2727 CG2 THR B 81 1.264 -7.255 0.862 1.00 0.00 C ATOM 0 H THR B 81 -1.940 -6.544 2.941 1.00 0.00 H new ATOM 0 HA THR B 81 -1.093 -8.952 1.643 1.00 0.00 H new ATOM 0 HB THR B 81 -0.192 -6.120 1.903 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.475 -6.090 0.160 1.00 0.00 H new ATOM 0 HG21 THR B 81 1.575 -6.441 0.207 1.00 0.00 H new ATOM 0 HG22 THR B 81 1.913 -7.285 1.737 1.00 0.00 H new ATOM 0 HG23 THR B 81 1.335 -8.201 0.325 1.00 0.00 H new ATOM 2735 N THR B 82 0.893 -7.728 3.988 1.00 0.00 N ATOM 2736 CA THR B 82 1.968 -8.058 4.925 1.00 0.00 C ATOM 2737 C THR B 82 1.734 -9.382 5.641 1.00 0.00 C ATOM 2738 O THR B 82 2.685 -10.039 6.066 1.00 0.00 O ATOM 2739 CB THR B 82 2.134 -6.938 5.951 1.00 0.00 C ATOM 2740 OG1 THR B 82 2.310 -5.689 5.306 1.00 0.00 O ATOM 2741 CG2 THR B 82 3.313 -7.144 6.878 1.00 0.00 C ATOM 0 H THR B 82 0.599 -6.752 4.022 1.00 0.00 H new ATOM 0 HA THR B 82 2.880 -8.163 4.338 1.00 0.00 H new ATOM 0 HB THR B 82 1.219 -6.952 6.543 1.00 0.00 H new ATOM 0 HG1 THR B 82 1.457 -5.207 5.289 1.00 0.00 H new ATOM 0 HG21 THR B 82 3.373 -6.313 7.581 1.00 0.00 H new ATOM 0 HG22 THR B 82 3.185 -8.076 7.428 1.00 0.00 H new ATOM 0 HG23 THR B 82 4.232 -7.191 6.293 1.00 0.00 H new ATOM 2749 N ALA B 83 0.481 -9.777 5.783 1.00 0.00 N ATOM 2750 CA ALA B 83 0.169 -11.027 6.452 1.00 0.00 C ATOM 2751 C ALA B 83 0.276 -12.211 5.504 1.00 0.00 C ATOM 2752 O ALA B 83 1.179 -13.039 5.627 1.00 0.00 O ATOM 2753 CB ALA B 83 -1.212 -10.976 7.074 1.00 0.00 C ATOM 0 H ALA B 83 -0.329 -9.256 5.448 1.00 0.00 H new ATOM 0 HA ALA B 83 0.905 -11.163 7.244 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -1.423 -11.924 7.569 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -1.252 -10.168 7.804 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -1.955 -10.800 6.296 1.00 0.00 H new ATOM 2759 N CYS B 84 -0.666 -12.300 4.575 1.00 0.00 N ATOM 2760 CA CYS B 84 -0.689 -13.405 3.625 1.00 0.00 C ATOM 2761 C CYS B 84 0.124 -13.120 2.371 1.00 0.00 C ATOM 2762 O CYS B 84 1.027 -13.882 2.029 1.00 0.00 O ATOM 2763 CB CYS B 84 -2.128 -13.760 3.251 1.00 0.00 C ATOM 2764 SG CYS B 84 -2.436 -15.537 3.108 1.00 0.00 S ATOM 0 H CYS B 84 -1.421 -11.624 4.459 1.00 0.00 H new ATOM 0 HA CYS B 84 -0.223 -14.255 4.122 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -2.800 -13.345 4.002 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -2.374 -13.282 2.303 1.00 0.00 H new ATOM 0 HG CYS B 84 -1.500 -16.191 3.729 1.00 0.00 H new ATOM 2770 N HIS B 85 -0.186 -12.029 1.679 1.00 0.00 N ATOM 2771 CA HIS B 85 0.546 -11.689 0.462 1.00 0.00 C ATOM 2772 C HIS B 85 2.045 -11.659 0.737 1.00 0.00 C ATOM 2773 O HIS B 85 2.862 -11.764 -0.178 1.00 0.00 O ATOM 2774 CB HIS B 85 0.076 -10.349 -0.101 1.00 0.00 C ATOM 2775 CG HIS B 85 0.135 -10.281 -1.595 1.00 0.00 C ATOM 2776 ND1 HIS B 85 -0.827 -9.657 -2.360 1.00 0.00 N ATOM 2777 CD2 HIS B 85 1.045 -10.776 -2.468 1.00 0.00 C ATOM 2778 CE1 HIS B 85 -0.513 -9.773 -3.638 1.00 0.00 C ATOM 2779 NE2 HIS B 85 0.618 -10.448 -3.732 1.00 0.00 N ATOM 0 H HIS B 85 -0.926 -11.374 1.933 1.00 0.00 H new ATOM 0 HA HIS B 85 0.344 -12.457 -0.284 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -0.948 -10.165 0.224 1.00 0.00 H new ATOM 0 HB3 HIS B 85 0.691 -9.552 0.317 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -1.652 -9.180 -1.996 1.00 0.00 H new ATOM 0 HD2 HIS B 85 1.940 -11.326 -2.217 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -1.085 -9.382 -4.466 1.00 0.00 H new ATOM 2788 N GLU B 86 2.391 -11.527 2.014 1.00 0.00 N ATOM 2789 CA GLU B 86 3.775 -11.497 2.446 1.00 0.00 C ATOM 2790 C GLU B 86 4.542 -12.705 1.918 1.00 0.00 C ATOM 2791 O GLU B 86 5.471 -12.566 1.123 1.00 0.00 O ATOM 2792 CB GLU B 86 3.809 -11.468 3.977 1.00 0.00 C ATOM 2793 CG GLU B 86 5.172 -11.778 4.580 1.00 0.00 C ATOM 2794 CD GLU B 86 5.195 -13.097 5.329 1.00 0.00 C ATOM 2795 OE1 GLU B 86 4.129 -13.513 5.830 1.00 0.00 O ATOM 2796 OE2 GLU B 86 6.277 -13.712 5.415 1.00 0.00 O ATOM 0 H GLU B 86 1.717 -11.438 2.774 1.00 0.00 H new ATOM 0 HA GLU B 86 4.257 -10.605 2.046 1.00 0.00 H new ATOM 0 HB2 GLU B 86 3.490 -10.483 4.317 1.00 0.00 H new ATOM 0 HB3 GLU B 86 3.084 -12.187 4.358 1.00 0.00 H new ATOM 0 HG2 GLU B 86 5.919 -11.803 3.786 1.00 0.00 H new ATOM 0 HG3 GLU B 86 5.455 -10.974 5.259 1.00 0.00 H new ATOM 2803 N PHE B 87 4.143 -13.888 2.363 1.00 0.00 N ATOM 2804 CA PHE B 87 4.784 -15.123 1.934 1.00 0.00 C ATOM 2805 C PHE B 87 3.784 -16.026 1.221 1.00 0.00 C ATOM 2806 O PHE B 87 4.157 -16.825 0.361 1.00 0.00 O ATOM 2807 CB PHE B 87 5.398 -15.852 3.131 1.00 0.00 C ATOM 2808 CG PHE B 87 6.818 -16.284 2.903 1.00 0.00 C ATOM 2809 CD1 PHE B 87 7.745 -15.409 2.359 1.00 0.00 C ATOM 2810 CD2 PHE B 87 7.227 -17.567 3.230 1.00 0.00 C ATOM 2811 CE1 PHE B 87 9.052 -15.805 2.148 1.00 0.00 C ATOM 2812 CE2 PHE B 87 8.532 -17.970 3.020 1.00 0.00 C ATOM 2813 CZ PHE B 87 9.445 -17.087 2.478 1.00 0.00 C ATOM 0 H PHE B 87 3.376 -14.019 3.023 1.00 0.00 H new ATOM 0 HA PHE B 87 5.581 -14.870 1.235 1.00 0.00 H new ATOM 0 HB2 PHE B 87 5.360 -15.199 4.003 1.00 0.00 H new ATOM 0 HB3 PHE B 87 4.792 -16.728 3.363 1.00 0.00 H new ATOM 0 HD1 PHE B 87 7.442 -14.406 2.097 1.00 0.00 H new ATOM 0 HD2 PHE B 87 6.517 -18.261 3.654 1.00 0.00 H new ATOM 0 HE1 PHE B 87 9.765 -15.113 1.726 1.00 0.00 H new ATOM 0 HE2 PHE B 87 8.837 -18.973 3.279 1.00 0.00 H new ATOM 0 HZ PHE B 87 10.466 -17.399 2.312 1.00 0.00 H new ATOM 2823 N PHE B 88 2.510 -15.887 1.576 1.00 0.00 N ATOM 2824 CA PHE B 88 1.457 -16.681 0.962 1.00 0.00 C ATOM 2825 C PHE B 88 1.065 -16.102 -0.395 1.00 0.00 C ATOM 2826 O PHE B 88 0.483 -16.799 -1.227 1.00 0.00 O ATOM 2827 CB PHE B 88 0.232 -16.749 1.880 1.00 0.00 C ATOM 2828 CG PHE B 88 0.271 -17.899 2.845 1.00 0.00 C ATOM 2829 CD1 PHE B 88 0.376 -19.202 2.385 1.00 0.00 C ATOM 2830 CD2 PHE B 88 0.203 -17.677 4.211 1.00 0.00 C ATOM 2831 CE1 PHE B 88 0.414 -20.263 3.269 1.00 0.00 C ATOM 2832 CE2 PHE B 88 0.239 -18.735 5.100 1.00 0.00 C ATOM 2833 CZ PHE B 88 0.344 -20.029 4.629 1.00 0.00 C ATOM 0 H PHE B 88 2.184 -15.231 2.286 1.00 0.00 H new ATOM 0 HA PHE B 88 1.838 -17.691 0.810 1.00 0.00 H new ATOM 0 HB2 PHE B 88 0.155 -15.817 2.440 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -0.667 -16.828 1.268 1.00 0.00 H new ATOM 0 HD1 PHE B 88 0.429 -19.390 1.323 1.00 0.00 H new ATOM 0 HD2 PHE B 88 0.121 -16.667 4.585 1.00 0.00 H new ATOM 0 HE1 PHE B 88 0.498 -21.274 2.898 1.00 0.00 H new ATOM 0 HE2 PHE B 88 0.185 -18.550 6.163 1.00 0.00 H new ATOM 0 HZ PHE B 88 0.371 -20.857 5.322 1.00 0.00 H new ATOM 2909 N ARG C 2 0.252 12.605 8.373 1.00 0.00 N ATOM 2910 CA ARG C 2 -0.993 13.218 7.935 1.00 0.00 C ATOM 2911 C ARG C 2 -0.734 14.470 7.099 1.00 0.00 C ATOM 2912 O ARG C 2 -0.894 14.456 5.878 1.00 0.00 O ATOM 2913 CB ARG C 2 -1.860 13.573 9.145 1.00 0.00 C ATOM 2914 CG ARG C 2 -2.685 12.408 9.667 1.00 0.00 C ATOM 2915 CD ARG C 2 -3.377 12.757 10.976 1.00 0.00 C ATOM 2916 NE ARG C 2 -2.514 12.517 12.132 1.00 0.00 N ATOM 2917 CZ ARG C 2 -2.947 12.501 13.391 1.00 0.00 C ATOM 2918 NH1 ARG C 2 -4.230 12.710 13.661 1.00 0.00 N ATOM 2919 NH2 ARG C 2 -2.096 12.275 14.383 1.00 0.00 N ATOM 0 HA ARG C 2 -1.519 12.495 7.311 1.00 0.00 H new ATOM 0 HB2 ARG C 2 -1.218 13.940 9.946 1.00 0.00 H new ATOM 0 HB3 ARG C 2 -2.530 14.389 8.874 1.00 0.00 H new ATOM 0 HG2 ARG C 2 -3.431 12.127 8.924 1.00 0.00 H new ATOM 0 HG3 ARG C 2 -2.040 11.542 9.815 1.00 0.00 H new ATOM 0 HD2 ARG C 2 -3.678 13.805 10.959 1.00 0.00 H new ATOM 0 HD3 ARG C 2 -4.287 12.166 11.074 1.00 0.00 H new ATOM 0 HE ARG C 2 -1.522 12.352 11.964 1.00 0.00 H new ATOM 0 HH11 ARG C 2 -4.889 12.884 12.902 1.00 0.00 H new ATOM 0 HH12 ARG C 2 -4.557 12.697 14.627 1.00 0.00 H new ATOM 0 HH21 ARG C 2 -1.109 12.113 14.182 1.00 0.00 H new ATOM 0 HH22 ARG C 2 -2.428 12.263 15.347 1.00 0.00 H new ATOM 2932 N THR C 3 -0.346 15.551 7.769 1.00 0.00 N ATOM 2933 CA THR C 3 -0.080 16.819 7.094 1.00 0.00 C ATOM 2934 C THR C 3 1.414 17.106 6.922 1.00 0.00 C ATOM 2935 O THR C 3 1.783 18.055 6.231 1.00 0.00 O ATOM 2936 CB THR C 3 -0.733 17.967 7.865 1.00 0.00 C ATOM 2937 OG1 THR C 3 -0.403 17.900 9.241 1.00 0.00 O ATOM 2938 CG2 THR C 3 -2.242 17.980 7.755 1.00 0.00 C ATOM 0 H THR C 3 -0.208 15.575 8.779 1.00 0.00 H new ATOM 0 HA THR C 3 -0.509 16.737 6.095 1.00 0.00 H new ATOM 0 HB THR C 3 -0.344 18.878 7.410 1.00 0.00 H new ATOM 0 HG1 THR C 3 -0.829 18.644 9.716 1.00 0.00 H new ATOM 0 HG21 THR C 3 -2.641 18.819 8.325 1.00 0.00 H new ATOM 0 HG22 THR C 3 -2.530 18.082 6.709 1.00 0.00 H new ATOM 0 HG23 THR C 3 -2.644 17.048 8.152 1.00 0.00 H new ATOM 2946 N LYS C 4 2.274 16.326 7.574 1.00 0.00 N ATOM 2947 CA LYS C 4 3.710 16.569 7.494 1.00 0.00 C ATOM 2948 C LYS C 4 4.408 15.617 6.532 1.00 0.00 C ATOM 2949 O LYS C 4 4.971 16.053 5.536 1.00 0.00 O ATOM 2950 CB LYS C 4 4.325 16.435 8.884 1.00 0.00 C ATOM 2951 CG LYS C 4 5.796 16.805 8.935 1.00 0.00 C ATOM 2952 CD LYS C 4 6.673 15.565 9.006 1.00 0.00 C ATOM 2953 CE LYS C 4 8.129 15.866 8.662 1.00 0.00 C ATOM 2954 NZ LYS C 4 8.296 17.157 7.934 1.00 0.00 N ATOM 0 H LYS C 4 2.006 15.532 8.155 1.00 0.00 H new ATOM 0 HA LYS C 4 3.851 17.579 7.110 1.00 0.00 H new ATOM 0 HB2 LYS C 4 3.775 17.070 9.578 1.00 0.00 H new ATOM 0 HB3 LYS C 4 4.205 15.408 9.228 1.00 0.00 H new ATOM 0 HG2 LYS C 4 6.058 17.389 8.052 1.00 0.00 H new ATOM 0 HG3 LYS C 4 5.985 17.437 9.803 1.00 0.00 H new ATOM 0 HD2 LYS C 4 6.619 15.141 10.009 1.00 0.00 H new ATOM 0 HD3 LYS C 4 6.288 14.811 8.320 1.00 0.00 H new ATOM 0 HE2 LYS C 4 8.716 15.893 9.580 1.00 0.00 H new ATOM 0 HE3 LYS C 4 8.528 15.056 8.052 1.00 0.00 H new ATOM 0 HZ1 LYS C 4 9.275 17.239 7.593 1.00 0.00 H new ATOM 0 HZ2 LYS C 4 7.644 17.186 7.125 1.00 0.00 H new ATOM 0 HZ3 LYS C 4 8.086 17.947 8.576 1.00 0.00 H new ATOM 2968 N ILE C 5 4.365 14.329 6.877 1.00 0.00 N ATOM 2969 CA ILE C 5 4.981 13.215 6.124 1.00 0.00 C ATOM 2970 C ILE C 5 6.104 12.583 6.932 1.00 0.00 C ATOM 2971 O ILE C 5 7.105 12.122 6.386 1.00 0.00 O ATOM 2972 CB ILE C 5 5.494 13.538 4.679 1.00 0.00 C ATOM 2973 CG1 ILE C 5 6.922 14.128 4.659 1.00 0.00 C ATOM 2974 CG2 ILE C 5 4.526 14.411 3.894 1.00 0.00 C ATOM 2975 CD1 ILE C 5 7.242 15.111 5.764 1.00 0.00 C ATOM 0 H ILE C 5 3.884 14.012 7.719 1.00 0.00 H new ATOM 0 HA ILE C 5 4.153 12.522 5.973 1.00 0.00 H new ATOM 0 HB ILE C 5 5.545 12.574 4.173 1.00 0.00 H new ATOM 0 HG12 ILE C 5 7.636 13.306 4.712 1.00 0.00 H new ATOM 0 HG13 ILE C 5 7.077 14.624 3.701 1.00 0.00 H new ATOM 0 HG21 ILE C 5 4.932 14.603 2.901 1.00 0.00 H new ATOM 0 HG22 ILE C 5 3.568 13.900 3.801 1.00 0.00 H new ATOM 0 HG23 ILE C 5 4.383 15.357 4.417 1.00 0.00 H new ATOM 0 HD11 ILE C 5 8.268 15.461 5.653 1.00 0.00 H new ATOM 0 HD12 ILE C 5 6.561 15.960 5.705 1.00 0.00 H new ATOM 0 HD13 ILE C 5 7.128 14.621 6.731 1.00 0.00 H new ATOM 2987 N ASP C 6 5.921 12.553 8.242 1.00 0.00 N ATOM 2988 CA ASP C 6 6.915 11.965 9.129 1.00 0.00 C ATOM 2989 C ASP C 6 6.978 10.447 8.953 1.00 0.00 C ATOM 2990 O ASP C 6 6.570 9.696 9.839 1.00 0.00 O ATOM 2991 CB ASP C 6 6.599 12.309 10.586 1.00 0.00 C ATOM 2992 CG ASP C 6 5.152 12.034 10.945 1.00 0.00 C ATOM 2993 OD1 ASP C 6 4.281 12.840 10.554 1.00 0.00 O ATOM 2994 OD2 ASP C 6 4.890 11.015 11.617 1.00 0.00 O ATOM 0 H ASP C 6 5.098 12.927 8.714 1.00 0.00 H new ATOM 0 HA ASP C 6 7.887 12.382 8.867 1.00 0.00 H new ATOM 0 HB2 ASP C 6 7.249 11.731 11.242 1.00 0.00 H new ATOM 0 HB3 ASP C 6 6.821 13.361 10.764 1.00 0.00 H new ATOM 2999 N TRP C 7 7.504 9.997 7.811 1.00 0.00 N ATOM 3000 CA TRP C 7 7.625 8.564 7.546 1.00 0.00 C ATOM 3001 C TRP C 7 8.336 7.881 8.709 1.00 0.00 C ATOM 3002 O TRP C 7 7.826 6.924 9.291 1.00 0.00 O ATOM 3003 CB TRP C 7 8.392 8.307 6.243 1.00 0.00 C ATOM 3004 CG TRP C 7 7.898 9.108 5.076 1.00 0.00 C ATOM 3005 CD1 TRP C 7 6.744 9.834 5.007 1.00 0.00 C ATOM 3006 CD2 TRP C 7 8.544 9.263 3.805 1.00 0.00 C ATOM 3007 NE1 TRP C 7 6.638 10.435 3.776 1.00 0.00 N ATOM 3008 CE2 TRP C 7 7.731 10.102 3.022 1.00 0.00 C ATOM 3009 CE3 TRP C 7 9.733 8.777 3.252 1.00 0.00 C ATOM 3010 CZ2 TRP C 7 8.069 10.467 1.721 1.00 0.00 C ATOM 3011 CZ3 TRP C 7 10.066 9.139 1.960 1.00 0.00 C ATOM 3012 CH2 TRP C 7 9.238 9.979 1.208 1.00 0.00 C ATOM 0 H TRP C 7 7.849 10.598 7.063 1.00 0.00 H new ATOM 0 HA TRP C 7 6.622 8.150 7.439 1.00 0.00 H new ATOM 0 HB2 TRP C 7 9.446 8.531 6.404 1.00 0.00 H new ATOM 0 HB3 TRP C 7 8.325 7.247 5.997 1.00 0.00 H new ATOM 0 HD1 TRP C 7 6.020 9.923 5.804 1.00 0.00 H new ATOM 0 HE1 TRP C 7 5.869 11.033 3.473 1.00 0.00 H new ATOM 0 HE3 TRP C 7 10.380 8.130 3.825 1.00 0.00 H new ATOM 0 HZ2 TRP C 7 7.430 11.113 1.138 1.00 0.00 H new ATOM 0 HZ3 TRP C 7 10.981 8.767 1.524 1.00 0.00 H new ATOM 0 HH2 TRP C 7 9.528 10.247 0.203 1.00 0.00 H new ATOM 3023 N ASN C 8 9.511 8.400 9.049 1.00 0.00 N ATOM 3024 CA ASN C 8 10.299 7.869 10.154 1.00 0.00 C ATOM 3025 C ASN C 8 11.583 8.683 10.343 1.00 0.00 C ATOM 3026 O ASN C 8 11.583 9.677 11.067 1.00 0.00 O ATOM 3027 CB ASN C 8 10.610 6.383 9.937 1.00 0.00 C ATOM 3028 CG ASN C 8 10.805 5.639 11.244 1.00 0.00 C ATOM 3029 OD1 ASN C 8 10.020 4.757 11.592 1.00 0.00 O ATOM 3030 ND2 ASN C 8 11.853 5.995 11.977 1.00 0.00 N ATOM 0 H ASN C 8 9.940 9.193 8.572 1.00 0.00 H new ATOM 0 HA ASN C 8 9.710 7.955 11.067 1.00 0.00 H new ATOM 0 HB2 ASN C 8 9.797 5.922 9.377 1.00 0.00 H new ATOM 0 HB3 ASN C 8 11.510 6.287 9.329 1.00 0.00 H new ATOM 0 HD21 ASN C 8 12.033 5.532 12.868 1.00 0.00 H new ATOM 0 HD22 ASN C 8 12.478 6.732 11.649 1.00 0.00 H new ATOM 3037 N LYS C 9 12.676 8.267 9.703 1.00 0.00 N ATOM 3038 CA LYS C 9 13.945 8.976 9.823 1.00 0.00 C ATOM 3039 C LYS C 9 14.188 9.927 8.648 1.00 0.00 C ATOM 3040 O LYS C 9 14.724 11.021 8.827 1.00 0.00 O ATOM 3041 CB LYS C 9 15.100 7.978 9.934 1.00 0.00 C ATOM 3042 CG LYS C 9 16.060 8.286 11.072 1.00 0.00 C ATOM 3043 CD LYS C 9 17.316 8.981 10.570 1.00 0.00 C ATOM 3044 CE LYS C 9 18.523 8.638 11.431 1.00 0.00 C ATOM 3045 NZ LYS C 9 19.348 7.558 10.823 1.00 0.00 N ATOM 0 H LYS C 9 12.706 7.446 9.099 1.00 0.00 H new ATOM 0 HA LYS C 9 13.894 9.579 10.730 1.00 0.00 H new ATOM 0 HB2 LYS C 9 14.692 6.977 10.074 1.00 0.00 H new ATOM 0 HB3 LYS C 9 15.653 7.969 8.995 1.00 0.00 H new ATOM 0 HG2 LYS C 9 15.563 8.918 11.808 1.00 0.00 H new ATOM 0 HG3 LYS C 9 16.333 7.361 11.579 1.00 0.00 H new ATOM 0 HD2 LYS C 9 17.508 8.687 9.538 1.00 0.00 H new ATOM 0 HD3 LYS C 9 17.162 10.060 10.571 1.00 0.00 H new ATOM 0 HE2 LYS C 9 19.136 9.529 11.569 1.00 0.00 H new ATOM 0 HE3 LYS C 9 18.187 8.326 12.420 1.00 0.00 H new ATOM 0 HZ1 LYS C 9 20.160 7.353 11.439 1.00 0.00 H new ATOM 0 HZ2 LYS C 9 18.771 6.700 10.714 1.00 0.00 H new ATOM 0 HZ3 LYS C 9 19.690 7.866 9.890 1.00 0.00 H new ATOM 3059 N ILE C 10 13.823 9.491 7.443 1.00 0.00 N ATOM 3060 CA ILE C 10 14.039 10.294 6.239 1.00 0.00 C ATOM 3061 C ILE C 10 13.395 11.679 6.336 1.00 0.00 C ATOM 3062 O ILE C 10 14.088 12.694 6.263 1.00 0.00 O ATOM 3063 CB ILE C 10 13.514 9.570 4.978 1.00 0.00 C ATOM 3064 CG1 ILE C 10 13.794 10.410 3.723 1.00 0.00 C ATOM 3065 CG2 ILE C 10 12.034 9.258 5.114 1.00 0.00 C ATOM 3066 CD1 ILE C 10 13.031 9.958 2.494 1.00 0.00 C ATOM 0 H ILE C 10 13.378 8.589 7.274 1.00 0.00 H new ATOM 0 HA ILE C 10 15.118 10.427 6.155 1.00 0.00 H new ATOM 0 HB ILE C 10 14.043 8.623 4.875 1.00 0.00 H new ATOM 0 HG12 ILE C 10 13.543 11.450 3.931 1.00 0.00 H new ATOM 0 HG13 ILE C 10 14.862 10.377 3.507 1.00 0.00 H new ATOM 0 HG21 ILE C 10 11.685 8.749 4.216 1.00 0.00 H new ATOM 0 HG22 ILE C 10 11.876 8.615 5.980 1.00 0.00 H new ATOM 0 HG23 ILE C 10 11.477 10.186 5.244 1.00 0.00 H new ATOM 0 HD11 ILE C 10 13.284 10.602 1.652 1.00 0.00 H new ATOM 0 HD12 ILE C 10 13.299 8.928 2.257 1.00 0.00 H new ATOM 0 HD13 ILE C 10 11.960 10.018 2.688 1.00 0.00 H new ATOM 3078 N LEU C 11 12.077 11.727 6.495 1.00 0.00 N ATOM 3079 CA LEU C 11 11.370 12.993 6.594 1.00 0.00 C ATOM 3080 C LEU C 11 11.215 13.410 8.055 1.00 0.00 C ATOM 3081 O LEU C 11 10.924 14.569 8.352 1.00 0.00 O ATOM 3082 CB LEU C 11 10.005 12.885 5.906 1.00 0.00 C ATOM 3083 CG LEU C 11 10.015 13.159 4.397 1.00 0.00 C ATOM 3084 CD1 LEU C 11 10.336 14.618 4.117 1.00 0.00 C ATOM 3085 CD2 LEU C 11 11.003 12.251 3.683 1.00 0.00 C ATOM 0 H LEU C 11 11.479 10.903 6.558 1.00 0.00 H new ATOM 0 HA LEU C 11 11.952 13.763 6.088 1.00 0.00 H new ATOM 0 HB2 LEU C 11 9.608 11.884 6.075 1.00 0.00 H new ATOM 0 HB3 LEU C 11 9.319 13.585 6.382 1.00 0.00 H new ATOM 0 HG LEU C 11 9.018 12.944 4.012 1.00 0.00 H new ATOM 0 HD11 LEU C 11 10.338 14.790 3.041 1.00 0.00 H new ATOM 0 HD12 LEU C 11 9.583 15.252 4.585 1.00 0.00 H new ATOM 0 HD13 LEU C 11 11.318 14.859 4.525 1.00 0.00 H new ATOM 0 HD21 LEU C 11 10.989 12.467 2.615 1.00 0.00 H new ATOM 0 HD22 LEU C 11 12.005 12.424 4.075 1.00 0.00 H new ATOM 0 HD23 LEU C 11 10.724 11.210 3.846 1.00 0.00 H new ATOM 3097 N SER C 12 11.424 12.455 8.961 1.00 0.00 N ATOM 3098 CA SER C 12 11.322 12.709 10.393 1.00 0.00 C ATOM 3099 C SER C 12 9.915 13.157 10.778 1.00 0.00 C ATOM 3100 O SER C 12 9.509 12.898 11.930 1.00 0.00 O ATOM 3101 CB SER C 12 12.345 13.763 10.820 1.00 0.00 C ATOM 3102 OG SER C 12 11.862 15.074 10.582 1.00 0.00 O ATOM 3103 OXT SER C 12 9.233 13.762 9.928 1.00 0.00 O ATOM 0 H SER C 12 11.666 11.493 8.724 1.00 0.00 H new ATOM 0 HA SER C 12 11.534 11.775 10.914 1.00 0.00 H new ATOM 0 HB2 SER C 12 12.573 13.644 11.879 1.00 0.00 H new ATOM 0 HB3 SER C 12 13.276 13.611 10.274 1.00 0.00 H new ATOM 0 HG SER C 12 11.723 15.202 9.620 1.00 0.00 H new ATOM 3110 N THR D 1 0.626 -8.656 11.531 1.00 0.00 N ATOM 3111 CA THR D 1 0.168 -9.339 10.293 1.00 0.00 C ATOM 3112 C THR D 1 1.329 -10.015 9.575 1.00 0.00 C ATOM 3113 O THR D 1 1.646 -9.674 8.436 1.00 0.00 O ATOM 3114 CB THR D 1 -0.483 -8.306 9.369 1.00 0.00 C ATOM 3115 OG1 THR D 1 0.001 -7.004 9.652 1.00 0.00 O ATOM 3116 CG2 THR D 1 -1.991 -8.269 9.480 1.00 0.00 C ATOM 0 H1 THR D 1 0.009 -8.924 12.324 1.00 0.00 H new ATOM 0 H2 THR D 1 1.604 -8.939 11.742 1.00 0.00 H new ATOM 0 H3 THR D 1 0.586 -7.626 11.394 1.00 0.00 H new ATOM 0 HA THR D 1 -0.553 -10.111 10.563 1.00 0.00 H new ATOM 0 HB THR D 1 -0.217 -8.615 8.358 1.00 0.00 H new ATOM 0 HG1 THR D 1 -0.425 -6.359 9.050 1.00 0.00 H new ATOM 0 HG21 THR D 1 -2.388 -7.516 8.799 1.00 0.00 H new ATOM 0 HG22 THR D 1 -2.399 -9.245 9.219 1.00 0.00 H new ATOM 0 HG23 THR D 1 -2.275 -8.019 10.502 1.00 0.00 H new ATOM 3126 N ARG D 2 1.968 -10.969 10.241 1.00 0.00 N ATOM 3127 CA ARG D 2 3.089 -11.674 9.637 1.00 0.00 C ATOM 3128 C ARG D 2 2.667 -13.045 9.112 1.00 0.00 C ATOM 3129 O ARG D 2 2.539 -13.246 7.904 1.00 0.00 O ATOM 3130 CB ARG D 2 4.222 -11.834 10.653 1.00 0.00 C ATOM 3131 CG ARG D 2 5.121 -10.612 10.760 1.00 0.00 C ATOM 3132 CD ARG D 2 6.106 -10.745 11.912 1.00 0.00 C ATOM 3133 NE ARG D 2 5.532 -10.294 13.178 1.00 0.00 N ATOM 3134 CZ ARG D 2 6.247 -10.071 14.279 1.00 0.00 C ATOM 3135 NH1 ARG D 2 7.562 -10.256 14.274 1.00 0.00 N ATOM 3136 NH2 ARG D 2 5.645 -9.661 15.387 1.00 0.00 N ATOM 0 H ARG D 2 1.733 -11.269 11.187 1.00 0.00 H new ATOM 0 HA ARG D 2 3.440 -11.080 8.793 1.00 0.00 H new ATOM 0 HB2 ARG D 2 3.793 -12.046 11.632 1.00 0.00 H new ATOM 0 HB3 ARG D 2 4.828 -12.697 10.376 1.00 0.00 H new ATOM 0 HG2 ARG D 2 5.667 -10.478 9.826 1.00 0.00 H new ATOM 0 HG3 ARG D 2 4.510 -9.721 10.903 1.00 0.00 H new ATOM 0 HD2 ARG D 2 6.417 -11.786 12.005 1.00 0.00 H new ATOM 0 HD3 ARG D 2 7.001 -10.164 11.692 1.00 0.00 H new ATOM 0 HE ARG D 2 4.524 -10.141 13.221 1.00 0.00 H new ATOM 0 HH11 ARG D 2 8.030 -10.571 13.424 1.00 0.00 H new ATOM 0 HH12 ARG D 2 8.104 -10.084 15.120 1.00 0.00 H new ATOM 0 HH21 ARG D 2 4.635 -9.517 15.395 1.00 0.00 H new ATOM 0 HH22 ARG D 2 6.192 -9.490 16.231 1.00 0.00 H new ATOM 3149 N THR D 3 2.469 -13.988 10.029 1.00 0.00 N ATOM 3150 CA THR D 3 2.079 -15.347 9.663 1.00 0.00 C ATOM 3151 C THR D 3 0.593 -15.629 9.896 1.00 0.00 C ATOM 3152 O THR D 3 0.092 -16.674 9.483 1.00 0.00 O ATOM 3153 CB THR D 3 2.918 -16.359 10.445 1.00 0.00 C ATOM 3154 OG1 THR D 3 2.916 -16.049 11.827 1.00 0.00 O ATOM 3155 CG2 THR D 3 4.360 -16.420 9.990 1.00 0.00 C ATOM 0 H THR D 3 2.572 -13.836 11.032 1.00 0.00 H new ATOM 0 HA THR D 3 2.261 -15.446 8.593 1.00 0.00 H new ATOM 0 HB THR D 3 2.454 -17.327 10.256 1.00 0.00 H new ATOM 0 HG1 THR D 3 3.456 -16.708 12.311 1.00 0.00 H new ATOM 0 HG21 THR D 3 4.899 -17.157 10.586 1.00 0.00 H new ATOM 0 HG22 THR D 3 4.398 -16.705 8.939 1.00 0.00 H new ATOM 0 HG23 THR D 3 4.823 -15.442 10.117 1.00 0.00 H new ATOM 3163 N LYS D 4 -0.107 -14.731 10.587 1.00 0.00 N ATOM 3164 CA LYS D 4 -1.517 -14.956 10.888 1.00 0.00 C ATOM 3165 C LYS D 4 -2.440 -14.169 9.966 1.00 0.00 C ATOM 3166 O LYS D 4 -3.212 -14.757 9.218 1.00 0.00 O ATOM 3167 CB LYS D 4 -1.794 -14.571 12.339 1.00 0.00 C ATOM 3168 CG LYS D 4 -3.204 -14.896 12.793 1.00 0.00 C ATOM 3169 CD LYS D 4 -4.066 -13.645 12.853 1.00 0.00 C ATOM 3170 CE LYS D 4 -5.555 -13.971 12.915 1.00 0.00 C ATOM 3171 NZ LYS D 4 -5.861 -15.364 12.480 1.00 0.00 N ATOM 0 H LYS D 4 0.273 -13.854 10.944 1.00 0.00 H new ATOM 0 HA LYS D 4 -1.722 -16.015 10.728 1.00 0.00 H new ATOM 0 HB2 LYS D 4 -1.085 -15.088 12.985 1.00 0.00 H new ATOM 0 HB3 LYS D 4 -1.618 -13.502 12.463 1.00 0.00 H new ATOM 0 HG2 LYS D 4 -3.652 -15.617 12.109 1.00 0.00 H new ATOM 0 HG3 LYS D 4 -3.173 -15.366 13.776 1.00 0.00 H new ATOM 0 HD2 LYS D 4 -3.788 -13.057 13.728 1.00 0.00 H new ATOM 0 HD3 LYS D 4 -3.868 -13.027 11.977 1.00 0.00 H new ATOM 0 HE2 LYS D 4 -5.911 -13.827 13.935 1.00 0.00 H new ATOM 0 HE3 LYS D 4 -6.102 -13.270 12.285 1.00 0.00 H new ATOM 0 HZ1 LYS D 4 -6.891 -15.483 12.396 1.00 0.00 H new ATOM 0 HZ2 LYS D 4 -5.415 -15.546 11.558 1.00 0.00 H new ATOM 0 HZ3 LYS D 4 -5.491 -16.036 13.182 1.00 0.00 H new ATOM 3185 N ILE D 5 -2.344 -12.841 10.065 1.00 0.00 N ATOM 3186 CA ILE D 5 -3.141 -11.861 9.296 1.00 0.00 C ATOM 3187 C ILE D 5 -4.057 -11.077 10.223 1.00 0.00 C ATOM 3188 O ILE D 5 -5.167 -10.696 9.854 1.00 0.00 O ATOM 3189 CB ILE D 5 -3.972 -12.417 8.089 1.00 0.00 C ATOM 3190 CG1 ILE D 5 -5.353 -12.972 8.503 1.00 0.00 C ATOM 3191 CG2 ILE D 5 -3.196 -13.431 7.261 1.00 0.00 C ATOM 3192 CD1 ILE D 5 -5.385 -13.744 9.804 1.00 0.00 C ATOM 0 H ILE D 5 -1.687 -12.394 10.705 1.00 0.00 H new ATOM 0 HA ILE D 5 -2.386 -11.222 8.839 1.00 0.00 H new ATOM 0 HB ILE D 5 -4.160 -11.553 7.452 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -6.051 -12.139 8.579 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -5.717 -13.622 7.707 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -3.819 -13.783 6.439 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -2.297 -12.962 6.860 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -2.915 -14.275 7.890 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -6.401 -14.087 9.998 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -4.719 -14.604 9.733 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -5.058 -13.098 10.619 1.00 0.00 H new ATOM 3204 N ASP D 6 -3.575 -10.825 11.430 1.00 0.00 N ATOM 3205 CA ASP D 6 -4.347 -10.074 12.409 1.00 0.00 C ATOM 3206 C ASP D 6 -4.480 -8.609 11.996 1.00 0.00 C ATOM 3207 O ASP D 6 -3.891 -7.724 12.619 1.00 0.00 O ATOM 3208 CB ASP D 6 -3.692 -10.169 13.789 1.00 0.00 C ATOM 3209 CG ASP D 6 -2.208 -9.866 13.746 1.00 0.00 C ATOM 3210 OD1 ASP D 6 -1.436 -10.743 13.307 1.00 0.00 O ATOM 3211 OD2 ASP D 6 -1.817 -8.751 14.154 1.00 0.00 O ATOM 0 H ASP D 6 -2.657 -11.128 11.755 1.00 0.00 H new ATOM 0 HA ASP D 6 -5.345 -10.510 12.456 1.00 0.00 H new ATOM 0 HB2 ASP D 6 -4.183 -9.473 14.470 1.00 0.00 H new ATOM 0 HB3 ASP D 6 -3.844 -11.170 14.192 1.00 0.00 H new ATOM 3216 N TRP D 7 -5.267 -8.349 10.948 1.00 0.00 N ATOM 3217 CA TRP D 7 -5.476 -6.981 10.476 1.00 0.00 C ATOM 3218 C TRP D 7 -5.910 -6.094 11.637 1.00 0.00 C ATOM 3219 O TRP D 7 -5.298 -5.062 11.911 1.00 0.00 O ATOM 3220 CB TRP D 7 -6.532 -6.936 9.364 1.00 0.00 C ATOM 3221 CG TRP D 7 -6.307 -7.936 8.268 1.00 0.00 C ATOM 3222 CD1 TRP D 7 -5.186 -8.686 8.058 1.00 0.00 C ATOM 3223 CD2 TRP D 7 -7.229 -8.294 7.228 1.00 0.00 C ATOM 3224 NE1 TRP D 7 -5.359 -9.492 6.958 1.00 0.00 N ATOM 3225 CE2 TRP D 7 -6.603 -9.271 6.434 1.00 0.00 C ATOM 3226 CE3 TRP D 7 -8.524 -7.886 6.894 1.00 0.00 C ATOM 3227 CZ2 TRP D 7 -7.228 -9.847 5.331 1.00 0.00 C ATOM 3228 CZ3 TRP D 7 -9.142 -8.458 5.798 1.00 0.00 C ATOM 3229 CH2 TRP D 7 -8.494 -9.431 5.029 1.00 0.00 C ATOM 0 H TRP D 7 -5.765 -9.062 10.416 1.00 0.00 H new ATOM 0 HA TRP D 7 -4.535 -6.613 10.068 1.00 0.00 H new ATOM 0 HB2 TRP D 7 -7.515 -7.108 9.803 1.00 0.00 H new ATOM 0 HB3 TRP D 7 -6.547 -5.936 8.932 1.00 0.00 H new ATOM 0 HD1 TRP D 7 -4.294 -8.651 8.666 1.00 0.00 H new ATOM 0 HE1 TRP D 7 -4.670 -10.149 6.591 1.00 0.00 H new ATOM 0 HE3 TRP D 7 -9.033 -7.137 7.482 1.00 0.00 H new ATOM 0 HZ2 TRP D 7 -6.729 -10.597 4.735 1.00 0.00 H new ATOM 0 HZ3 TRP D 7 -10.142 -8.149 5.531 1.00 0.00 H new ATOM 0 HH2 TRP D 7 -9.004 -9.862 4.180 1.00 0.00 H new ATOM 3240 N ASN D 8 -6.963 -6.523 12.327 1.00 0.00 N ATOM 3241 CA ASN D 8 -7.482 -5.794 13.477 1.00 0.00 C ATOM 3242 C ASN D 8 -8.669 -6.538 14.097 1.00 0.00 C ATOM 3243 O ASN D 8 -8.480 -7.392 14.961 1.00 0.00 O ATOM 3244 CB ASN D 8 -7.866 -4.362 13.086 1.00 0.00 C ATOM 3245 CG ASN D 8 -7.764 -3.402 14.254 1.00 0.00 C ATOM 3246 OD1 ASN D 8 -6.938 -2.490 14.253 1.00 0.00 O ATOM 3247 ND2 ASN D 8 -8.606 -3.605 15.261 1.00 0.00 N ATOM 0 H ASN D 8 -7.475 -7.377 12.107 1.00 0.00 H new ATOM 0 HA ASN D 8 -6.695 -5.733 14.229 1.00 0.00 H new ATOM 0 HB2 ASN D 8 -7.216 -4.021 12.280 1.00 0.00 H new ATOM 0 HB3 ASN D 8 -8.885 -4.354 12.699 1.00 0.00 H new ATOM 0 HD21 ASN D 8 -8.584 -2.992 16.076 1.00 0.00 H new ATOM 0 HD22 ASN D 8 -9.275 -4.374 15.219 1.00 0.00 H new ATOM 3254 N LYS D 9 -9.888 -6.215 13.667 1.00 0.00 N ATOM 3255 CA LYS D 9 -11.081 -6.866 14.201 1.00 0.00 C ATOM 3256 C LYS D 9 -11.572 -8.000 13.296 1.00 0.00 C ATOM 3257 O LYS D 9 -12.028 -9.035 13.780 1.00 0.00 O ATOM 3258 CB LYS D 9 -12.198 -5.840 14.405 1.00 0.00 C ATOM 3259 CG LYS D 9 -12.859 -5.929 15.771 1.00 0.00 C ATOM 3260 CD LYS D 9 -14.183 -6.674 15.704 1.00 0.00 C ATOM 3261 CE LYS D 9 -15.163 -6.164 16.749 1.00 0.00 C ATOM 3262 NZ LYS D 9 -16.129 -5.188 16.175 1.00 0.00 N ATOM 0 H LYS D 9 -10.074 -5.510 12.954 1.00 0.00 H new ATOM 0 HA LYS D 9 -10.809 -7.304 15.161 1.00 0.00 H new ATOM 0 HB2 LYS D 9 -11.789 -4.838 14.272 1.00 0.00 H new ATOM 0 HB3 LYS D 9 -12.955 -5.980 13.634 1.00 0.00 H new ATOM 0 HG2 LYS D 9 -12.191 -6.436 16.467 1.00 0.00 H new ATOM 0 HG3 LYS D 9 -13.025 -4.925 16.162 1.00 0.00 H new ATOM 0 HD2 LYS D 9 -14.616 -6.559 14.711 1.00 0.00 H new ATOM 0 HD3 LYS D 9 -14.010 -7.740 15.855 1.00 0.00 H new ATOM 0 HE2 LYS D 9 -15.708 -7.005 17.177 1.00 0.00 H new ATOM 0 HE3 LYS D 9 -14.613 -5.694 17.564 1.00 0.00 H new ATOM 0 HZ1 LYS D 9 -16.779 -4.865 16.919 1.00 0.00 H new ATOM 0 HZ2 LYS D 9 -15.611 -4.373 15.789 1.00 0.00 H new ATOM 0 HZ3 LYS D 9 -16.673 -5.644 15.415 1.00 0.00 H new ATOM 3276 N ILE D 10 -11.508 -7.786 11.982 1.00 0.00 N ATOM 3277 CA ILE D 10 -11.981 -8.779 11.018 1.00 0.00 C ATOM 3278 C ILE D 10 -11.304 -10.140 11.199 1.00 0.00 C ATOM 3279 O ILE D 10 -11.974 -11.137 11.465 1.00 0.00 O ATOM 3280 CB ILE D 10 -11.780 -8.294 9.564 1.00 0.00 C ATOM 3281 CG1 ILE D 10 -12.328 -9.330 8.573 1.00 0.00 C ATOM 3282 CG2 ILE D 10 -10.315 -7.994 9.295 1.00 0.00 C ATOM 3283 CD1 ILE D 10 -11.882 -9.112 7.141 1.00 0.00 C ATOM 0 H ILE D 10 -11.134 -6.935 11.561 1.00 0.00 H new ATOM 0 HA ILE D 10 -13.046 -8.902 11.212 1.00 0.00 H new ATOM 0 HB ILE D 10 -12.338 -7.368 9.426 1.00 0.00 H new ATOM 0 HG12 ILE D 10 -12.015 -10.324 8.893 1.00 0.00 H new ATOM 0 HG13 ILE D 10 -13.417 -9.312 8.610 1.00 0.00 H new ATOM 0 HG21 ILE D 10 -10.196 -7.654 8.266 1.00 0.00 H new ATOM 0 HG22 ILE D 10 -9.972 -7.215 9.976 1.00 0.00 H new ATOM 0 HG23 ILE D 10 -9.724 -8.897 9.449 1.00 0.00 H new ATOM 0 HD11 ILE D 10 -12.312 -9.885 6.504 1.00 0.00 H new ATOM 0 HD12 ILE D 10 -12.219 -8.133 6.800 1.00 0.00 H new ATOM 0 HD13 ILE D 10 -10.794 -9.161 7.087 1.00 0.00 H new ATOM 3295 N LEU D 11 -9.983 -10.185 11.052 1.00 0.00 N ATOM 3296 CA LEU D 11 -9.247 -11.430 11.199 1.00 0.00 C ATOM 3297 C LEU D 11 -8.746 -11.594 12.632 1.00 0.00 C ATOM 3298 O LEU D 11 -8.370 -12.689 13.048 1.00 0.00 O ATOM 3299 CB LEU D 11 -8.084 -11.470 10.203 1.00 0.00 C ATOM 3300 CG LEU D 11 -8.440 -12.000 8.809 1.00 0.00 C ATOM 3301 CD1 LEU D 11 -8.787 -13.478 8.867 1.00 0.00 C ATOM 3302 CD2 LEU D 11 -9.585 -11.209 8.199 1.00 0.00 C ATOM 0 H LEU D 11 -9.404 -9.374 10.832 1.00 0.00 H new ATOM 0 HA LEU D 11 -9.916 -12.263 10.983 1.00 0.00 H new ATOM 0 HB2 LEU D 11 -7.680 -10.463 10.100 1.00 0.00 H new ATOM 0 HB3 LEU D 11 -7.291 -12.091 10.619 1.00 0.00 H new ATOM 0 HG LEU D 11 -7.565 -11.876 8.172 1.00 0.00 H new ATOM 0 HD11 LEU D 11 -9.036 -13.833 7.867 1.00 0.00 H new ATOM 0 HD12 LEU D 11 -7.933 -14.038 9.248 1.00 0.00 H new ATOM 0 HD13 LEU D 11 -9.641 -13.626 9.528 1.00 0.00 H new ATOM 0 HD21 LEU D 11 -9.816 -11.607 7.211 1.00 0.00 H new ATOM 0 HD22 LEU D 11 -10.464 -11.291 8.838 1.00 0.00 H new ATOM 0 HD23 LEU D 11 -9.297 -10.162 8.110 1.00 0.00 H new ATOM 3314 N SER D 12 -8.759 -10.493 13.384 1.00 0.00 N ATOM 3315 CA SER D 12 -8.320 -10.500 14.774 1.00 0.00 C ATOM 3316 C SER D 12 -6.854 -10.903 14.893 1.00 0.00 C ATOM 3317 O SER D 12 -6.195 -10.458 15.855 1.00 0.00 O ATOM 3318 CB SER D 12 -9.194 -11.444 15.603 1.00 0.00 C ATOM 3319 OG SER D 12 -8.753 -12.785 15.488 1.00 0.00 O ATOM 3320 OXT SER D 12 -6.377 -11.660 14.023 1.00 0.00 O ATOM 0 H SER D 12 -9.071 -9.582 13.049 1.00 0.00 H new ATOM 0 HA SER D 12 -8.423 -9.486 15.160 1.00 0.00 H new ATOM 0 HB2 SER D 12 -9.171 -11.140 16.649 1.00 0.00 H new ATOM 0 HB3 SER D 12 -10.230 -11.370 15.272 1.00 0.00 H new ATOM 0 HG SER D 12 -8.869 -13.089 14.564 1.00 0.00 H new