USER MOD reduce.3.24.130724 H: found=0, std=0, add=1588, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1592 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 57 MET CE :methyl 137:sc= -3.66! (180deg=-7.36!) USER MOD Set 1.2: B 68 CYS SG : rot 62:sc= -0.387 USER MOD Set 2.1: B 24 LYS NZ :NH3+ 167:sc= -0.845 (180deg=-1.36!) USER MOD Set 2.2: B 25 HIS : no HD1:sc= -0.298 K(o=-1.1,f=-2.2) USER MOD Set 3.1: A 16 GLN : amide:sc= -3.03 X(o=-6,f=-6.2) USER MOD Set 3.2: B 0 MET N :NH3+ 179:sc= -2.98 (180deg=-1.21) USER MOD Set 4.1: A 81 THR OG1 : rot 114:sc= 0.276 USER MOD Set 4.2: B 7 MET CE :methyl 159:sc= -0.236 (180deg=-0.428) USER MOD Set 5.1: A 78 SER OG : rot 2:sc= 0.0667 USER MOD Set 5.2: B 78 SER OG : rot 4:sc= 0.127 USER MOD Set 6.1: A 57 MET CE :methyl 137:sc= -3.56 (180deg=-7.07!) USER MOD Set 6.2: A 68 CYS SG : rot -100:sc= -0.487 USER MOD Set 7.1: A 24 LYS NZ :NH3+ 166:sc= -0.672 (180deg=-1.3!) USER MOD Set 7.2: A 25 HIS : no HD1:sc= -0.263 K(o=-0.94,f=-2.3) USER MOD Set 8.1: A 7 MET CE :methyl 160:sc= -0.293 (180deg=-0.374) USER MOD Set 8.2: B 81 THR OG1 : rot 108:sc= 0.404 USER MOD Set 9.1: A 0 MET N :NH3+ 174:sc= -2.31 (180deg=-0.955) USER MOD Set 9.2: B 16 GLN : amide:sc= -2.9 X(o=-5.2,f=-5.4) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot -66:sc= 0.79 USER MOD Single : A 5 LYS NZ :NH3+ 173:sc= -0.974 (180deg=-0.977) USER MOD Single : A 15 HIS : no HD1:sc= -0.0938 X(o=-0.094,f=-0.095) USER MOD Single : A 17 TYR OH : rot -9:sc= 0.516 USER MOD Single : A 18 SER OG : rot 180:sc= 0.166! USER MOD Single : A 26 LYS NZ :NH3+ -126:sc= -0.917 (180deg=-2.74!) USER MOD Single : A 28 LYS NZ :NH3+ -167:sc= 0.0239 (180deg=0.0119) 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+ -163:sc=-0.00869 (180deg=-0.235) USER MOD Single : A 37 ASN : amide:sc= 0.207 K(o=0.21,f=-1.1) USER MOD Single : A 38 ASN : amide:sc= -1.59! K(o=-1.6!,f=-0.98) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -1.88 K(o=-1.9,f=-8.6!) USER MOD Single : A 48 LYS NZ :NH3+ 153:sc= -2.33! (180deg=-3.17!) USER MOD Single : A 50 GLN : amide:sc= -4.75! C(o=-4.7!,f=-4.1!) USER MOD Single : A 55 LYS NZ :NH3+ -138:sc= -0.246 (180deg=-1.26!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.0232 K(o=-0.023,f=-2!) USER MOD Single : A 74 MET CE :methyl -155:sc= -1.91 (180deg=-4.3!) USER MOD Single : A 79 MET CE :methyl -147:sc= -0.212 (180deg=-1.49!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.0158 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER OG : rot -67:sc= 0.923 USER MOD Single : B 5 LYS NZ :NH3+ -179:sc= -1.01 (180deg=-1.02) USER MOD Single : B 15 HIS : no HD1:sc= -0.101 X(o=-0.1,f=-0.12) USER MOD Single : B 17 TYR OH : rot -9:sc= 0.534 USER MOD Single : B 18 SER OG : rot -143:sc= 0.545! USER MOD Single : B 26 LYS NZ :NH3+ -123:sc= -0.996 (180deg=-2.98!) USER MOD Single : B 28 LYS NZ :NH3+ -167:sc= 0.0306 (180deg=0.0153) 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+ -165:sc= 0 (180deg=-0.141) USER MOD Single : B 37 ASN : amide:sc= 0.0197! K(o=0.02!,f=-1) USER MOD Single : B 38 ASN : amide:sc= -1.63! K(o=-1.6!,f=-0.86) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-9!) USER MOD Single : B 48 LYS NZ :NH3+ -177:sc= -0.845 (180deg=-1.12!) USER MOD Single : B 50 GLN : amide:sc= -4.63! C(o=-4.6!,f=-4.1!) USER MOD Single : B 55 LYS NZ :NH3+ -153:sc= -0.187 (180deg=-1.26!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 GLN : amide:sc= -0.0315 K(o=-0.031,f=-2.1!) USER MOD Single : B 74 MET CE :methyl -155:sc= -1.6 (180deg=-4.35!) USER MOD Single : B 79 MET CE :methyl -140:sc= -0.48 (180deg=-1.72) USER MOD Single : B 82 THR OG1 : rot 180:sc= 0.00966 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : X 105 HIS : no HD1:sc= -5.86! C(o=-5.9!,f=-9.6!) USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.102) USER MOD Single : X 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : X 111 LYS NZ :NH3+ -120:sc= -2.04! (180deg=-2.82!) USER MOD Single : X 112 THR OG1 : rot -26:sc= 0.616 USER MOD Single : Y 105 HIS : no HD1:sc= -5.83! C(o=-5.8!,f=-9.7!) USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0466) USER MOD Single : Y 109 MET CE :methyl -165:sc= 0 (180deg=-0.0551) USER MOD Single : Y 111 LYS NZ :NH3+ -120:sc= -2.31 (180deg=-3.1!) USER MOD Single : Y 112 THR OG1 : rot -30:sc= 0.558 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 1.654 -2.758 -13.686 1.00 0.00 N ATOM 2 CA MET A 0 0.522 -3.243 -14.522 1.00 0.00 C ATOM 3 C MET A 0 -0.647 -2.263 -14.406 1.00 0.00 C ATOM 4 O MET A 0 -1.612 -2.515 -13.714 1.00 0.00 O ATOM 5 CB MET A 0 0.082 -4.633 -14.040 1.00 0.00 C ATOM 6 CG MET A 0 0.086 -4.682 -12.508 1.00 0.00 C ATOM 7 SD MET A 0 -0.420 -6.330 -11.955 1.00 0.00 S ATOM 8 CE MET A 0 -2.202 -6.016 -11.904 1.00 0.00 C ATOM 0 H1 MET A 0 2.412 -3.470 -13.681 1.00 0.00 H new ATOM 0 H2 MET A 0 2.019 -1.867 -14.079 1.00 0.00 H new ATOM 0 H3 MET A 0 1.323 -2.597 -12.713 1.00 0.00 H new ATOM 0 HA MET A 0 0.839 -3.310 -15.563 1.00 0.00 H new ATOM 0 HB2 MET A 0 -0.916 -4.859 -14.417 1.00 0.00 H new ATOM 0 HB3 MET A 0 0.753 -5.394 -14.438 1.00 0.00 H new ATOM 0 HG2 MET A 0 1.081 -4.449 -12.129 1.00 0.00 H new ATOM 0 HG3 MET A 0 -0.592 -3.928 -12.108 1.00 0.00 H new ATOM 0 HE1 MET A 0 -2.721 -6.918 -11.581 1.00 0.00 H new ATOM 0 HE2 MET A 0 -2.409 -5.207 -11.203 1.00 0.00 H new ATOM 0 HE3 MET A 0 -2.550 -5.733 -12.897 1.00 0.00 H new ATOM 20 N SER A 1 -0.565 -1.146 -15.076 1.00 0.00 N ATOM 21 CA SER A 1 -1.672 -0.149 -14.997 1.00 0.00 C ATOM 22 C SER A 1 -1.838 0.303 -13.543 1.00 0.00 C ATOM 23 O SER A 1 -2.920 0.626 -13.095 1.00 0.00 O ATOM 24 CB SER A 1 -2.972 -0.792 -15.488 1.00 0.00 C ATOM 25 OG SER A 1 -3.640 -1.394 -14.388 1.00 0.00 O ATOM 0 H SER A 1 0.218 -0.880 -15.673 1.00 0.00 H new ATOM 0 HA SER A 1 -1.438 0.713 -15.622 1.00 0.00 H new ATOM 0 HB2 SER A 1 -3.612 -0.040 -15.950 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.756 -1.540 -16.251 1.00 0.00 H new ATOM 0 HG SER A 1 -3.109 -2.148 -14.056 1.00 0.00 H new ATOM 31 N GLU A 2 -0.759 0.335 -12.815 1.00 0.00 N ATOM 32 CA GLU A 2 -0.803 0.772 -11.389 1.00 0.00 C ATOM 33 C GLU A 2 -1.120 2.274 -11.338 1.00 0.00 C ATOM 34 O GLU A 2 -1.202 2.876 -10.287 1.00 0.00 O ATOM 35 CB GLU A 2 0.572 0.516 -10.755 1.00 0.00 C ATOM 36 CG GLU A 2 0.466 0.575 -9.231 1.00 0.00 C ATOM 37 CD GLU A 2 1.839 0.318 -8.609 1.00 0.00 C ATOM 38 OE1 GLU A 2 2.737 -0.066 -9.339 1.00 0.00 O ATOM 39 OE2 GLU A 2 1.967 0.503 -7.409 1.00 0.00 O ATOM 0 H GLU A 2 0.168 0.073 -13.151 1.00 0.00 H new ATOM 0 HA GLU A 2 -1.569 0.219 -10.846 1.00 0.00 H new ATOM 0 HB2 GLU A 2 0.948 -0.459 -11.064 1.00 0.00 H new ATOM 0 HB3 GLU A 2 1.288 1.259 -11.107 1.00 0.00 H new ATOM 0 HG2 GLU A 2 0.092 1.551 -8.920 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -0.249 -0.168 -8.877 1.00 0.00 H new ATOM 46 N LEU A 3 -1.249 2.883 -12.480 1.00 0.00 N ATOM 47 CA LEU A 3 -1.502 4.351 -12.544 1.00 0.00 C ATOM 48 C LEU A 3 -2.811 4.712 -11.818 1.00 0.00 C ATOM 49 O LEU A 3 -2.914 5.753 -11.214 1.00 0.00 O ATOM 50 CB LEU A 3 -1.560 4.764 -14.041 1.00 0.00 C ATOM 51 CG LEU A 3 -1.446 6.298 -14.299 1.00 0.00 C ATOM 52 CD1 LEU A 3 -2.827 6.946 -14.255 1.00 0.00 C ATOM 53 CD2 LEU A 3 -0.524 7.003 -13.293 1.00 0.00 C ATOM 0 H LEU A 3 -1.189 2.421 -13.387 1.00 0.00 H new ATOM 0 HA LEU A 3 -0.700 4.892 -12.042 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -0.755 4.259 -14.575 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -2.498 4.407 -14.466 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.006 6.414 -15.289 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -2.733 8.017 -14.437 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.462 6.502 -15.022 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -3.275 6.782 -13.275 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -0.483 8.068 -13.521 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -0.912 6.863 -12.284 1.00 0.00 H new ATOM 0 HD23 LEU A 3 0.478 6.579 -13.359 1.00 0.00 H new ATOM 65 N GLU A 4 -3.811 3.878 -11.874 1.00 0.00 N ATOM 66 CA GLU A 4 -5.105 4.205 -11.178 1.00 0.00 C ATOM 67 C GLU A 4 -4.902 4.387 -9.675 1.00 0.00 C ATOM 68 O GLU A 4 -5.497 5.253 -9.067 1.00 0.00 O ATOM 69 CB GLU A 4 -6.113 3.076 -11.421 1.00 0.00 C ATOM 70 CG GLU A 4 -6.584 3.111 -12.876 1.00 0.00 C ATOM 71 CD GLU A 4 -7.580 1.975 -13.119 1.00 0.00 C ATOM 72 OE1 GLU A 4 -7.733 1.147 -12.236 1.00 0.00 O ATOM 73 OE2 GLU A 4 -8.169 1.950 -14.187 1.00 0.00 O ATOM 0 H GLU A 4 -3.797 2.985 -12.367 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.481 5.143 -11.586 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.655 2.112 -11.200 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.965 3.185 -10.750 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.051 4.071 -13.095 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.731 3.011 -13.548 1.00 0.00 H new ATOM 80 N LYS A 5 -4.094 3.581 -9.063 1.00 0.00 N ATOM 81 CA LYS A 5 -3.889 3.720 -7.593 1.00 0.00 C ATOM 82 C LYS A 5 -2.999 4.922 -7.296 1.00 0.00 C ATOM 83 O LYS A 5 -3.103 5.539 -6.261 1.00 0.00 O ATOM 84 CB LYS A 5 -3.224 2.462 -7.053 1.00 0.00 C ATOM 85 CG LYS A 5 -4.223 1.298 -7.111 1.00 0.00 C ATOM 86 CD LYS A 5 -3.513 -0.026 -6.785 1.00 0.00 C ATOM 87 CE LYS A 5 -2.863 -0.601 -8.051 1.00 0.00 C ATOM 88 NZ LYS A 5 -1.776 -1.542 -7.662 1.00 0.00 N ATOM 0 H LYS A 5 -3.565 2.832 -9.510 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.858 3.864 -7.114 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -2.337 2.225 -7.640 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -2.894 2.623 -6.027 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.033 1.469 -6.402 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.673 1.244 -8.102 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -2.754 0.138 -6.020 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -4.228 -0.740 -6.377 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -3.609 -1.118 -8.654 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.460 0.205 -8.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.413 -2.023 -8.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.005 -1.013 -7.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -2.150 -2.249 -6.997 1.00 0.00 H new ATOM 102 N ALA A 6 -2.090 5.221 -8.176 1.00 0.00 N ATOM 103 CA ALA A 6 -1.154 6.352 -7.932 1.00 0.00 C ATOM 104 C ALA A 6 -1.865 7.704 -8.016 1.00 0.00 C ATOM 105 O ALA A 6 -1.605 8.595 -7.236 1.00 0.00 O ATOM 106 CB ALA A 6 -0.025 6.280 -8.970 1.00 0.00 C ATOM 0 H ALA A 6 -1.953 4.729 -9.059 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.750 6.265 -6.923 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.672 7.102 -8.807 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.502 5.332 -8.869 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.447 6.355 -9.972 1.00 0.00 H new ATOM 112 N MET A 7 -2.751 7.872 -8.946 1.00 0.00 N ATOM 113 CA MET A 7 -3.459 9.178 -9.062 1.00 0.00 C ATOM 114 C MET A 7 -4.401 9.355 -7.881 1.00 0.00 C ATOM 115 O MET A 7 -4.558 10.435 -7.339 1.00 0.00 O ATOM 116 CB MET A 7 -4.261 9.221 -10.367 1.00 0.00 C ATOM 117 CG MET A 7 -3.306 9.309 -11.558 1.00 0.00 C ATOM 118 SD MET A 7 -4.247 9.702 -13.057 1.00 0.00 S ATOM 119 CE MET A 7 -2.966 10.675 -13.893 1.00 0.00 C ATOM 0 H MET A 7 -3.019 7.167 -9.632 1.00 0.00 H new ATOM 0 HA MET A 7 -2.725 9.983 -9.065 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.883 8.330 -10.452 1.00 0.00 H new ATOM 0 HB3 MET A 7 -4.933 10.079 -10.364 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.552 10.075 -11.378 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.777 8.364 -11.685 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.183 10.721 -14.960 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.950 11.684 -13.482 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.994 10.205 -13.740 1.00 0.00 H new ATOM 129 N VAL A 8 -5.037 8.301 -7.490 1.00 0.00 N ATOM 130 CA VAL A 8 -5.991 8.384 -6.354 1.00 0.00 C ATOM 131 C VAL A 8 -5.222 8.612 -5.047 1.00 0.00 C ATOM 132 O VAL A 8 -5.698 9.260 -4.138 1.00 0.00 O ATOM 133 CB VAL A 8 -6.803 7.088 -6.285 1.00 0.00 C ATOM 134 CG1 VAL A 8 -7.682 7.094 -5.033 1.00 0.00 C ATOM 135 CG2 VAL A 8 -7.690 6.984 -7.533 1.00 0.00 C ATOM 0 H VAL A 8 -4.940 7.376 -7.908 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.673 9.222 -6.502 1.00 0.00 H new ATOM 0 HB VAL A 8 -6.125 6.235 -6.242 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.258 6.170 -4.988 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.052 7.172 -4.147 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.363 7.944 -5.071 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.271 6.063 -7.490 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.366 7.838 -7.571 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.064 6.977 -8.425 1.00 0.00 H new ATOM 145 N ALA A 9 -4.045 8.065 -4.949 1.00 0.00 N ATOM 146 CA ALA A 9 -3.236 8.222 -3.704 1.00 0.00 C ATOM 147 C ALA A 9 -2.730 9.659 -3.548 1.00 0.00 C ATOM 148 O ALA A 9 -2.702 10.187 -2.457 1.00 0.00 O ATOM 149 CB ALA A 9 -2.046 7.269 -3.740 1.00 0.00 C ATOM 0 H ALA A 9 -3.602 7.511 -5.682 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.876 7.988 -2.854 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.458 7.387 -2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.404 6.242 -3.810 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -1.424 7.496 -4.606 1.00 0.00 H new ATOM 155 N LEU A 10 -2.313 10.302 -4.606 1.00 0.00 N ATOM 156 CA LEU A 10 -1.807 11.700 -4.444 1.00 0.00 C ATOM 157 C LEU A 10 -2.927 12.552 -3.871 1.00 0.00 C ATOM 158 O LEU A 10 -2.724 13.387 -3.012 1.00 0.00 O ATOM 159 CB LEU A 10 -1.404 12.282 -5.802 1.00 0.00 C ATOM 160 CG LEU A 10 -0.196 11.531 -6.377 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.140 12.100 -7.765 1.00 0.00 C ATOM 162 CD2 LEU A 10 1.017 11.696 -5.446 1.00 0.00 C ATOM 0 H LEU A 10 -2.299 9.932 -5.556 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.940 11.694 -3.784 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.243 12.216 -6.495 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.163 13.339 -5.693 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.437 10.471 -6.462 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.998 11.569 -8.178 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.717 11.975 -8.427 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.378 13.160 -7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.870 11.160 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.263 12.754 -5.353 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.778 11.292 -4.462 1.00 0.00 H new ATOM 174 N ILE A 11 -4.115 12.332 -4.338 1.00 0.00 N ATOM 175 CA ILE A 11 -5.272 13.103 -3.832 1.00 0.00 C ATOM 176 C ILE A 11 -5.527 12.763 -2.358 1.00 0.00 C ATOM 177 O ILE A 11 -5.873 13.624 -1.573 1.00 0.00 O ATOM 178 CB ILE A 11 -6.495 12.799 -4.707 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.278 13.461 -6.077 1.00 0.00 C ATOM 180 CG2 ILE A 11 -7.762 13.352 -4.056 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.338 13.003 -7.085 1.00 0.00 C ATOM 0 H ILE A 11 -4.337 11.643 -5.057 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.066 14.172 -3.887 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.614 11.722 -4.821 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.317 14.545 -5.971 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.285 13.213 -6.451 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.622 13.129 -4.687 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.900 12.890 -3.078 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.669 14.431 -3.937 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.160 13.487 -8.045 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.280 11.921 -7.208 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.329 13.274 -6.720 1.00 0.00 H new ATOM 193 N ASP A 12 -5.379 11.523 -1.970 1.00 0.00 N ATOM 194 CA ASP A 12 -5.634 11.164 -0.541 1.00 0.00 C ATOM 195 C ASP A 12 -4.691 11.938 0.399 1.00 0.00 C ATOM 196 O ASP A 12 -5.111 12.463 1.408 1.00 0.00 O ATOM 197 CB ASP A 12 -5.410 9.660 -0.345 1.00 0.00 C ATOM 198 CG ASP A 12 -6.522 8.872 -1.045 1.00 0.00 C ATOM 199 OD1 ASP A 12 -7.558 9.456 -1.315 1.00 0.00 O ATOM 200 OD2 ASP A 12 -6.316 7.695 -1.301 1.00 0.00 O ATOM 0 H ASP A 12 -5.096 10.750 -2.572 1.00 0.00 H new ATOM 0 HA ASP A 12 -6.664 11.428 -0.300 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.439 9.372 -0.748 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.397 9.421 0.718 1.00 0.00 H new ATOM 205 N VAL A 13 -3.420 11.994 0.080 1.00 0.00 N ATOM 206 CA VAL A 13 -2.431 12.707 0.963 1.00 0.00 C ATOM 207 C VAL A 13 -2.756 14.204 1.058 1.00 0.00 C ATOM 208 O VAL A 13 -2.650 14.808 2.118 1.00 0.00 O ATOM 209 CB VAL A 13 -1.002 12.483 0.386 1.00 0.00 C ATOM 210 CG1 VAL A 13 -0.079 13.681 0.676 1.00 0.00 C ATOM 211 CG2 VAL A 13 -0.372 11.214 1.008 1.00 0.00 C ATOM 0 H VAL A 13 -3.019 11.575 -0.759 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.486 12.303 1.974 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.102 12.369 -0.693 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.909 13.488 0.258 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.496 14.580 0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.004 13.824 1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.627 11.066 0.598 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.307 11.333 2.090 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.992 10.348 0.775 1.00 0.00 H new ATOM 221 N PHE A 14 -3.146 14.808 -0.023 1.00 0.00 N ATOM 222 CA PHE A 14 -3.457 16.257 0.025 1.00 0.00 C ATOM 223 C PHE A 14 -4.507 16.500 1.095 1.00 0.00 C ATOM 224 O PHE A 14 -4.445 17.459 1.818 1.00 0.00 O ATOM 225 CB PHE A 14 -3.977 16.719 -1.336 1.00 0.00 C ATOM 226 CG PHE A 14 -4.344 18.184 -1.266 1.00 0.00 C ATOM 227 CD1 PHE A 14 -3.376 19.167 -1.510 1.00 0.00 C ATOM 228 CD2 PHE A 14 -5.660 18.558 -0.972 1.00 0.00 C ATOM 229 CE1 PHE A 14 -3.726 20.523 -1.461 1.00 0.00 C ATOM 230 CE2 PHE A 14 -6.009 19.914 -0.919 1.00 0.00 C ATOM 231 CZ PHE A 14 -5.042 20.896 -1.164 1.00 0.00 C ATOM 0 H PHE A 14 -3.263 14.364 -0.934 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.556 16.822 0.264 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.217 16.560 -2.101 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.847 16.129 -1.624 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.360 18.880 -1.736 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -6.407 17.801 -0.786 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.980 21.280 -1.652 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -7.024 20.202 -0.689 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.311 21.941 -1.124 1.00 0.00 H new ATOM 241 N HIS A 15 -5.468 15.641 1.203 1.00 0.00 N ATOM 242 CA HIS A 15 -6.521 15.832 2.236 1.00 0.00 C ATOM 243 C HIS A 15 -5.995 15.476 3.635 1.00 0.00 C ATOM 244 O HIS A 15 -6.560 15.888 4.629 1.00 0.00 O ATOM 245 CB HIS A 15 -7.713 14.943 1.905 1.00 0.00 C ATOM 246 CG HIS A 15 -8.799 15.149 2.926 1.00 0.00 C ATOM 247 ND1 HIS A 15 -9.460 16.362 3.073 1.00 0.00 N ATOM 248 CD2 HIS A 15 -9.358 14.303 3.853 1.00 0.00 C ATOM 249 CE1 HIS A 15 -10.371 16.212 4.053 1.00 0.00 C ATOM 250 NE2 HIS A 15 -10.348 14.978 4.559 1.00 0.00 N ATOM 0 H HIS A 15 -5.575 14.810 0.621 1.00 0.00 H new ATOM 0 HA HIS A 15 -6.819 16.881 2.237 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -8.088 15.177 0.909 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -7.406 13.897 1.892 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -9.073 13.273 4.009 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -11.037 16.993 4.388 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -10.934 14.607 5.307 1.00 0.00 H new ATOM 259 N GLN A 16 -4.952 14.689 3.740 1.00 0.00 N ATOM 260 CA GLN A 16 -4.468 14.300 5.097 1.00 0.00 C ATOM 261 C GLN A 16 -4.072 15.529 5.909 1.00 0.00 C ATOM 262 O GLN A 16 -4.341 15.591 7.092 1.00 0.00 O ATOM 263 CB GLN A 16 -3.240 13.389 4.974 1.00 0.00 C ATOM 264 CG GLN A 16 -3.648 12.025 4.418 1.00 0.00 C ATOM 265 CD GLN A 16 -4.550 11.302 5.422 1.00 0.00 C ATOM 266 OE1 GLN A 16 -5.601 10.810 5.062 1.00 0.00 O ATOM 267 NE2 GLN A 16 -4.191 11.228 6.674 1.00 0.00 N ATOM 0 H GLN A 16 -4.423 14.305 2.957 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.281 13.778 5.602 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.500 13.850 4.320 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -2.770 13.266 5.950 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.172 12.151 3.470 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.761 11.425 4.215 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.309 11.641 6.977 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.792 10.757 7.350 1.00 0.00 H new ATOM 276 N TYR A 17 -3.428 16.501 5.309 1.00 0.00 N ATOM 277 CA TYR A 17 -3.009 17.720 6.097 1.00 0.00 C ATOM 278 C TYR A 17 -3.660 18.997 5.540 1.00 0.00 C ATOM 279 O TYR A 17 -3.808 19.974 6.244 1.00 0.00 O ATOM 280 CB TYR A 17 -1.488 17.846 6.043 1.00 0.00 C ATOM 281 CG TYR A 17 -1.068 18.066 4.619 1.00 0.00 C ATOM 282 CD1 TYR A 17 -1.127 17.008 3.709 1.00 0.00 C ATOM 283 CD2 TYR A 17 -0.630 19.327 4.206 1.00 0.00 C ATOM 284 CE1 TYR A 17 -0.753 17.207 2.381 1.00 0.00 C ATOM 285 CE2 TYR A 17 -0.248 19.531 2.878 1.00 0.00 C ATOM 286 CZ TYR A 17 -0.310 18.470 1.960 1.00 0.00 C ATOM 287 OH TYR A 17 0.058 18.668 0.645 1.00 0.00 O ATOM 0 H TYR A 17 -3.174 16.511 4.321 1.00 0.00 H new ATOM 0 HA TYR A 17 -3.340 17.601 7.129 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.156 18.676 6.666 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.021 16.944 6.439 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.463 16.035 4.035 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -0.587 20.143 4.913 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.804 16.390 1.677 1.00 0.00 H new ATOM 0 HE2 TYR A 17 0.095 20.504 2.557 1.00 0.00 H new ATOM 0 HH TYR A 17 0.089 17.806 0.181 1.00 0.00 H new ATOM 297 N SER A 18 -4.047 19.011 4.294 1.00 0.00 N ATOM 298 CA SER A 18 -4.682 20.247 3.730 1.00 0.00 C ATOM 299 C SER A 18 -6.042 20.469 4.393 1.00 0.00 C ATOM 300 O SER A 18 -6.438 21.584 4.665 1.00 0.00 O ATOM 301 CB SER A 18 -4.877 20.112 2.216 1.00 0.00 C ATOM 302 OG SER A 18 -5.964 19.234 1.956 1.00 0.00 O ATOM 0 H SER A 18 -3.955 18.231 3.644 1.00 0.00 H new ATOM 0 HA SER A 18 -4.026 21.095 3.927 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.071 21.090 1.775 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.967 19.729 1.754 1.00 0.00 H new ATOM 0 HG SER A 18 -6.092 19.149 0.988 1.00 0.00 H new ATOM 308 N GLY A 19 -6.762 19.412 4.646 1.00 0.00 N ATOM 309 CA GLY A 19 -8.103 19.552 5.284 1.00 0.00 C ATOM 310 C GLY A 19 -7.936 19.844 6.776 1.00 0.00 C ATOM 311 O GLY A 19 -8.885 20.159 7.468 1.00 0.00 O ATOM 0 H GLY A 19 -6.480 18.454 4.438 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.661 20.357 4.806 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.680 18.638 5.145 1.00 0.00 H new ATOM 315 N ARG A 20 -6.735 19.747 7.275 1.00 0.00 N ATOM 316 CA ARG A 20 -6.501 20.020 8.723 1.00 0.00 C ATOM 317 C ARG A 20 -6.907 21.456 9.048 1.00 0.00 C ATOM 318 O ARG A 20 -7.518 21.720 10.066 1.00 0.00 O ATOM 319 CB ARG A 20 -5.015 19.841 9.029 1.00 0.00 C ATOM 320 CG ARG A 20 -4.738 20.119 10.508 1.00 0.00 C ATOM 321 CD ARG A 20 -3.251 19.927 10.759 1.00 0.00 C ATOM 322 NE ARG A 20 -2.931 20.227 12.183 1.00 0.00 N ATOM 323 CZ ARG A 20 -1.800 19.822 12.689 1.00 0.00 C ATOM 324 NH1 ARG A 20 -0.967 19.142 11.950 1.00 0.00 N ATOM 325 NH2 ARG A 20 -1.500 20.090 13.931 1.00 0.00 N ATOM 0 H ARG A 20 -5.904 19.490 6.743 1.00 0.00 H new ATOM 0 HA ARG A 20 -7.094 19.330 9.324 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -4.705 18.826 8.779 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -4.425 20.516 8.409 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -5.039 21.134 10.766 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.319 19.445 11.137 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -2.963 18.903 10.521 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -2.676 20.580 10.103 1.00 0.00 H new ATOM 0 HE ARG A 20 -3.593 20.747 12.759 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -1.202 18.929 10.980 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -0.081 18.823 12.342 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -2.152 20.619 14.510 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -0.614 19.771 14.322 1.00 0.00 H new ATOM 339 N GLU A 21 -6.559 22.387 8.193 1.00 0.00 N ATOM 340 CA GLU A 21 -6.902 23.826 8.442 1.00 0.00 C ATOM 341 C GLU A 21 -7.907 24.311 7.395 1.00 0.00 C ATOM 342 O GLU A 21 -8.106 23.695 6.367 1.00 0.00 O ATOM 343 CB GLU A 21 -5.631 24.678 8.361 1.00 0.00 C ATOM 344 CG GLU A 21 -4.741 24.368 9.566 1.00 0.00 C ATOM 345 CD GLU A 21 -3.468 25.213 9.498 1.00 0.00 C ATOM 346 OE1 GLU A 21 -3.249 25.834 8.474 1.00 0.00 O ATOM 347 OE2 GLU A 21 -2.734 25.223 10.473 1.00 0.00 O ATOM 0 H GLU A 21 -6.049 22.212 7.327 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.343 23.921 9.434 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.096 24.468 7.435 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.889 25.737 8.347 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.279 24.577 10.491 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -4.485 23.308 9.578 1.00 0.00 H new ATOM 354 N GLY A 22 -8.558 25.408 7.670 1.00 0.00 N ATOM 355 CA GLY A 22 -9.577 25.950 6.727 1.00 0.00 C ATOM 356 C GLY A 22 -9.025 26.006 5.300 1.00 0.00 C ATOM 357 O GLY A 22 -9.774 25.985 4.344 1.00 0.00 O ATOM 0 H GLY A 22 -8.425 25.958 8.518 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.470 25.325 6.752 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -9.878 26.948 7.044 1.00 0.00 H new ATOM 361 N ASP A 23 -7.733 26.085 5.132 1.00 0.00 N ATOM 362 CA ASP A 23 -7.177 26.152 3.757 1.00 0.00 C ATOM 363 C ASP A 23 -7.288 24.777 3.089 1.00 0.00 C ATOM 364 O ASP A 23 -6.335 24.254 2.561 1.00 0.00 O ATOM 365 CB ASP A 23 -5.709 26.579 3.845 1.00 0.00 C ATOM 366 CG ASP A 23 -5.618 28.090 4.084 1.00 0.00 C ATOM 367 OD1 ASP A 23 -6.630 28.761 3.955 1.00 0.00 O ATOM 368 OD2 ASP A 23 -4.535 28.551 4.396 1.00 0.00 O ATOM 0 H ASP A 23 -7.045 26.106 5.884 1.00 0.00 H new ATOM 0 HA ASP A 23 -7.734 26.874 3.161 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -5.214 26.044 4.655 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.189 26.316 2.924 1.00 0.00 H new ATOM 373 N LYS A 24 -8.449 24.186 3.109 1.00 0.00 N ATOM 374 CA LYS A 24 -8.621 22.851 2.466 1.00 0.00 C ATOM 375 C LYS A 24 -8.566 22.998 0.934 1.00 0.00 C ATOM 376 O LYS A 24 -8.011 22.168 0.239 1.00 0.00 O ATOM 377 CB LYS A 24 -9.972 22.264 2.882 1.00 0.00 C ATOM 378 CG LYS A 24 -10.149 20.880 2.249 1.00 0.00 C ATOM 379 CD LYS A 24 -11.389 20.184 2.835 1.00 0.00 C ATOM 380 CE LYS A 24 -12.672 20.802 2.261 1.00 0.00 C ATOM 381 NZ LYS A 24 -12.607 20.802 0.772 1.00 0.00 N ATOM 0 H LYS A 24 -9.289 24.569 3.543 1.00 0.00 H new ATOM 0 HA LYS A 24 -7.819 22.186 2.786 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.028 22.188 3.968 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.779 22.925 2.567 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -10.254 20.977 1.168 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.262 20.273 2.430 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.358 19.119 2.607 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -11.387 20.278 3.921 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -13.541 20.236 2.597 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -12.793 21.821 2.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.552 20.994 0.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.945 21.538 0.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.278 19.873 0.439 1.00 0.00 H new ATOM 395 N HIS A 25 -9.167 24.038 0.404 1.00 0.00 N ATOM 396 CA HIS A 25 -9.187 24.241 -1.082 1.00 0.00 C ATOM 397 C HIS A 25 -7.895 24.918 -1.567 1.00 0.00 C ATOM 398 O HIS A 25 -7.629 24.977 -2.750 1.00 0.00 O ATOM 399 CB HIS A 25 -10.387 25.116 -1.450 1.00 0.00 C ATOM 400 CG HIS A 25 -11.656 24.394 -1.088 1.00 0.00 C ATOM 401 ND1 HIS A 25 -12.274 24.560 0.143 1.00 0.00 N ATOM 402 CD2 HIS A 25 -12.425 23.488 -1.776 1.00 0.00 C ATOM 403 CE1 HIS A 25 -13.364 23.770 0.160 1.00 0.00 C ATOM 404 NE2 HIS A 25 -13.500 23.097 -0.985 1.00 0.00 N ATOM 0 H HIS A 25 -9.648 24.760 0.941 1.00 0.00 H new ATOM 0 HA HIS A 25 -9.264 23.267 -1.565 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -10.333 26.068 -0.922 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -10.374 25.341 -2.516 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -12.226 23.134 -2.777 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -14.044 23.691 0.996 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -14.237 22.435 -1.228 1.00 0.00 H new ATOM 413 N LYS A 26 -7.093 25.425 -0.668 1.00 0.00 N ATOM 414 CA LYS A 26 -5.813 26.100 -1.068 1.00 0.00 C ATOM 415 C LYS A 26 -4.707 25.607 -0.137 1.00 0.00 C ATOM 416 O LYS A 26 -4.980 25.090 0.922 1.00 0.00 O ATOM 417 CB LYS A 26 -5.981 27.620 -0.950 1.00 0.00 C ATOM 418 CG LYS A 26 -6.348 27.990 0.489 1.00 0.00 C ATOM 419 CD LYS A 26 -6.694 29.483 0.572 1.00 0.00 C ATOM 420 CE LYS A 26 -7.995 29.787 -0.193 1.00 0.00 C ATOM 421 NZ LYS A 26 -7.661 30.185 -1.590 1.00 0.00 N ATOM 0 H LYS A 26 -7.268 25.402 0.337 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.555 25.863 -2.100 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.057 28.121 -1.240 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.758 27.964 -1.633 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.196 27.392 0.822 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -5.516 27.763 1.156 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.803 29.778 1.616 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.877 30.074 0.158 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.642 28.910 -0.197 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.545 30.586 0.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.100 31.103 -1.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.629 30.262 -1.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.021 29.467 -2.251 1.00 0.00 H new ATOM 435 N LEU A 27 -3.462 25.725 -0.530 1.00 0.00 N ATOM 436 CA LEU A 27 -2.346 25.220 0.339 1.00 0.00 C ATOM 437 C LEU A 27 -1.377 26.358 0.653 1.00 0.00 C ATOM 438 O LEU A 27 -0.642 26.793 -0.199 1.00 0.00 O ATOM 439 CB LEU A 27 -1.616 24.100 -0.434 1.00 0.00 C ATOM 440 CG LEU A 27 -1.037 23.047 0.530 1.00 0.00 C ATOM 441 CD1 LEU A 27 -2.171 22.251 1.215 1.00 0.00 C ATOM 442 CD2 LEU A 27 -0.146 22.089 -0.269 1.00 0.00 C ATOM 0 H LEU A 27 -3.168 26.147 -1.411 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.738 24.836 1.281 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.308 23.622 -1.127 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.813 24.531 -1.032 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.456 23.549 1.304 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.740 21.513 1.891 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.805 22.934 1.780 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.768 21.744 0.457 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.272 21.337 0.400 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.739 21.599 -1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.664 22.649 -0.736 1.00 0.00 H new ATOM 454 N LYS A 28 -1.343 26.832 1.873 1.00 0.00 N ATOM 455 CA LYS A 28 -0.391 27.931 2.206 1.00 0.00 C ATOM 456 C LYS A 28 0.929 27.324 2.661 1.00 0.00 C ATOM 457 O LYS A 28 0.961 26.243 3.217 1.00 0.00 O ATOM 458 CB LYS A 28 -0.974 28.800 3.325 1.00 0.00 C ATOM 459 CG LYS A 28 -1.563 27.905 4.413 1.00 0.00 C ATOM 460 CD LYS A 28 -1.960 28.760 5.618 1.00 0.00 C ATOM 461 CE LYS A 28 -2.662 27.882 6.655 1.00 0.00 C ATOM 462 NZ LYS A 28 -3.195 28.736 7.751 1.00 0.00 N ATOM 0 H LYS A 28 -1.927 26.509 2.644 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.225 28.552 1.326 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.197 29.438 3.746 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -1.745 29.458 2.924 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.433 27.373 4.029 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.835 27.151 4.713 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.076 29.223 6.056 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.620 29.568 5.303 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.474 27.326 6.186 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.964 27.148 7.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.473 28.137 8.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.461 29.406 8.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -4.024 29.263 7.409 1.00 0.00 H new ATOM 476 N LYS A 29 2.017 28.011 2.418 1.00 0.00 N ATOM 477 CA LYS A 29 3.359 27.491 2.827 1.00 0.00 C ATOM 478 C LYS A 29 3.275 26.809 4.188 1.00 0.00 C ATOM 479 O LYS A 29 4.088 25.977 4.522 1.00 0.00 O ATOM 480 CB LYS A 29 4.343 28.658 2.928 1.00 0.00 C ATOM 481 CG LYS A 29 3.826 29.698 3.933 1.00 0.00 C ATOM 482 CD LYS A 29 4.831 30.858 4.054 1.00 0.00 C ATOM 483 CE LYS A 29 4.635 31.856 2.908 1.00 0.00 C ATOM 484 NZ LYS A 29 5.534 33.027 3.116 1.00 0.00 N ATOM 0 H LYS A 29 2.034 28.917 1.950 1.00 0.00 H new ATOM 0 HA LYS A 29 3.695 26.770 2.082 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.321 28.293 3.241 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.473 29.120 1.949 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.857 30.078 3.610 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.677 29.232 4.907 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.700 31.363 5.011 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.849 30.469 4.036 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.855 31.379 1.953 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.596 32.183 2.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.404 33.707 2.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.303 33.486 4.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.523 32.706 3.133 1.00 0.00 H new ATOM 498 N SER A 30 2.310 27.167 4.984 1.00 0.00 N ATOM 499 CA SER A 30 2.203 26.531 6.330 1.00 0.00 C ATOM 500 C SER A 30 1.711 25.087 6.180 1.00 0.00 C ATOM 501 O SER A 30 2.248 24.177 6.780 1.00 0.00 O ATOM 502 CB SER A 30 1.241 27.323 7.216 1.00 0.00 C ATOM 503 OG SER A 30 1.794 28.604 7.488 1.00 0.00 O ATOM 0 H SER A 30 1.597 27.864 4.768 1.00 0.00 H new ATOM 0 HA SER A 30 3.186 26.529 6.800 1.00 0.00 H new ATOM 0 HB2 SER A 30 0.276 27.429 6.720 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.063 26.787 8.148 1.00 0.00 H new ATOM 0 HG SER A 30 1.177 29.113 8.054 1.00 0.00 H new ATOM 509 N GLU A 31 0.707 24.863 5.373 1.00 0.00 N ATOM 510 CA GLU A 31 0.211 23.473 5.183 1.00 0.00 C ATOM 511 C GLU A 31 1.276 22.661 4.444 1.00 0.00 C ATOM 512 O GLU A 31 1.511 21.509 4.743 1.00 0.00 O ATOM 513 CB GLU A 31 -1.101 23.483 4.393 1.00 0.00 C ATOM 514 CG GLU A 31 -2.218 24.051 5.275 1.00 0.00 C ATOM 515 CD GLU A 31 -3.542 24.057 4.504 1.00 0.00 C ATOM 516 OE1 GLU A 31 -3.573 24.610 3.419 1.00 0.00 O ATOM 517 OE2 GLU A 31 -4.504 23.507 5.016 1.00 0.00 O ATOM 0 H GLU A 31 0.213 25.580 4.841 1.00 0.00 H new ATOM 0 HA GLU A 31 0.018 23.016 6.154 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.992 24.086 3.491 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.354 22.472 4.072 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.318 23.452 6.181 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.966 25.064 5.589 1.00 0.00 H new ATOM 524 N LEU A 32 1.932 23.262 3.489 1.00 0.00 N ATOM 525 CA LEU A 32 2.998 22.537 2.739 1.00 0.00 C ATOM 526 C LEU A 32 4.081 22.095 3.721 1.00 0.00 C ATOM 527 O LEU A 32 4.613 21.014 3.633 1.00 0.00 O ATOM 528 CB LEU A 32 3.603 23.484 1.696 1.00 0.00 C ATOM 529 CG LEU A 32 4.751 22.793 0.948 1.00 0.00 C ATOM 530 CD1 LEU A 32 4.242 21.523 0.247 1.00 0.00 C ATOM 531 CD2 LEU A 32 5.322 23.766 -0.087 1.00 0.00 C ATOM 0 H LEU A 32 1.776 24.226 3.195 1.00 0.00 H new ATOM 0 HA LEU A 32 2.580 21.663 2.239 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.834 23.795 0.988 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.970 24.387 2.185 1.00 0.00 H new ATOM 0 HG LEU A 32 5.528 22.507 1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.067 21.043 -0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.836 20.836 0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.462 21.789 -0.466 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.139 23.286 -0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.540 24.048 -0.791 1.00 0.00 H new ATOM 0 HD23 LEU A 32 5.694 24.657 0.418 1.00 0.00 H new ATOM 543 N LYS A 33 4.400 22.935 4.655 1.00 0.00 N ATOM 544 CA LYS A 33 5.436 22.599 5.674 1.00 0.00 C ATOM 545 C LYS A 33 4.992 21.352 6.446 1.00 0.00 C ATOM 546 O LYS A 33 5.789 20.503 6.792 1.00 0.00 O ATOM 547 CB LYS A 33 5.576 23.800 6.633 1.00 0.00 C ATOM 548 CG LYS A 33 6.463 23.472 7.852 1.00 0.00 C ATOM 549 CD LYS A 33 7.923 23.317 7.426 1.00 0.00 C ATOM 550 CE LYS A 33 8.798 23.172 8.666 1.00 0.00 C ATOM 551 NZ LYS A 33 8.937 24.498 9.328 1.00 0.00 N ATOM 0 H LYS A 33 3.982 23.859 4.762 1.00 0.00 H new ATOM 0 HA LYS A 33 6.396 22.395 5.199 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.002 24.646 6.093 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.588 24.106 6.977 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.377 24.265 8.595 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.116 22.553 8.325 1.00 0.00 H new ATOM 0 HD2 LYS A 33 8.035 22.444 6.784 1.00 0.00 H new ATOM 0 HD3 LYS A 33 8.238 24.183 6.844 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.355 22.453 9.355 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.779 22.786 8.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.742 24.475 9.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 9.100 25.230 8.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 8.066 24.717 9.853 1.00 0.00 H new ATOM 565 N GLU A 34 3.726 21.264 6.748 1.00 0.00 N ATOM 566 CA GLU A 34 3.210 20.106 7.534 1.00 0.00 C ATOM 567 C GLU A 34 3.384 18.805 6.763 1.00 0.00 C ATOM 568 O GLU A 34 3.713 17.790 7.322 1.00 0.00 O ATOM 569 CB GLU A 34 1.729 20.329 7.847 1.00 0.00 C ATOM 570 CG GLU A 34 1.182 19.149 8.657 1.00 0.00 C ATOM 571 CD GLU A 34 -0.281 19.412 9.005 1.00 0.00 C ATOM 572 OE1 GLU A 34 -0.754 20.495 8.707 1.00 0.00 O ATOM 573 OE2 GLU A 34 -0.903 18.522 9.559 1.00 0.00 O ATOM 0 H GLU A 34 3.020 21.951 6.482 1.00 0.00 H new ATOM 0 HA GLU A 34 3.778 20.031 8.461 1.00 0.00 H new ATOM 0 HB2 GLU A 34 1.603 21.255 8.407 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.165 20.437 6.920 1.00 0.00 H new ATOM 0 HG2 GLU A 34 1.271 18.227 8.083 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.766 19.016 9.568 1.00 0.00 H new ATOM 580 N LEU A 35 3.155 18.807 5.493 1.00 0.00 N ATOM 581 CA LEU A 35 3.332 17.540 4.737 1.00 0.00 C ATOM 582 C LEU A 35 4.814 17.182 4.724 1.00 0.00 C ATOM 583 O LEU A 35 5.211 16.066 4.977 1.00 0.00 O ATOM 584 CB LEU A 35 2.835 17.737 3.297 1.00 0.00 C ATOM 585 CG LEU A 35 3.300 16.559 2.392 1.00 0.00 C ATOM 586 CD1 LEU A 35 2.188 16.163 1.421 1.00 0.00 C ATOM 587 CD2 LEU A 35 4.548 16.954 1.582 1.00 0.00 C ATOM 0 H LEU A 35 2.857 19.614 4.945 1.00 0.00 H new ATOM 0 HA LEU A 35 2.763 16.738 5.207 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.747 17.803 3.288 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.215 18.679 2.901 1.00 0.00 H new ATOM 0 HG LEU A 35 3.541 15.716 3.040 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.528 15.338 0.795 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.307 15.852 1.983 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.934 17.016 0.791 1.00 0.00 H new ATOM 0 HD21 LEU A 35 4.856 16.116 0.956 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.316 17.812 0.951 1.00 0.00 H new ATOM 0 HD23 LEU A 35 5.357 17.214 2.264 1.00 0.00 H new ATOM 599 N ILE A 36 5.631 18.126 4.388 1.00 0.00 N ATOM 600 CA ILE A 36 7.085 17.853 4.297 1.00 0.00 C ATOM 601 C ILE A 36 7.707 17.626 5.681 1.00 0.00 C ATOM 602 O ILE A 36 8.529 16.751 5.859 1.00 0.00 O ATOM 603 CB ILE A 36 7.761 19.045 3.615 1.00 0.00 C ATOM 604 CG1 ILE A 36 7.171 19.230 2.213 1.00 0.00 C ATOM 605 CG2 ILE A 36 9.258 18.774 3.488 1.00 0.00 C ATOM 606 CD1 ILE A 36 7.660 20.552 1.616 1.00 0.00 C ATOM 0 H ILE A 36 5.355 19.084 4.170 1.00 0.00 H new ATOM 0 HA ILE A 36 7.235 16.942 3.718 1.00 0.00 H new ATOM 0 HB ILE A 36 7.595 19.944 4.209 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.466 18.399 1.572 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.082 19.223 2.263 1.00 0.00 H new ATOM 0 HG21 ILE A 36 9.741 19.622 3.002 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.687 18.631 4.480 1.00 0.00 H new ATOM 0 HG23 ILE A 36 9.416 17.876 2.891 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.238 20.679 0.619 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.343 21.378 2.252 1.00 0.00 H new ATOM 0 HD13 ILE A 36 8.748 20.541 1.551 1.00 0.00 H new ATOM 618 N ASN A 37 7.360 18.417 6.657 1.00 0.00 N ATOM 619 CA ASN A 37 7.982 18.239 8.002 1.00 0.00 C ATOM 620 C ASN A 37 7.364 17.064 8.759 1.00 0.00 C ATOM 621 O ASN A 37 8.028 16.380 9.512 1.00 0.00 O ATOM 622 CB ASN A 37 7.790 19.517 8.821 1.00 0.00 C ATOM 623 CG ASN A 37 8.617 19.429 10.107 1.00 0.00 C ATOM 624 OD1 ASN A 37 8.080 19.198 11.171 1.00 0.00 O ATOM 625 ND2 ASN A 37 9.910 19.606 10.057 1.00 0.00 N ATOM 0 H ASN A 37 6.679 19.173 6.585 1.00 0.00 H new ATOM 0 HA ASN A 37 9.042 18.031 7.857 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.097 20.385 8.237 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.736 19.652 9.063 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.466 19.550 10.910 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.364 19.800 9.165 1.00 0.00 H new ATOM 632 N ASN A 38 6.089 16.866 8.613 1.00 0.00 N ATOM 633 CA ASN A 38 5.391 15.775 9.380 1.00 0.00 C ATOM 634 C ASN A 38 5.177 14.486 8.567 1.00 0.00 C ATOM 635 O ASN A 38 5.254 13.404 9.113 1.00 0.00 O ATOM 636 CB ASN A 38 4.025 16.291 9.843 1.00 0.00 C ATOM 637 CG ASN A 38 3.499 15.408 10.975 1.00 0.00 C ATOM 638 OD1 ASN A 38 2.601 15.793 11.696 1.00 0.00 O ATOM 639 ND2 ASN A 38 4.027 14.229 11.159 1.00 0.00 N ATOM 0 H ASN A 38 5.487 17.410 7.995 1.00 0.00 H new ATOM 0 HA ASN A 38 6.038 15.519 10.219 1.00 0.00 H new ATOM 0 HB2 ASN A 38 4.111 17.323 10.183 1.00 0.00 H new ATOM 0 HB3 ASN A 38 3.322 16.288 9.010 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.685 13.629 11.910 1.00 0.00 H new ATOM 0 HD22 ASN A 38 4.781 13.908 10.552 1.00 0.00 H new ATOM 646 N GLU A 39 4.867 14.563 7.295 1.00 0.00 N ATOM 647 CA GLU A 39 4.606 13.296 6.527 1.00 0.00 C ATOM 648 C GLU A 39 5.898 12.765 5.903 1.00 0.00 C ATOM 649 O GLU A 39 5.983 11.605 5.552 1.00 0.00 O ATOM 650 CB GLU A 39 3.567 13.559 5.424 1.00 0.00 C ATOM 651 CG GLU A 39 3.128 12.234 4.796 1.00 0.00 C ATOM 652 CD GLU A 39 1.993 12.500 3.805 1.00 0.00 C ATOM 653 OE1 GLU A 39 2.273 13.026 2.739 1.00 0.00 O ATOM 654 OE2 GLU A 39 0.863 12.176 4.129 1.00 0.00 O ATOM 0 H GLU A 39 4.784 15.428 6.761 1.00 0.00 H new ATOM 0 HA GLU A 39 4.221 12.547 7.218 1.00 0.00 H new ATOM 0 HB2 GLU A 39 2.704 14.077 5.841 1.00 0.00 H new ATOM 0 HB3 GLU A 39 3.991 14.211 4.660 1.00 0.00 H new ATOM 0 HG2 GLU A 39 3.969 11.763 4.287 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.796 11.543 5.571 1.00 0.00 H new ATOM 661 N LEU A 40 6.908 13.594 5.766 1.00 0.00 N ATOM 662 CA LEU A 40 8.203 13.127 5.164 1.00 0.00 C ATOM 663 C LEU A 40 9.312 13.179 6.223 1.00 0.00 C ATOM 664 O LEU A 40 10.359 13.757 6.008 1.00 0.00 O ATOM 665 CB LEU A 40 8.590 14.038 3.991 1.00 0.00 C ATOM 666 CG LEU A 40 7.411 14.188 3.018 1.00 0.00 C ATOM 667 CD1 LEU A 40 7.865 14.981 1.782 1.00 0.00 C ATOM 668 CD2 LEU A 40 6.909 12.801 2.591 1.00 0.00 C ATOM 0 H LEU A 40 6.893 14.575 6.045 1.00 0.00 H new ATOM 0 HA LEU A 40 8.080 12.104 4.808 1.00 0.00 H new ATOM 0 HB2 LEU A 40 8.887 15.017 4.366 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.451 13.622 3.468 1.00 0.00 H new ATOM 0 HG LEU A 40 6.600 14.722 3.512 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.029 15.088 1.091 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.210 15.968 2.090 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.679 14.450 1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.073 12.913 1.901 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.716 12.258 2.098 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.582 12.246 3.470 1.00 0.00 H new ATOM 680 N SER A 41 9.089 12.591 7.371 1.00 0.00 N ATOM 681 CA SER A 41 10.132 12.624 8.440 1.00 0.00 C ATOM 682 C SER A 41 11.311 11.708 8.076 1.00 0.00 C ATOM 683 O SER A 41 12.430 12.160 7.931 1.00 0.00 O ATOM 684 CB SER A 41 9.519 12.164 9.764 1.00 0.00 C ATOM 685 OG SER A 41 10.513 12.204 10.779 1.00 0.00 O ATOM 0 H SER A 41 8.233 12.091 7.613 1.00 0.00 H new ATOM 0 HA SER A 41 10.501 13.645 8.537 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.681 12.807 10.033 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.125 11.153 9.664 1.00 0.00 H new ATOM 0 HG SER A 41 10.124 11.912 11.630 1.00 0.00 H new ATOM 691 N HIS A 42 11.079 10.424 7.931 1.00 0.00 N ATOM 692 CA HIS A 42 12.201 9.490 7.581 1.00 0.00 C ATOM 693 C HIS A 42 12.262 9.294 6.065 1.00 0.00 C ATOM 694 O HIS A 42 13.187 8.707 5.539 1.00 0.00 O ATOM 695 CB HIS A 42 11.976 8.134 8.263 1.00 0.00 C ATOM 696 CG HIS A 42 10.560 7.675 8.036 1.00 0.00 C ATOM 697 ND1 HIS A 42 9.782 8.147 6.988 1.00 0.00 N ATOM 698 CD2 HIS A 42 9.765 6.788 8.721 1.00 0.00 C ATOM 699 CE1 HIS A 42 8.579 7.549 7.073 1.00 0.00 C ATOM 700 NE2 HIS A 42 8.519 6.713 8.111 1.00 0.00 N ATOM 0 H HIS A 42 10.166 9.983 8.039 1.00 0.00 H new ATOM 0 HA HIS A 42 13.142 9.919 7.926 1.00 0.00 H new ATOM 0 HB2 HIS A 42 12.674 7.397 7.866 1.00 0.00 H new ATOM 0 HB3 HIS A 42 12.174 8.217 9.332 1.00 0.00 H new ATOM 0 HD2 HIS A 42 10.063 6.234 9.599 1.00 0.00 H new ATOM 0 HE1 HIS A 42 7.764 7.724 6.386 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.725 6.139 8.397 1.00 0.00 H new ATOM 709 N PHE A 43 11.284 9.784 5.362 1.00 0.00 N ATOM 710 CA PHE A 43 11.274 9.638 3.881 1.00 0.00 C ATOM 711 C PHE A 43 12.509 10.354 3.312 1.00 0.00 C ATOM 712 O PHE A 43 13.250 9.812 2.516 1.00 0.00 O ATOM 713 CB PHE A 43 9.980 10.287 3.359 1.00 0.00 C ATOM 714 CG PHE A 43 9.459 9.582 2.124 1.00 0.00 C ATOM 715 CD1 PHE A 43 10.337 9.098 1.140 1.00 0.00 C ATOM 716 CD2 PHE A 43 8.080 9.422 1.962 1.00 0.00 C ATOM 717 CE1 PHE A 43 9.829 8.458 0.004 1.00 0.00 C ATOM 718 CE2 PHE A 43 7.577 8.788 0.832 1.00 0.00 C ATOM 719 CZ PHE A 43 8.448 8.304 -0.151 1.00 0.00 C ATOM 0 H PHE A 43 10.484 10.283 5.751 1.00 0.00 H new ATOM 0 HA PHE A 43 11.306 8.592 3.578 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.220 10.263 4.140 1.00 0.00 H new ATOM 0 HB3 PHE A 43 10.166 11.336 3.128 1.00 0.00 H new ATOM 0 HD1 PHE A 43 11.403 9.220 1.260 1.00 0.00 H new ATOM 0 HD2 PHE A 43 7.403 9.792 2.718 1.00 0.00 H new ATOM 0 HE1 PHE A 43 10.503 8.083 -0.752 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.510 8.668 0.712 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.054 7.812 -1.028 1.00 0.00 H new ATOM 729 N LEU A 44 12.735 11.568 3.737 1.00 0.00 N ATOM 730 CA LEU A 44 13.917 12.336 3.246 1.00 0.00 C ATOM 731 C LEU A 44 14.241 13.455 4.221 1.00 0.00 C ATOM 732 O LEU A 44 13.540 13.673 5.189 1.00 0.00 O ATOM 733 CB LEU A 44 13.649 12.932 1.856 1.00 0.00 C ATOM 734 CG LEU A 44 12.263 13.635 1.787 1.00 0.00 C ATOM 735 CD1 LEU A 44 12.412 15.143 2.042 1.00 0.00 C ATOM 736 CD2 LEU A 44 11.654 13.437 0.390 1.00 0.00 C ATOM 0 H LEU A 44 12.148 12.064 4.408 1.00 0.00 H new ATOM 0 HA LEU A 44 14.762 11.651 3.172 1.00 0.00 H new ATOM 0 HB2 LEU A 44 14.433 13.649 1.610 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.694 12.142 1.107 1.00 0.00 H new ATOM 0 HG LEU A 44 11.618 13.198 2.549 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.433 15.619 1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.842 15.304 3.031 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.067 15.577 1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.683 13.930 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.317 13.868 -0.360 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.530 12.372 0.195 1.00 0.00 H new ATOM 748 N GLU A 45 15.305 14.166 3.979 1.00 0.00 N ATOM 749 CA GLU A 45 15.669 15.263 4.903 1.00 0.00 C ATOM 750 C GLU A 45 14.462 16.176 5.078 1.00 0.00 C ATOM 751 O GLU A 45 14.181 17.030 4.261 1.00 0.00 O ATOM 752 CB GLU A 45 16.837 16.067 4.330 1.00 0.00 C ATOM 753 CG GLU A 45 17.303 17.087 5.370 1.00 0.00 C ATOM 754 CD GLU A 45 17.951 16.361 6.552 1.00 0.00 C ATOM 755 OE1 GLU A 45 18.308 15.206 6.391 1.00 0.00 O ATOM 756 OE2 GLU A 45 18.082 16.975 7.598 1.00 0.00 O ATOM 0 H GLU A 45 15.932 14.033 3.186 1.00 0.00 H new ATOM 0 HA GLU A 45 15.968 14.846 5.865 1.00 0.00 H new ATOM 0 HB2 GLU A 45 17.657 15.400 4.064 1.00 0.00 H new ATOM 0 HB3 GLU A 45 16.530 16.576 3.416 1.00 0.00 H new ATOM 0 HG2 GLU A 45 18.016 17.779 4.921 1.00 0.00 H new ATOM 0 HG3 GLU A 45 16.457 17.681 5.715 1.00 0.00 H new ATOM 763 N GLU A 46 13.751 15.995 6.146 1.00 0.00 N ATOM 764 CA GLU A 46 12.559 16.838 6.404 1.00 0.00 C ATOM 765 C GLU A 46 13.014 18.292 6.580 1.00 0.00 C ATOM 766 O GLU A 46 14.183 18.564 6.771 1.00 0.00 O ATOM 767 CB GLU A 46 11.848 16.314 7.665 1.00 0.00 C ATOM 768 CG GLU A 46 12.512 16.846 8.945 1.00 0.00 C ATOM 769 CD GLU A 46 11.884 16.165 10.162 1.00 0.00 C ATOM 770 OE1 GLU A 46 10.906 15.460 9.981 1.00 0.00 O ATOM 771 OE2 GLU A 46 12.396 16.355 11.253 1.00 0.00 O ATOM 0 H GLU A 46 13.945 15.292 6.859 1.00 0.00 H new ATOM 0 HA GLU A 46 11.858 16.795 5.570 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.800 16.614 7.645 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.867 15.224 7.669 1.00 0.00 H new ATOM 0 HG2 GLU A 46 13.584 16.653 8.919 1.00 0.00 H new ATOM 0 HG3 GLU A 46 12.384 17.926 9.012 1.00 0.00 H new ATOM 778 N ILE A 47 12.110 19.227 6.504 1.00 0.00 N ATOM 779 CA ILE A 47 12.509 20.655 6.656 1.00 0.00 C ATOM 780 C ILE A 47 12.679 21.001 8.135 1.00 0.00 C ATOM 781 O ILE A 47 11.919 20.565 8.977 1.00 0.00 O ATOM 782 CB ILE A 47 11.436 21.564 6.060 1.00 0.00 C ATOM 783 CG1 ILE A 47 11.246 21.251 4.555 1.00 0.00 C ATOM 784 CG2 ILE A 47 11.869 23.022 6.257 1.00 0.00 C ATOM 785 CD1 ILE A 47 12.199 22.083 3.693 1.00 0.00 C ATOM 0 H ILE A 47 11.116 19.066 6.344 1.00 0.00 H new ATOM 0 HA ILE A 47 13.454 20.805 6.133 1.00 0.00 H new ATOM 0 HB ILE A 47 10.483 21.394 6.561 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.422 20.190 4.376 1.00 0.00 H new ATOM 0 HG13 ILE A 47 10.216 21.457 4.265 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.114 23.686 5.837 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.981 23.228 7.322 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.821 23.190 5.753 1.00 0.00 H new ATOM 0 HD11 ILE A 47 12.043 21.842 2.642 1.00 0.00 H new ATOM 0 HD12 ILE A 47 12.004 23.143 3.855 1.00 0.00 H new ATOM 0 HD13 ILE A 47 13.229 21.857 3.968 1.00 0.00 H new ATOM 797 N LYS A 48 13.680 21.781 8.454 1.00 0.00 N ATOM 798 CA LYS A 48 13.927 22.169 9.876 1.00 0.00 C ATOM 799 C LYS A 48 13.530 23.631 10.096 1.00 0.00 C ATOM 800 O LYS A 48 13.358 24.071 11.215 1.00 0.00 O ATOM 801 CB LYS A 48 15.418 21.988 10.174 1.00 0.00 C ATOM 802 CG LYS A 48 15.900 20.629 9.613 1.00 0.00 C ATOM 803 CD LYS A 48 16.533 20.803 8.230 1.00 0.00 C ATOM 804 CE LYS A 48 17.142 19.471 7.799 1.00 0.00 C ATOM 805 NZ LYS A 48 18.224 19.090 8.752 1.00 0.00 N ATOM 0 H LYS A 48 14.343 22.169 7.783 1.00 0.00 H new ATOM 0 HA LYS A 48 13.332 21.543 10.541 1.00 0.00 H new ATOM 0 HB2 LYS A 48 15.990 22.801 9.726 1.00 0.00 H new ATOM 0 HB3 LYS A 48 15.592 22.031 11.249 1.00 0.00 H new ATOM 0 HG2 LYS A 48 16.625 20.185 10.296 1.00 0.00 H new ATOM 0 HG3 LYS A 48 15.059 19.939 9.548 1.00 0.00 H new ATOM 0 HD2 LYS A 48 15.782 21.126 7.509 1.00 0.00 H new ATOM 0 HD3 LYS A 48 17.300 21.577 8.260 1.00 0.00 H new ATOM 0 HE2 LYS A 48 16.374 18.698 7.776 1.00 0.00 H new ATOM 0 HE3 LYS A 48 17.544 19.552 6.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.325 18.055 8.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.121 19.521 8.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 17.982 19.428 9.705 1.00 0.00 H new ATOM 819 N GLU A 49 13.382 24.390 9.036 1.00 0.00 N ATOM 820 CA GLU A 49 12.994 25.832 9.179 1.00 0.00 C ATOM 821 C GLU A 49 11.962 26.209 8.119 1.00 0.00 C ATOM 822 O GLU A 49 11.924 25.652 7.040 1.00 0.00 O ATOM 823 CB GLU A 49 14.227 26.725 8.995 1.00 0.00 C ATOM 824 CG GLU A 49 15.115 26.661 10.232 1.00 0.00 C ATOM 825 CD GLU A 49 14.407 27.318 11.419 1.00 0.00 C ATOM 826 OE1 GLU A 49 13.494 28.094 11.185 1.00 0.00 O ATOM 827 OE2 GLU A 49 14.788 27.033 12.543 1.00 0.00 O ATOM 0 H GLU A 49 13.513 24.073 8.075 1.00 0.00 H new ATOM 0 HA GLU A 49 12.571 25.976 10.173 1.00 0.00 H new ATOM 0 HB2 GLU A 49 14.789 26.404 8.118 1.00 0.00 H new ATOM 0 HB3 GLU A 49 13.916 27.754 8.815 1.00 0.00 H new ATOM 0 HG2 GLU A 49 15.350 25.623 10.467 1.00 0.00 H new ATOM 0 HG3 GLU A 49 16.061 27.166 10.037 1.00 0.00 H new ATOM 834 N GLN A 50 11.141 27.175 8.421 1.00 0.00 N ATOM 835 CA GLN A 50 10.123 27.632 7.439 1.00 0.00 C ATOM 836 C GLN A 50 10.832 28.370 6.304 1.00 0.00 C ATOM 837 O GLN A 50 10.307 28.507 5.222 1.00 0.00 O ATOM 838 CB GLN A 50 9.135 28.585 8.125 1.00 0.00 C ATOM 839 CG GLN A 50 9.871 29.825 8.660 1.00 0.00 C ATOM 840 CD GLN A 50 10.118 30.827 7.525 1.00 0.00 C ATOM 841 OE1 GLN A 50 11.158 31.452 7.470 1.00 0.00 O ATOM 842 NE2 GLN A 50 9.206 31.003 6.607 1.00 0.00 N ATOM 0 H GLN A 50 11.133 27.670 9.313 1.00 0.00 H new ATOM 0 HA GLN A 50 9.579 26.773 7.046 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.363 28.889 7.418 1.00 0.00 H new ATOM 0 HB3 GLN A 50 8.633 28.071 8.944 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.282 30.295 9.447 1.00 0.00 H new ATOM 0 HG3 GLN A 50 10.820 29.529 9.106 1.00 0.00 H new ATOM 0 HE21 GLN A 50 8.331 30.480 6.650 1.00 0.00 H new ATOM 0 HE22 GLN A 50 9.368 31.664 5.847 1.00 0.00 H new ATOM 851 N GLU A 51 12.017 28.868 6.556 1.00 0.00 N ATOM 852 CA GLU A 51 12.758 29.622 5.497 1.00 0.00 C ATOM 853 C GLU A 51 13.028 28.727 4.293 1.00 0.00 C ATOM 854 O GLU A 51 12.925 29.156 3.165 1.00 0.00 O ATOM 855 CB GLU A 51 14.082 30.126 6.080 1.00 0.00 C ATOM 856 CG GLU A 51 15.020 28.931 6.357 1.00 0.00 C ATOM 857 CD GLU A 51 15.919 28.659 5.143 1.00 0.00 C ATOM 858 OE1 GLU A 51 15.587 29.120 4.064 1.00 0.00 O ATOM 859 OE2 GLU A 51 16.921 27.984 5.316 1.00 0.00 O ATOM 0 H GLU A 51 12.503 28.785 7.449 1.00 0.00 H new ATOM 0 HA GLU A 51 12.153 30.466 5.166 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.556 30.819 5.384 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.898 30.677 7.002 1.00 0.00 H new ATOM 0 HG2 GLU A 51 15.635 29.139 7.233 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.430 28.044 6.586 1.00 0.00 H new ATOM 866 N VAL A 52 13.370 27.493 4.515 1.00 0.00 N ATOM 867 CA VAL A 52 13.633 26.589 3.370 1.00 0.00 C ATOM 868 C VAL A 52 12.367 26.492 2.554 1.00 0.00 C ATOM 869 O VAL A 52 12.396 26.469 1.346 1.00 0.00 O ATOM 870 CB VAL A 52 14.029 25.206 3.876 1.00 0.00 C ATOM 871 CG1 VAL A 52 14.320 24.293 2.684 1.00 0.00 C ATOM 872 CG2 VAL A 52 15.271 25.321 4.766 1.00 0.00 C ATOM 0 H VAL A 52 13.478 27.073 5.438 1.00 0.00 H new ATOM 0 HA VAL A 52 14.449 26.979 2.762 1.00 0.00 H new ATOM 0 HB VAL A 52 13.212 24.782 4.460 1.00 0.00 H new ATOM 0 HG11 VAL A 52 14.603 23.304 3.044 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.429 24.211 2.062 1.00 0.00 H new ATOM 0 HG13 VAL A 52 15.136 24.712 2.095 1.00 0.00 H new ATOM 0 HG21 VAL A 52 15.553 24.332 5.127 1.00 0.00 H new ATOM 0 HG22 VAL A 52 16.093 25.745 4.190 1.00 0.00 H new ATOM 0 HG23 VAL A 52 15.051 25.968 5.615 1.00 0.00 H new ATOM 882 N VAL A 53 11.255 26.426 3.215 1.00 0.00 N ATOM 883 CA VAL A 53 9.968 26.328 2.495 1.00 0.00 C ATOM 884 C VAL A 53 9.745 27.592 1.673 1.00 0.00 C ATOM 885 O VAL A 53 9.217 27.538 0.590 1.00 0.00 O ATOM 886 CB VAL A 53 8.837 26.145 3.500 1.00 0.00 C ATOM 887 CG1 VAL A 53 7.523 25.960 2.744 1.00 0.00 C ATOM 888 CG2 VAL A 53 9.118 24.904 4.370 1.00 0.00 C ATOM 0 H VAL A 53 11.182 26.436 4.232 1.00 0.00 H new ATOM 0 HA VAL A 53 9.988 25.470 1.823 1.00 0.00 H new ATOM 0 HB VAL A 53 8.767 27.023 4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.709 25.828 3.457 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.329 26.840 2.130 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.592 25.080 2.105 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.309 24.773 5.089 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.185 24.021 3.734 1.00 0.00 H new ATOM 0 HG23 VAL A 53 10.059 25.039 4.903 1.00 0.00 H new ATOM 898 N ASP A 54 10.137 28.728 2.187 1.00 0.00 N ATOM 899 CA ASP A 54 9.952 30.000 1.431 1.00 0.00 C ATOM 900 C ASP A 54 10.758 29.934 0.130 1.00 0.00 C ATOM 901 O ASP A 54 10.325 30.365 -0.918 1.00 0.00 O ATOM 902 CB ASP A 54 10.440 31.178 2.282 1.00 0.00 C ATOM 903 CG ASP A 54 10.252 32.487 1.513 1.00 0.00 C ATOM 904 OD1 ASP A 54 9.980 32.422 0.326 1.00 0.00 O ATOM 905 OD2 ASP A 54 10.382 33.534 2.126 1.00 0.00 O ATOM 0 H ASP A 54 10.579 28.829 3.101 1.00 0.00 H new ATOM 0 HA ASP A 54 8.896 30.139 1.199 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.887 31.214 3.220 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.491 31.043 2.537 1.00 0.00 H new ATOM 910 N LYS A 55 11.931 29.386 0.200 1.00 0.00 N ATOM 911 CA LYS A 55 12.780 29.269 -1.021 1.00 0.00 C ATOM 912 C LYS A 55 12.081 28.322 -1.988 1.00 0.00 C ATOM 913 O LYS A 55 12.033 28.532 -3.189 1.00 0.00 O ATOM 914 CB LYS A 55 14.152 28.701 -0.635 1.00 0.00 C ATOM 915 CG LYS A 55 15.072 28.689 -1.863 1.00 0.00 C ATOM 916 CD LYS A 55 16.404 28.003 -1.527 1.00 0.00 C ATOM 917 CE LYS A 55 17.336 28.967 -0.780 1.00 0.00 C ATOM 918 NZ LYS A 55 17.563 30.183 -1.610 1.00 0.00 N ATOM 0 H LYS A 55 12.346 29.010 1.053 1.00 0.00 H new ATOM 0 HA LYS A 55 12.923 30.245 -1.486 1.00 0.00 H new ATOM 0 HB2 LYS A 55 14.596 29.304 0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 55 14.040 27.690 -0.243 1.00 0.00 H new ATOM 0 HG2 LYS A 55 14.584 28.167 -2.686 1.00 0.00 H new ATOM 0 HG3 LYS A 55 15.256 29.710 -2.198 1.00 0.00 H new ATOM 0 HD2 LYS A 55 16.220 27.120 -0.915 1.00 0.00 H new ATOM 0 HD3 LYS A 55 16.885 27.661 -2.444 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.897 29.245 0.178 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.286 28.478 -0.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.566 30.454 -1.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.306 29.982 -2.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.976 30.963 -1.251 1.00 0.00 H new ATOM 932 N VAL A 56 11.514 27.287 -1.447 1.00 0.00 N ATOM 933 CA VAL A 56 10.784 26.299 -2.274 1.00 0.00 C ATOM 934 C VAL A 56 9.557 26.989 -2.855 1.00 0.00 C ATOM 935 O VAL A 56 9.070 26.639 -3.911 1.00 0.00 O ATOM 936 CB VAL A 56 10.376 25.121 -1.384 1.00 0.00 C ATOM 937 CG1 VAL A 56 9.352 24.234 -2.094 1.00 0.00 C ATOM 938 CG2 VAL A 56 11.620 24.294 -1.054 1.00 0.00 C ATOM 0 H VAL A 56 11.527 27.081 -0.448 1.00 0.00 H new ATOM 0 HA VAL A 56 11.405 25.922 -3.087 1.00 0.00 H new ATOM 0 HB VAL A 56 9.924 25.508 -0.471 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.077 23.404 -1.444 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.464 24.820 -2.330 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.785 23.845 -3.016 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.340 23.452 -0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.064 23.921 -1.977 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.343 24.918 -0.529 1.00 0.00 H new ATOM 948 N MET A 57 9.061 27.981 -2.167 1.00 0.00 N ATOM 949 CA MET A 57 7.871 28.714 -2.677 1.00 0.00 C ATOM 950 C MET A 57 8.281 29.522 -3.900 1.00 0.00 C ATOM 951 O MET A 57 7.518 29.691 -4.819 1.00 0.00 O ATOM 952 CB MET A 57 7.287 29.638 -1.583 1.00 0.00 C ATOM 953 CG MET A 57 6.177 28.928 -0.766 1.00 0.00 C ATOM 954 SD MET A 57 4.860 30.124 -0.405 1.00 0.00 S ATOM 955 CE MET A 57 3.448 28.987 -0.442 1.00 0.00 C ATOM 0 H MET A 57 9.429 28.314 -1.276 1.00 0.00 H new ATOM 0 HA MET A 57 7.095 28.001 -2.954 1.00 0.00 H new ATOM 0 HB2 MET A 57 8.085 29.957 -0.912 1.00 0.00 H new ATOM 0 HB3 MET A 57 6.880 30.537 -2.045 1.00 0.00 H new ATOM 0 HG2 MET A 57 5.777 28.084 -1.327 1.00 0.00 H new ATOM 0 HG3 MET A 57 6.588 28.528 0.161 1.00 0.00 H new ATOM 0 HE1 MET A 57 2.780 29.210 0.390 1.00 0.00 H new ATOM 0 HE2 MET A 57 2.909 29.106 -1.382 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.805 27.961 -0.356 1.00 0.00 H new ATOM 965 N GLU A 58 9.489 29.997 -3.955 1.00 0.00 N ATOM 966 CA GLU A 58 9.896 30.752 -5.168 1.00 0.00 C ATOM 967 C GLU A 58 9.648 29.828 -6.343 1.00 0.00 C ATOM 968 O GLU A 58 9.261 30.231 -7.422 1.00 0.00 O ATOM 969 CB GLU A 58 11.389 31.074 -5.112 1.00 0.00 C ATOM 970 CG GLU A 58 11.668 31.982 -3.924 1.00 0.00 C ATOM 971 CD GLU A 58 13.162 32.309 -3.862 1.00 0.00 C ATOM 972 OE1 GLU A 58 13.559 33.282 -4.482 1.00 0.00 O ATOM 973 OE2 GLU A 58 13.883 31.585 -3.195 1.00 0.00 O ATOM 0 H GLU A 58 10.200 29.899 -3.230 1.00 0.00 H new ATOM 0 HA GLU A 58 9.341 31.686 -5.248 1.00 0.00 H new ATOM 0 HB2 GLU A 58 11.967 30.154 -5.024 1.00 0.00 H new ATOM 0 HB3 GLU A 58 11.702 31.560 -6.036 1.00 0.00 H new ATOM 0 HG2 GLU A 58 11.088 32.901 -4.013 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.354 31.495 -3.001 1.00 0.00 H new ATOM 980 N THR A 59 9.885 28.573 -6.111 1.00 0.00 N ATOM 981 CA THR A 59 9.693 27.553 -7.167 1.00 0.00 C ATOM 982 C THR A 59 8.227 27.099 -7.277 1.00 0.00 C ATOM 983 O THR A 59 7.681 27.018 -8.359 1.00 0.00 O ATOM 984 CB THR A 59 10.564 26.348 -6.819 1.00 0.00 C ATOM 985 OG1 THR A 59 11.816 26.801 -6.327 1.00 0.00 O ATOM 986 CG2 THR A 59 10.785 25.500 -8.059 1.00 0.00 C ATOM 0 H THR A 59 10.210 28.205 -5.217 1.00 0.00 H new ATOM 0 HA THR A 59 9.972 27.989 -8.126 1.00 0.00 H new ATOM 0 HB THR A 59 10.065 25.748 -6.058 1.00 0.00 H new ATOM 0 HG1 THR A 59 12.377 26.030 -6.101 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.407 24.641 -7.806 1.00 0.00 H new ATOM 0 HG22 THR A 59 9.824 25.153 -8.438 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.283 26.096 -8.824 1.00 0.00 H new ATOM 994 N LEU A 60 7.595 26.759 -6.179 1.00 0.00 N ATOM 995 CA LEU A 60 6.187 26.263 -6.251 1.00 0.00 C ATOM 996 C LEU A 60 5.204 27.421 -6.161 1.00 0.00 C ATOM 997 O LEU A 60 4.040 27.271 -6.473 1.00 0.00 O ATOM 998 CB LEU A 60 5.907 25.303 -5.088 1.00 0.00 C ATOM 999 CG LEU A 60 6.921 24.152 -5.072 1.00 0.00 C ATOM 1000 CD1 LEU A 60 6.506 23.144 -3.997 1.00 0.00 C ATOM 1001 CD2 LEU A 60 6.970 23.458 -6.444 1.00 0.00 C ATOM 0 H LEU A 60 7.992 26.804 -5.241 1.00 0.00 H new ATOM 0 HA LEU A 60 6.062 25.749 -7.204 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.952 25.846 -4.144 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.897 24.902 -5.177 1.00 0.00 H new ATOM 0 HG LEU A 60 7.912 24.548 -4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.220 22.320 -3.976 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.490 23.635 -3.024 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.513 22.758 -4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.694 22.644 -6.414 1.00 0.00 H new ATOM 0 HD22 LEU A 60 5.985 23.058 -6.685 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.265 24.179 -7.206 1.00 0.00 H new ATOM 1013 N ASP A 61 5.634 28.576 -5.746 1.00 0.00 N ATOM 1014 CA ASP A 61 4.662 29.704 -5.665 1.00 0.00 C ATOM 1015 C ASP A 61 4.497 30.263 -7.060 1.00 0.00 C ATOM 1016 O ASP A 61 4.838 31.392 -7.347 1.00 0.00 O ATOM 1017 CB ASP A 61 5.151 30.802 -4.727 1.00 0.00 C ATOM 1018 CG ASP A 61 4.000 31.766 -4.441 1.00 0.00 C ATOM 1019 OD1 ASP A 61 2.949 31.598 -5.039 1.00 0.00 O ATOM 1020 OD2 ASP A 61 4.188 32.656 -3.629 1.00 0.00 O ATOM 0 H ASP A 61 6.591 28.789 -5.465 1.00 0.00 H new ATOM 0 HA ASP A 61 3.715 29.338 -5.268 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.516 30.367 -3.797 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.986 31.337 -5.178 1.00 0.00 H new ATOM 1025 N GLU A 62 3.980 29.456 -7.928 1.00 0.00 N ATOM 1026 CA GLU A 62 3.783 29.890 -9.328 1.00 0.00 C ATOM 1027 C GLU A 62 2.863 31.106 -9.329 1.00 0.00 C ATOM 1028 O GLU A 62 3.068 32.054 -10.061 1.00 0.00 O ATOM 1029 CB GLU A 62 3.142 28.749 -10.110 1.00 0.00 C ATOM 1030 CG GLU A 62 4.022 27.501 -9.992 1.00 0.00 C ATOM 1031 CD GLU A 62 3.384 26.357 -10.780 1.00 0.00 C ATOM 1032 OE1 GLU A 62 2.260 26.526 -11.225 1.00 0.00 O ATOM 1033 OE2 GLU A 62 4.026 25.330 -10.921 1.00 0.00 O ATOM 0 H GLU A 62 3.681 28.502 -7.726 1.00 0.00 H new ATOM 0 HA GLU A 62 4.735 30.151 -9.791 1.00 0.00 H new ATOM 0 HB2 GLU A 62 2.144 28.543 -9.723 1.00 0.00 H new ATOM 0 HB3 GLU A 62 3.026 29.030 -11.157 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.021 27.709 -10.375 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.134 27.219 -8.945 1.00 0.00 H new ATOM 1040 N ASP A 63 1.859 31.097 -8.499 1.00 0.00 N ATOM 1041 CA ASP A 63 0.947 32.268 -8.438 1.00 0.00 C ATOM 1042 C ASP A 63 1.715 33.427 -7.804 1.00 0.00 C ATOM 1043 O ASP A 63 1.367 34.581 -7.957 1.00 0.00 O ATOM 1044 CB ASP A 63 -0.272 31.935 -7.572 1.00 0.00 C ATOM 1045 CG ASP A 63 -1.092 30.826 -8.236 1.00 0.00 C ATOM 1046 OD1 ASP A 63 -1.265 30.882 -9.442 1.00 0.00 O ATOM 1047 OD2 ASP A 63 -1.533 29.938 -7.524 1.00 0.00 O ATOM 0 H ASP A 63 1.632 30.332 -7.863 1.00 0.00 H new ATOM 0 HA ASP A 63 0.605 32.531 -9.439 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.051 31.617 -6.580 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -0.888 32.824 -7.437 1.00 0.00 H new ATOM 1052 N GLY A 64 2.773 33.116 -7.096 1.00 0.00 N ATOM 1053 CA GLY A 64 3.587 34.189 -6.448 1.00 0.00 C ATOM 1054 C GLY A 64 2.760 34.879 -5.360 1.00 0.00 C ATOM 1055 O GLY A 64 2.941 36.051 -5.092 1.00 0.00 O ATOM 0 H GLY A 64 3.107 32.165 -6.939 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.491 33.761 -6.015 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.905 34.918 -7.194 1.00 0.00 H new ATOM 1059 N ASP A 65 1.844 34.170 -4.737 1.00 0.00 N ATOM 1060 CA ASP A 65 0.990 34.791 -3.672 1.00 0.00 C ATOM 1061 C ASP A 65 1.364 34.230 -2.296 1.00 0.00 C ATOM 1062 O ASP A 65 0.633 34.383 -1.338 1.00 0.00 O ATOM 1063 CB ASP A 65 -0.477 34.478 -3.977 1.00 0.00 C ATOM 1064 CG ASP A 65 -0.660 32.966 -4.050 1.00 0.00 C ATOM 1065 OD1 ASP A 65 0.329 32.287 -4.257 1.00 0.00 O ATOM 1066 OD2 ASP A 65 -1.784 32.515 -3.903 1.00 0.00 O ATOM 0 H ASP A 65 1.652 33.185 -4.922 1.00 0.00 H new ATOM 0 HA ASP A 65 1.149 35.869 -3.660 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.120 34.898 -3.203 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.771 34.938 -4.920 1.00 0.00 H new ATOM 1071 N GLY A 66 2.482 33.566 -2.187 1.00 0.00 N ATOM 1072 CA GLY A 66 2.870 32.985 -0.868 1.00 0.00 C ATOM 1073 C GLY A 66 1.946 31.802 -0.574 1.00 0.00 C ATOM 1074 O GLY A 66 1.817 31.353 0.547 1.00 0.00 O ATOM 0 H GLY A 66 3.141 33.401 -2.948 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.910 32.659 -0.888 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.787 33.736 -0.083 1.00 0.00 H new ATOM 1078 N GLU A 67 1.298 31.314 -1.593 1.00 0.00 N ATOM 1079 CA GLU A 67 0.359 30.169 -1.458 1.00 0.00 C ATOM 1080 C GLU A 67 0.324 29.417 -2.794 1.00 0.00 C ATOM 1081 O GLU A 67 0.307 30.019 -3.845 1.00 0.00 O ATOM 1082 CB GLU A 67 -1.035 30.713 -1.127 1.00 0.00 C ATOM 1083 CG GLU A 67 -2.056 29.577 -1.068 1.00 0.00 C ATOM 1084 CD GLU A 67 -3.402 30.146 -0.627 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -3.620 30.223 0.570 1.00 0.00 O ATOM 1086 OE2 GLU A 67 -4.188 30.499 -1.491 1.00 0.00 O ATOM 0 H GLU A 67 1.384 31.674 -2.544 1.00 0.00 H new ATOM 0 HA GLU A 67 0.679 29.494 -0.664 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.010 31.236 -0.171 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.336 31.441 -1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -2.149 29.102 -2.045 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.725 28.808 -0.370 1.00 0.00 H new ATOM 1093 N CYS A 68 0.309 28.110 -2.767 1.00 0.00 N ATOM 1094 CA CYS A 68 0.271 27.315 -4.037 1.00 0.00 C ATOM 1095 C CYS A 68 -1.065 26.572 -4.090 1.00 0.00 C ATOM 1096 O CYS A 68 -1.566 26.094 -3.092 1.00 0.00 O ATOM 1097 CB CYS A 68 1.465 26.323 -4.079 1.00 0.00 C ATOM 1098 SG CYS A 68 2.588 26.647 -2.693 1.00 0.00 S ATOM 0 H CYS A 68 0.321 27.552 -1.913 1.00 0.00 H new ATOM 0 HA CYS A 68 0.358 27.970 -4.904 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.099 25.298 -4.029 1.00 0.00 H new ATOM 0 HB3 CYS A 68 2.000 26.425 -5.023 1.00 0.00 H new ATOM 0 HG CYS A 68 3.605 27.340 -3.111 1.00 0.00 H new ATOM 1104 N ASP A 69 -1.645 26.480 -5.246 1.00 0.00 N ATOM 1105 CA ASP A 69 -2.948 25.780 -5.372 1.00 0.00 C ATOM 1106 C ASP A 69 -2.715 24.284 -5.287 1.00 0.00 C ATOM 1107 O ASP A 69 -1.618 23.809 -5.506 1.00 0.00 O ATOM 1108 CB ASP A 69 -3.584 26.117 -6.719 1.00 0.00 C ATOM 1109 CG ASP A 69 -4.040 27.576 -6.725 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -4.464 28.048 -5.683 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -3.964 28.194 -7.774 1.00 0.00 O ATOM 0 H ASP A 69 -1.272 26.861 -6.115 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.614 26.099 -4.570 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.868 25.947 -7.523 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.434 25.460 -6.905 1.00 0.00 H new ATOM 1116 N PHE A 70 -3.738 23.531 -4.985 1.00 0.00 N ATOM 1117 CA PHE A 70 -3.582 22.063 -4.904 1.00 0.00 C ATOM 1118 C PHE A 70 -2.804 21.603 -6.141 1.00 0.00 C ATOM 1119 O PHE A 70 -1.985 20.719 -6.074 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.982 21.436 -4.853 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.936 19.983 -5.255 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -3.954 19.141 -4.728 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.883 19.479 -6.150 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -3.916 17.799 -5.098 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -5.846 18.136 -6.522 1.00 0.00 C ATOM 1126 CZ PHE A 70 -4.860 17.293 -5.997 1.00 0.00 C ATOM 0 H PHE A 70 -4.677 23.878 -4.791 1.00 0.00 H new ATOM 0 HA PHE A 70 -3.034 21.758 -4.013 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -5.389 21.526 -3.846 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.653 21.980 -5.518 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -3.224 19.531 -4.034 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.644 20.130 -6.554 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.157 17.148 -4.690 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.577 17.747 -7.215 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.828 16.253 -6.286 1.00 0.00 H new ATOM 1136 N GLN A 71 -3.049 22.231 -7.257 1.00 0.00 N ATOM 1137 CA GLN A 71 -2.319 21.883 -8.508 1.00 0.00 C ATOM 1138 C GLN A 71 -0.807 22.097 -8.332 1.00 0.00 C ATOM 1139 O GLN A 71 -0.013 21.242 -8.667 1.00 0.00 O ATOM 1140 CB GLN A 71 -2.835 22.781 -9.643 1.00 0.00 C ATOM 1141 CG GLN A 71 -1.946 22.634 -10.879 1.00 0.00 C ATOM 1142 CD GLN A 71 -2.631 23.289 -12.079 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -3.814 23.563 -12.044 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -1.933 23.553 -13.149 1.00 0.00 N ATOM 0 H GLN A 71 -3.733 22.981 -7.357 1.00 0.00 H new ATOM 0 HA GLN A 71 -2.492 20.833 -8.744 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -3.862 22.512 -9.891 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.847 23.821 -9.317 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.977 23.100 -10.701 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.760 21.580 -11.083 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.940 23.323 -13.179 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -2.381 23.989 -13.955 1.00 0.00 H new ATOM 1153 N GLU A 72 -0.399 23.237 -7.837 1.00 0.00 N ATOM 1154 CA GLU A 72 1.061 23.502 -7.684 1.00 0.00 C ATOM 1155 C GLU A 72 1.688 22.460 -6.752 1.00 0.00 C ATOM 1156 O GLU A 72 2.776 21.969 -6.985 1.00 0.00 O ATOM 1157 CB GLU A 72 1.251 24.903 -7.106 1.00 0.00 C ATOM 1158 CG GLU A 72 0.848 25.943 -8.155 1.00 0.00 C ATOM 1159 CD GLU A 72 0.797 27.331 -7.511 1.00 0.00 C ATOM 1160 OE1 GLU A 72 1.853 27.883 -7.250 1.00 0.00 O ATOM 1161 OE2 GLU A 72 -0.300 27.817 -7.287 1.00 0.00 O ATOM 0 H GLU A 72 -1.012 23.993 -7.533 1.00 0.00 H new ATOM 0 HA GLU A 72 1.550 23.437 -8.656 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.646 25.023 -6.207 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.290 25.050 -6.813 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.562 25.939 -8.978 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.125 25.691 -8.576 1.00 0.00 H new ATOM 1168 N PHE A 73 1.000 22.111 -5.710 1.00 0.00 N ATOM 1169 CA PHE A 73 1.525 21.090 -4.762 1.00 0.00 C ATOM 1170 C PHE A 73 1.715 19.762 -5.502 1.00 0.00 C ATOM 1171 O PHE A 73 2.660 19.033 -5.272 1.00 0.00 O ATOM 1172 CB PHE A 73 0.526 20.911 -3.603 1.00 0.00 C ATOM 1173 CG PHE A 73 0.765 19.582 -2.916 1.00 0.00 C ATOM 1174 CD1 PHE A 73 1.910 19.388 -2.133 1.00 0.00 C ATOM 1175 CD2 PHE A 73 -0.149 18.535 -3.091 1.00 0.00 C ATOM 1176 CE1 PHE A 73 2.136 18.148 -1.522 1.00 0.00 C ATOM 1177 CE2 PHE A 73 0.079 17.297 -2.485 1.00 0.00 C ATOM 1178 CZ PHE A 73 1.221 17.102 -1.700 1.00 0.00 C ATOM 0 H PHE A 73 0.085 22.492 -5.468 1.00 0.00 H new ATOM 0 HA PHE A 73 2.485 21.415 -4.360 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.637 21.725 -2.887 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.495 20.956 -3.981 1.00 0.00 H new ATOM 0 HD1 PHE A 73 2.617 20.193 -2.001 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -1.031 18.685 -3.695 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.016 17.998 -0.914 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -0.626 16.491 -2.622 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.397 16.145 -1.231 1.00 0.00 H new ATOM 1188 N MET A 74 0.798 19.438 -6.363 1.00 0.00 N ATOM 1189 CA MET A 74 0.869 18.151 -7.102 1.00 0.00 C ATOM 1190 C MET A 74 2.143 18.066 -7.932 1.00 0.00 C ATOM 1191 O MET A 74 2.748 17.018 -8.048 1.00 0.00 O ATOM 1192 CB MET A 74 -0.347 18.018 -8.020 1.00 0.00 C ATOM 1193 CG MET A 74 -1.596 17.733 -7.182 1.00 0.00 C ATOM 1194 SD MET A 74 -1.468 16.086 -6.430 1.00 0.00 S ATOM 1195 CE MET A 74 -1.524 15.118 -7.953 1.00 0.00 C ATOM 0 H MET A 74 -0.010 20.018 -6.590 1.00 0.00 H new ATOM 0 HA MET A 74 0.876 17.339 -6.375 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.484 18.934 -8.594 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.187 17.213 -8.738 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.705 18.490 -6.405 1.00 0.00 H new ATOM 0 HG3 MET A 74 -2.486 17.789 -7.809 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.898 14.118 -7.735 1.00 0.00 H new ATOM 0 HE2 MET A 74 -2.186 15.605 -8.669 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.522 15.046 -8.376 1.00 0.00 H new ATOM 1205 N ALA A 75 2.546 19.133 -8.544 1.00 0.00 N ATOM 1206 CA ALA A 75 3.767 19.053 -9.384 1.00 0.00 C ATOM 1207 C ALA A 75 4.996 18.774 -8.517 1.00 0.00 C ATOM 1208 O ALA A 75 5.917 18.099 -8.927 1.00 0.00 O ATOM 1209 CB ALA A 75 3.955 20.360 -10.173 1.00 0.00 C ATOM 0 H ALA A 75 2.093 20.046 -8.503 1.00 0.00 H new ATOM 0 HA ALA A 75 3.650 18.231 -10.090 1.00 0.00 H new ATOM 0 HB1 ALA A 75 4.854 20.289 -10.785 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.090 20.525 -10.816 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.054 21.194 -9.478 1.00 0.00 H new ATOM 1215 N PHE A 76 5.022 19.287 -7.330 1.00 0.00 N ATOM 1216 CA PHE A 76 6.195 19.051 -6.439 1.00 0.00 C ATOM 1217 C PHE A 76 6.374 17.561 -6.172 1.00 0.00 C ATOM 1218 O PHE A 76 7.465 17.067 -6.028 1.00 0.00 O ATOM 1219 CB PHE A 76 5.972 19.788 -5.121 1.00 0.00 C ATOM 1220 CG PHE A 76 7.139 19.538 -4.191 1.00 0.00 C ATOM 1221 CD1 PHE A 76 8.426 19.956 -4.553 1.00 0.00 C ATOM 1222 CD2 PHE A 76 6.935 18.885 -2.967 1.00 0.00 C ATOM 1223 CE1 PHE A 76 9.507 19.720 -3.694 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.015 18.652 -2.108 1.00 0.00 C ATOM 1225 CZ PHE A 76 9.301 19.069 -2.471 1.00 0.00 C ATOM 0 H PHE A 76 4.282 19.863 -6.929 1.00 0.00 H new ATOM 0 HA PHE A 76 7.096 19.423 -6.927 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.864 20.857 -5.305 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.046 19.450 -4.657 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.585 20.460 -5.495 1.00 0.00 H new ATOM 0 HD2 PHE A 76 5.943 18.562 -2.687 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.500 20.040 -3.975 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.856 18.150 -1.165 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.134 18.889 -1.808 1.00 0.00 H new ATOM 1235 N VAL A 77 5.304 16.860 -6.067 1.00 0.00 N ATOM 1236 CA VAL A 77 5.380 15.401 -5.771 1.00 0.00 C ATOM 1237 C VAL A 77 5.981 14.654 -6.962 1.00 0.00 C ATOM 1238 O VAL A 77 6.666 13.668 -6.804 1.00 0.00 O ATOM 1239 CB VAL A 77 3.963 14.861 -5.479 1.00 0.00 C ATOM 1240 CG1 VAL A 77 4.018 13.736 -4.434 1.00 0.00 C ATOM 1241 CG2 VAL A 77 3.093 16.001 -4.957 1.00 0.00 C ATOM 0 H VAL A 77 4.359 17.229 -6.173 1.00 0.00 H new ATOM 0 HA VAL A 77 6.016 15.246 -4.900 1.00 0.00 H new ATOM 0 HB VAL A 77 3.540 14.458 -6.399 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.010 13.369 -4.242 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.636 12.920 -4.810 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.447 14.120 -3.508 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.090 15.627 -4.748 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.529 16.401 -4.042 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.038 16.789 -5.708 1.00 0.00 H new ATOM 1251 N SER A 78 5.699 15.098 -8.150 1.00 0.00 N ATOM 1252 CA SER A 78 6.228 14.393 -9.349 1.00 0.00 C ATOM 1253 C SER A 78 7.748 14.524 -9.421 1.00 0.00 C ATOM 1254 O SER A 78 8.438 13.594 -9.788 1.00 0.00 O ATOM 1255 CB SER A 78 5.602 14.991 -10.611 1.00 0.00 C ATOM 1256 OG SER A 78 5.642 16.409 -10.528 1.00 0.00 O ATOM 0 H SER A 78 5.125 15.918 -8.345 1.00 0.00 H new ATOM 0 HA SER A 78 5.971 13.336 -9.276 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.142 14.652 -11.495 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.572 14.650 -10.717 1.00 0.00 H new ATOM 0 HG SER A 78 6.091 16.676 -9.699 1.00 0.00 H new ATOM 1262 N MET A 79 8.280 15.674 -9.107 1.00 0.00 N ATOM 1263 CA MET A 79 9.761 15.837 -9.200 1.00 0.00 C ATOM 1264 C MET A 79 10.477 15.135 -8.039 1.00 0.00 C ATOM 1265 O MET A 79 11.510 14.523 -8.228 1.00 0.00 O ATOM 1266 CB MET A 79 10.114 17.328 -9.216 1.00 0.00 C ATOM 1267 CG MET A 79 9.479 18.023 -8.013 1.00 0.00 C ATOM 1268 SD MET A 79 9.713 19.811 -8.147 1.00 0.00 S ATOM 1269 CE MET A 79 11.520 19.800 -8.102 1.00 0.00 C ATOM 0 H MET A 79 7.764 16.497 -8.795 1.00 0.00 H new ATOM 0 HA MET A 79 10.099 15.372 -10.126 1.00 0.00 H new ATOM 0 HB2 MET A 79 11.196 17.455 -9.192 1.00 0.00 H new ATOM 0 HB3 MET A 79 9.760 17.785 -10.140 1.00 0.00 H new ATOM 0 HG2 MET A 79 8.416 17.788 -7.965 1.00 0.00 H new ATOM 0 HG3 MET A 79 9.928 17.656 -7.090 1.00 0.00 H new ATOM 0 HE1 MET A 79 11.877 20.700 -7.602 1.00 0.00 H new ATOM 0 HE2 MET A 79 11.865 18.921 -7.557 1.00 0.00 H new ATOM 0 HE3 MET A 79 11.909 19.772 -9.120 1.00 0.00 H new ATOM 1279 N VAL A 80 9.955 15.204 -6.843 1.00 0.00 N ATOM 1280 CA VAL A 80 10.649 14.522 -5.704 1.00 0.00 C ATOM 1281 C VAL A 80 10.604 13.014 -5.919 1.00 0.00 C ATOM 1282 O VAL A 80 11.531 12.293 -5.598 1.00 0.00 O ATOM 1283 CB VAL A 80 9.971 14.845 -4.371 1.00 0.00 C ATOM 1284 CG1 VAL A 80 10.758 14.177 -3.242 1.00 0.00 C ATOM 1285 CG2 VAL A 80 9.958 16.353 -4.143 1.00 0.00 C ATOM 0 H VAL A 80 9.093 15.694 -6.604 1.00 0.00 H new ATOM 0 HA VAL A 80 11.679 14.878 -5.671 1.00 0.00 H new ATOM 0 HB VAL A 80 8.945 14.477 -4.389 1.00 0.00 H new ATOM 0 HG11 VAL A 80 10.284 14.400 -2.286 1.00 0.00 H new ATOM 0 HG12 VAL A 80 10.772 13.098 -3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 80 11.780 14.556 -3.237 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.473 16.573 -3.192 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.982 16.727 -4.124 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.410 16.838 -4.950 1.00 0.00 H new ATOM 1295 N THR A 81 9.520 12.538 -6.450 1.00 0.00 N ATOM 1296 CA THR A 81 9.370 11.078 -6.687 1.00 0.00 C ATOM 1297 C THR A 81 10.469 10.617 -7.621 1.00 0.00 C ATOM 1298 O THR A 81 11.048 9.564 -7.452 1.00 0.00 O ATOM 1299 CB THR A 81 8.022 10.799 -7.342 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.975 11.217 -6.484 1.00 0.00 O ATOM 1301 CG2 THR A 81 7.906 9.302 -7.645 1.00 0.00 C ATOM 0 H THR A 81 8.720 13.103 -6.734 1.00 0.00 H new ATOM 0 HA THR A 81 9.432 10.548 -5.736 1.00 0.00 H new ATOM 0 HB THR A 81 7.945 11.356 -8.276 1.00 0.00 H new ATOM 0 HG1 THR A 81 6.491 11.963 -6.897 1.00 0.00 H new ATOM 0 HG21 THR A 81 6.943 9.099 -8.114 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.708 9.004 -8.320 1.00 0.00 H new ATOM 0 HG23 THR A 81 7.984 8.736 -6.717 1.00 0.00 H new ATOM 1309 N THR A 82 10.770 11.402 -8.604 1.00 0.00 N ATOM 1310 CA THR A 82 11.841 11.017 -9.549 1.00 0.00 C ATOM 1311 C THR A 82 13.104 10.754 -8.729 1.00 0.00 C ATOM 1312 O THR A 82 13.836 9.808 -8.965 1.00 0.00 O ATOM 1313 CB THR A 82 12.071 12.166 -10.529 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.816 12.615 -11.020 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.920 11.681 -11.699 1.00 0.00 C ATOM 0 H THR A 82 10.320 12.297 -8.796 1.00 0.00 H new ATOM 0 HA THR A 82 11.573 10.125 -10.115 1.00 0.00 H new ATOM 0 HB THR A 82 12.586 12.980 -10.020 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.956 13.354 -11.648 1.00 0.00 H new ATOM 0 HG21 THR A 82 13.082 12.503 -12.396 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.881 11.325 -11.328 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.404 10.868 -12.210 1.00 0.00 H new ATOM 1323 N ALA A 83 13.336 11.562 -7.731 1.00 0.00 N ATOM 1324 CA ALA A 83 14.515 11.338 -6.856 1.00 0.00 C ATOM 1325 C ALA A 83 14.364 9.955 -6.228 1.00 0.00 C ATOM 1326 O ALA A 83 15.321 9.240 -6.023 1.00 0.00 O ATOM 1327 CB ALA A 83 14.549 12.399 -5.748 1.00 0.00 C ATOM 0 H ALA A 83 12.759 12.366 -7.486 1.00 0.00 H new ATOM 0 HA ALA A 83 15.437 11.406 -7.433 1.00 0.00 H new ATOM 0 HB1 ALA A 83 15.416 12.230 -5.109 1.00 0.00 H new ATOM 0 HB2 ALA A 83 14.616 13.391 -6.196 1.00 0.00 H new ATOM 0 HB3 ALA A 83 13.639 12.331 -5.151 1.00 0.00 H new ATOM 1333 N CYS A 84 13.148 9.588 -5.923 1.00 0.00 N ATOM 1334 CA CYS A 84 12.884 8.261 -5.303 1.00 0.00 C ATOM 1335 C CYS A 84 13.366 7.151 -6.242 1.00 0.00 C ATOM 1336 O CYS A 84 13.845 6.127 -5.804 1.00 0.00 O ATOM 1337 CB CYS A 84 11.379 8.111 -5.050 1.00 0.00 C ATOM 1338 SG CYS A 84 11.115 6.881 -3.752 1.00 0.00 S ATOM 0 H CYS A 84 12.318 10.160 -6.080 1.00 0.00 H new ATOM 0 HA CYS A 84 13.420 8.185 -4.357 1.00 0.00 H new ATOM 0 HB2 CYS A 84 10.951 9.068 -4.753 1.00 0.00 H new ATOM 0 HB3 CYS A 84 10.873 7.806 -5.966 1.00 0.00 H new ATOM 0 HG CYS A 84 9.841 6.750 -3.531 1.00 0.00 H new ATOM 1344 N HIS A 85 13.249 7.339 -7.529 1.00 0.00 N ATOM 1345 CA HIS A 85 13.713 6.277 -8.467 1.00 0.00 C ATOM 1346 C HIS A 85 15.195 6.039 -8.231 1.00 0.00 C ATOM 1347 O HIS A 85 15.666 4.918 -8.219 1.00 0.00 O ATOM 1348 CB HIS A 85 13.500 6.745 -9.909 1.00 0.00 C ATOM 1349 CG HIS A 85 14.036 5.712 -10.863 1.00 0.00 C ATOM 1350 ND1 HIS A 85 15.195 5.920 -11.602 1.00 0.00 N ATOM 1351 CD2 HIS A 85 13.593 4.460 -11.208 1.00 0.00 C ATOM 1352 CE1 HIS A 85 15.406 4.816 -12.344 1.00 0.00 C ATOM 1353 NE2 HIS A 85 14.459 3.900 -12.140 1.00 0.00 N ATOM 0 H HIS A 85 12.857 8.172 -7.968 1.00 0.00 H new ATOM 0 HA HIS A 85 13.152 5.357 -8.299 1.00 0.00 H new ATOM 0 HB2 HIS A 85 12.439 6.909 -10.095 1.00 0.00 H new ATOM 0 HB3 HIS A 85 14.003 7.698 -10.070 1.00 0.00 H new ATOM 0 HD2 HIS A 85 12.707 3.983 -10.816 1.00 0.00 H new ATOM 0 HE1 HIS A 85 16.239 4.689 -13.020 1.00 0.00 H new ATOM 0 HE2 HIS A 85 14.385 2.981 -12.576 1.00 0.00 H new ATOM 1362 N GLU A 86 15.928 7.082 -8.017 1.00 0.00 N ATOM 1363 CA GLU A 86 17.376 6.926 -7.753 1.00 0.00 C ATOM 1364 C GLU A 86 17.570 6.188 -6.421 1.00 0.00 C ATOM 1365 O GLU A 86 18.453 5.366 -6.274 1.00 0.00 O ATOM 1366 CB GLU A 86 18.018 8.311 -7.680 1.00 0.00 C ATOM 1367 CG GLU A 86 18.027 8.938 -9.077 1.00 0.00 C ATOM 1368 CD GLU A 86 18.658 10.330 -9.006 1.00 0.00 C ATOM 1369 OE1 GLU A 86 19.152 10.682 -7.949 1.00 0.00 O ATOM 1370 OE2 GLU A 86 18.636 11.020 -10.013 1.00 0.00 O ATOM 0 H GLU A 86 15.587 8.043 -8.013 1.00 0.00 H new ATOM 0 HA GLU A 86 17.844 6.351 -8.552 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.464 8.945 -6.988 1.00 0.00 H new ATOM 0 HB3 GLU A 86 19.036 8.233 -7.297 1.00 0.00 H new ATOM 0 HG2 GLU A 86 18.588 8.307 -9.767 1.00 0.00 H new ATOM 0 HG3 GLU A 86 17.010 9.007 -9.463 1.00 0.00 H new ATOM 1377 N PHE A 87 16.758 6.499 -5.442 1.00 0.00 N ATOM 1378 CA PHE A 87 16.893 5.846 -4.103 1.00 0.00 C ATOM 1379 C PHE A 87 16.147 4.507 -4.066 1.00 0.00 C ATOM 1380 O PHE A 87 16.459 3.639 -3.275 1.00 0.00 O ATOM 1381 CB PHE A 87 16.315 6.779 -3.035 1.00 0.00 C ATOM 1382 CG PHE A 87 16.505 6.164 -1.668 1.00 0.00 C ATOM 1383 CD1 PHE A 87 17.681 6.410 -0.950 1.00 0.00 C ATOM 1384 CD2 PHE A 87 15.510 5.345 -1.121 1.00 0.00 C ATOM 1385 CE1 PHE A 87 17.863 5.840 0.315 1.00 0.00 C ATOM 1386 CE2 PHE A 87 15.692 4.775 0.146 1.00 0.00 C ATOM 1387 CZ PHE A 87 16.869 5.023 0.864 1.00 0.00 C ATOM 0 H PHE A 87 16.003 7.181 -5.513 1.00 0.00 H new ATOM 0 HA PHE A 87 17.949 5.655 -3.911 1.00 0.00 H new ATOM 0 HB2 PHE A 87 16.809 7.750 -3.080 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.255 6.951 -3.223 1.00 0.00 H new ATOM 0 HD1 PHE A 87 18.449 7.041 -1.373 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.603 5.153 -1.675 1.00 0.00 H new ATOM 0 HE1 PHE A 87 18.771 6.031 0.868 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.924 4.144 0.569 1.00 0.00 H new ATOM 0 HZ PHE A 87 17.009 4.584 1.841 1.00 0.00 H new ATOM 1397 N PHE A 88 15.161 4.330 -4.901 1.00 0.00 N ATOM 1398 CA PHE A 88 14.403 3.048 -4.893 1.00 0.00 C ATOM 1399 C PHE A 88 15.354 1.901 -5.211 1.00 0.00 C ATOM 1400 O PHE A 88 15.107 0.765 -4.862 1.00 0.00 O ATOM 1401 CB PHE A 88 13.295 3.089 -5.945 1.00 0.00 C ATOM 1402 CG PHE A 88 12.431 1.856 -5.810 1.00 0.00 C ATOM 1403 CD1 PHE A 88 12.750 0.694 -6.524 1.00 0.00 C ATOM 1404 CD2 PHE A 88 11.309 1.877 -4.973 1.00 0.00 C ATOM 1405 CE1 PHE A 88 11.947 -0.446 -6.401 1.00 0.00 C ATOM 1406 CE2 PHE A 88 10.506 0.736 -4.849 1.00 0.00 C ATOM 1407 CZ PHE A 88 10.825 -0.425 -5.563 1.00 0.00 C ATOM 0 H PHE A 88 14.848 5.016 -5.587 1.00 0.00 H new ATOM 0 HA PHE A 88 13.958 2.901 -3.909 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.690 3.987 -5.817 1.00 0.00 H new ATOM 0 HB3 PHE A 88 13.728 3.136 -6.944 1.00 0.00 H new ATOM 0 HD1 PHE A 88 13.616 0.678 -7.170 1.00 0.00 H new ATOM 0 HD2 PHE A 88 11.063 2.773 -4.423 1.00 0.00 H new ATOM 0 HE1 PHE A 88 12.193 -1.342 -6.952 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.641 0.752 -4.203 1.00 0.00 H new ATOM 0 HZ PHE A 88 10.206 -1.305 -5.468 1.00 0.00 H new ATOM 1464 N MET B 0 -3.481 8.664 5.033 1.00 0.00 N ATOM 1465 CA MET B 0 -2.609 8.449 6.221 1.00 0.00 C ATOM 1466 C MET B 0 -1.182 8.164 5.751 1.00 0.00 C ATOM 1467 O MET B 0 -0.730 7.036 5.756 1.00 0.00 O ATOM 1468 CB MET B 0 -3.134 7.263 7.042 1.00 0.00 C ATOM 1469 CG MET B 0 -3.574 6.130 6.108 1.00 0.00 C ATOM 1470 SD MET B 0 -4.195 4.739 7.089 1.00 0.00 S ATOM 1471 CE MET B 0 -2.613 3.898 7.336 1.00 0.00 C ATOM 0 H1 MET B 0 -4.457 8.842 5.346 1.00 0.00 H new ATOM 0 H2 MET B 0 -3.136 9.483 4.493 1.00 0.00 H new ATOM 0 H3 MET B 0 -3.460 7.818 4.429 1.00 0.00 H new ATOM 0 HA MET B 0 -2.615 9.342 6.846 1.00 0.00 H new ATOM 0 HB2 MET B 0 -2.357 6.906 7.718 1.00 0.00 H new ATOM 0 HB3 MET B 0 -3.973 7.582 7.660 1.00 0.00 H new ATOM 0 HG2 MET B 0 -4.350 6.485 5.430 1.00 0.00 H new ATOM 0 HG3 MET B 0 -2.735 5.807 5.491 1.00 0.00 H new ATOM 0 HE1 MET B 0 -2.769 2.996 7.928 1.00 0.00 H new ATOM 0 HE2 MET B 0 -2.190 3.628 6.369 1.00 0.00 H new ATOM 0 HE3 MET B 0 -1.926 4.562 7.860 1.00 0.00 H new ATOM 1483 N SER B 1 -0.471 9.178 5.340 1.00 0.00 N ATOM 1484 CA SER B 1 0.926 8.962 4.863 1.00 0.00 C ATOM 1485 C SER B 1 0.905 8.014 3.658 1.00 0.00 C ATOM 1486 O SER B 1 1.824 7.255 3.428 1.00 0.00 O ATOM 1487 CB SER B 1 1.759 8.345 5.992 1.00 0.00 C ATOM 1488 OG SER B 1 1.675 6.927 5.916 1.00 0.00 O ATOM 0 H SER B 1 -0.795 10.145 5.313 1.00 0.00 H new ATOM 0 HA SER B 1 1.368 9.914 4.569 1.00 0.00 H new ATOM 0 HB2 SER B 1 2.798 8.664 5.909 1.00 0.00 H new ATOM 0 HB3 SER B 1 1.395 8.691 6.959 1.00 0.00 H new ATOM 0 HG SER B 1 0.761 6.642 6.126 1.00 0.00 H new ATOM 1494 N GLU B 2 -0.143 8.071 2.886 1.00 0.00 N ATOM 1495 CA GLU B 2 -0.261 7.202 1.678 1.00 0.00 C ATOM 1496 C GLU B 2 0.774 7.652 0.636 1.00 0.00 C ATOM 1497 O GLU B 2 0.881 7.102 -0.442 1.00 0.00 O ATOM 1498 CB GLU B 2 -1.674 7.357 1.104 1.00 0.00 C ATOM 1499 CG GLU B 2 -1.969 6.212 0.137 1.00 0.00 C ATOM 1500 CD GLU B 2 -3.374 6.379 -0.445 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -4.100 7.225 0.046 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -3.696 5.661 -1.378 1.00 0.00 O ATOM 0 H GLU B 2 -0.937 8.692 3.042 1.00 0.00 H new ATOM 0 HA GLU B 2 -0.081 6.159 1.938 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -2.406 7.361 1.912 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -1.764 8.313 0.588 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -1.231 6.201 -0.665 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -1.890 5.256 0.655 1.00 0.00 H new ATOM 1509 N LEU B 3 1.503 8.683 0.944 1.00 0.00 N ATOM 1510 CA LEU B 3 2.501 9.233 -0.018 1.00 0.00 C ATOM 1511 C LEU B 3 3.553 8.168 -0.385 1.00 0.00 C ATOM 1512 O LEU B 3 4.020 8.126 -1.498 1.00 0.00 O ATOM 1513 CB LEU B 3 3.166 10.472 0.641 1.00 0.00 C ATOM 1514 CG LEU B 3 3.965 11.380 -0.344 1.00 0.00 C ATOM 1515 CD1 LEU B 3 5.404 10.890 -0.481 1.00 0.00 C ATOM 1516 CD2 LEU B 3 3.321 11.454 -1.737 1.00 0.00 C ATOM 0 H LEU B 3 1.451 9.178 1.834 1.00 0.00 H new ATOM 0 HA LEU B 3 2.008 9.525 -0.945 1.00 0.00 H new ATOM 0 HB2 LEU B 3 2.392 11.071 1.121 1.00 0.00 H new ATOM 0 HB3 LEU B 3 3.839 10.131 1.428 1.00 0.00 H new ATOM 0 HG LEU B 3 3.952 12.382 0.084 1.00 0.00 H new ATOM 0 HD11 LEU B 3 5.944 11.537 -1.172 1.00 0.00 H new ATOM 0 HD12 LEU B 3 5.891 10.914 0.494 1.00 0.00 H new ATOM 0 HD13 LEU B 3 5.406 9.869 -0.863 1.00 0.00 H new ATOM 0 HD21 LEU B 3 3.919 12.099 -2.381 1.00 0.00 H new ATOM 0 HD22 LEU B 3 3.273 10.454 -2.169 1.00 0.00 H new ATOM 0 HD23 LEU B 3 2.313 11.861 -1.651 1.00 0.00 H new ATOM 1528 N GLU B 4 3.932 7.315 0.525 1.00 0.00 N ATOM 1529 CA GLU B 4 4.964 6.269 0.191 1.00 0.00 C ATOM 1530 C GLU B 4 4.490 5.361 -0.942 1.00 0.00 C ATOM 1531 O GLU B 4 5.261 4.988 -1.805 1.00 0.00 O ATOM 1532 CB GLU B 4 5.246 5.414 1.436 1.00 0.00 C ATOM 1533 CG GLU B 4 6.014 6.244 2.467 1.00 0.00 C ATOM 1534 CD GLU B 4 6.293 5.391 3.706 1.00 0.00 C ATOM 1535 OE1 GLU B 4 5.747 4.303 3.789 1.00 0.00 O ATOM 1536 OE2 GLU B 4 7.042 5.845 4.555 1.00 0.00 O ATOM 0 H GLU B 4 3.580 7.289 1.482 1.00 0.00 H new ATOM 0 HA GLU B 4 5.871 6.779 -0.133 1.00 0.00 H new ATOM 0 HB2 GLU B 4 4.309 5.059 1.865 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.825 4.532 1.160 1.00 0.00 H new ATOM 0 HG2 GLU B 4 6.951 6.599 2.038 1.00 0.00 H new ATOM 0 HG3 GLU B 4 5.436 7.126 2.743 1.00 0.00 H new ATOM 1543 N LYS B 5 3.251 4.995 -0.958 1.00 0.00 N ATOM 1544 CA LYS B 5 2.763 4.101 -2.045 1.00 0.00 C ATOM 1545 C LYS B 5 2.604 4.882 -3.343 1.00 0.00 C ATOM 1546 O LYS B 5 2.737 4.342 -4.419 1.00 0.00 O ATOM 1547 CB LYS B 5 1.416 3.510 -1.656 1.00 0.00 C ATOM 1548 CG LYS B 5 1.611 2.509 -0.515 1.00 0.00 C ATOM 1549 CD LYS B 5 0.243 2.079 0.045 1.00 0.00 C ATOM 1550 CE LYS B 5 -0.226 3.077 1.110 1.00 0.00 C ATOM 1551 NZ LYS B 5 -1.704 2.964 1.270 1.00 0.00 N ATOM 0 H LYS B 5 2.550 5.271 -0.271 1.00 0.00 H new ATOM 0 HA LYS B 5 3.492 3.304 -2.192 1.00 0.00 H new ATOM 0 HB2 LYS B 5 0.734 4.302 -1.347 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.962 3.016 -2.515 1.00 0.00 H new ATOM 0 HG2 LYS B 5 2.157 1.637 -0.874 1.00 0.00 H new ATOM 0 HG3 LYS B 5 2.212 2.958 0.275 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -0.488 2.025 -0.761 1.00 0.00 H new ATOM 0 HD3 LYS B 5 0.315 1.081 0.477 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.271 2.875 2.059 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.044 4.092 0.818 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -2.030 3.651 1.979 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -2.168 3.160 0.360 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -1.947 2.002 1.582 1.00 0.00 H new ATOM 1565 N ALA B 6 2.262 6.134 -3.251 1.00 0.00 N ATOM 1566 CA ALA B 6 2.041 6.942 -4.481 1.00 0.00 C ATOM 1567 C ALA B 6 3.354 7.218 -5.218 1.00 0.00 C ATOM 1568 O ALA B 6 3.409 7.179 -6.428 1.00 0.00 O ATOM 1569 CB ALA B 6 1.365 8.261 -4.083 1.00 0.00 C ATOM 0 H ALA B 6 2.125 6.636 -2.373 1.00 0.00 H new ATOM 0 HA ALA B 6 1.402 6.381 -5.163 1.00 0.00 H new ATOM 0 HB1 ALA B 6 1.195 8.866 -4.974 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.411 8.050 -3.601 1.00 0.00 H new ATOM 0 HB3 ALA B 6 2.008 8.805 -3.392 1.00 0.00 H new ATOM 1575 N MET B 7 4.403 7.499 -4.512 1.00 0.00 N ATOM 1576 CA MET B 7 5.695 7.780 -5.195 1.00 0.00 C ATOM 1577 C MET B 7 6.230 6.502 -5.825 1.00 0.00 C ATOM 1578 O MET B 7 6.777 6.500 -6.913 1.00 0.00 O ATOM 1579 CB MET B 7 6.715 8.321 -4.187 1.00 0.00 C ATOM 1580 CG MET B 7 6.317 9.732 -3.754 1.00 0.00 C ATOM 1581 SD MET B 7 7.701 10.499 -2.871 1.00 0.00 S ATOM 1582 CE MET B 7 7.387 12.211 -3.376 1.00 0.00 C ATOM 0 H MET B 7 4.427 7.547 -3.493 1.00 0.00 H new ATOM 0 HA MET B 7 5.530 8.527 -5.972 1.00 0.00 H new ATOM 0 HB2 MET B 7 6.765 7.665 -3.318 1.00 0.00 H new ATOM 0 HB3 MET B 7 7.709 8.335 -4.634 1.00 0.00 H new ATOM 0 HG2 MET B 7 6.050 10.330 -4.625 1.00 0.00 H new ATOM 0 HG3 MET B 7 5.437 9.693 -3.112 1.00 0.00 H new ATOM 0 HE1 MET B 7 7.870 12.892 -2.675 1.00 0.00 H new ATOM 0 HE2 MET B 7 7.788 12.375 -4.376 1.00 0.00 H new ATOM 0 HE3 MET B 7 6.313 12.398 -3.381 1.00 0.00 H new ATOM 1592 N VAL B 8 6.080 5.418 -5.138 1.00 0.00 N ATOM 1593 CA VAL B 8 6.586 4.122 -5.666 1.00 0.00 C ATOM 1594 C VAL B 8 5.733 3.687 -6.860 1.00 0.00 C ATOM 1595 O VAL B 8 6.210 3.056 -7.780 1.00 0.00 O ATOM 1596 CB VAL B 8 6.527 3.071 -4.554 1.00 0.00 C ATOM 1597 CG1 VAL B 8 6.923 1.698 -5.106 1.00 0.00 C ATOM 1598 CG2 VAL B 8 7.499 3.470 -3.438 1.00 0.00 C ATOM 0 H VAL B 8 5.626 5.366 -4.226 1.00 0.00 H new ATOM 0 HA VAL B 8 7.618 4.232 -5.998 1.00 0.00 H new ATOM 0 HB VAL B 8 5.511 3.016 -4.163 1.00 0.00 H new ATOM 0 HG11 VAL B 8 6.878 0.958 -4.307 1.00 0.00 H new ATOM 0 HG12 VAL B 8 6.236 1.414 -5.903 1.00 0.00 H new ATOM 0 HG13 VAL B 8 7.938 1.744 -5.501 1.00 0.00 H new ATOM 0 HG21 VAL B 8 7.463 2.727 -2.642 1.00 0.00 H new ATOM 0 HG22 VAL B 8 8.511 3.524 -3.839 1.00 0.00 H new ATOM 0 HG23 VAL B 8 7.215 4.444 -3.039 1.00 0.00 H new ATOM 1608 N ALA B 9 4.471 4.001 -6.834 1.00 0.00 N ATOM 1609 CA ALA B 9 3.565 3.595 -7.948 1.00 0.00 C ATOM 1610 C ALA B 9 3.874 4.372 -9.231 1.00 0.00 C ATOM 1611 O ALA B 9 3.835 3.821 -10.309 1.00 0.00 O ATOM 1612 CB ALA B 9 2.118 3.847 -7.543 1.00 0.00 C ATOM 0 H ALA B 9 4.021 4.526 -6.084 1.00 0.00 H new ATOM 0 HA ALA B 9 3.723 2.534 -8.144 1.00 0.00 H new ATOM 0 HB1 ALA B 9 1.456 3.551 -8.356 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.883 3.264 -6.653 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.979 4.907 -7.330 1.00 0.00 H new ATOM 1618 N LEU B 10 4.166 5.643 -9.143 1.00 0.00 N ATOM 1619 CA LEU B 10 4.459 6.407 -10.398 1.00 0.00 C ATOM 1620 C LEU B 10 5.658 5.768 -11.080 1.00 0.00 C ATOM 1621 O LEU B 10 5.705 5.614 -12.284 1.00 0.00 O ATOM 1622 CB LEU B 10 4.802 7.862 -10.065 1.00 0.00 C ATOM 1623 CG LEU B 10 3.585 8.578 -9.472 1.00 0.00 C ATOM 1624 CD1 LEU B 10 3.983 10.006 -9.068 1.00 0.00 C ATOM 1625 CD2 LEU B 10 2.453 8.637 -10.514 1.00 0.00 C ATOM 0 H LEU B 10 4.215 6.179 -8.277 1.00 0.00 H new ATOM 0 HA LEU B 10 3.584 6.386 -11.048 1.00 0.00 H new ATOM 0 HB2 LEU B 10 5.630 7.894 -9.357 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.132 8.379 -10.966 1.00 0.00 H new ATOM 0 HG LEU B 10 3.237 8.031 -8.596 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.119 10.519 -8.645 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.780 9.965 -8.325 1.00 0.00 H new ATOM 0 HD13 LEU B 10 4.333 10.548 -9.946 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.590 9.148 -10.086 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.796 9.181 -11.394 1.00 0.00 H new ATOM 0 HD23 LEU B 10 2.170 7.624 -10.801 1.00 0.00 H new ATOM 1637 N ILE B 11 6.620 5.385 -10.306 1.00 0.00 N ATOM 1638 CA ILE B 11 7.824 4.739 -10.873 1.00 0.00 C ATOM 1639 C ILE B 11 7.454 3.384 -11.492 1.00 0.00 C ATOM 1640 O ILE B 11 7.981 3.007 -12.520 1.00 0.00 O ATOM 1641 CB ILE B 11 8.878 4.593 -9.768 1.00 0.00 C ATOM 1642 CG1 ILE B 11 9.430 5.990 -9.437 1.00 0.00 C ATOM 1643 CG2 ILE B 11 10.013 3.679 -10.228 1.00 0.00 C ATOM 1644 CD1 ILE B 11 10.303 5.944 -8.179 1.00 0.00 C ATOM 0 H ILE B 11 6.625 5.493 -9.292 1.00 0.00 H new ATOM 0 HA ILE B 11 8.242 5.355 -11.669 1.00 0.00 H new ATOM 0 HB ILE B 11 8.423 4.148 -8.883 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.014 6.364 -10.278 1.00 0.00 H new ATOM 0 HG13 ILE B 11 8.605 6.686 -9.288 1.00 0.00 H new ATOM 0 HG21 ILE B 11 10.751 3.587 -9.432 1.00 0.00 H new ATOM 0 HG22 ILE B 11 9.613 2.694 -10.467 1.00 0.00 H new ATOM 0 HG23 ILE B 11 10.486 4.103 -11.114 1.00 0.00 H new ATOM 0 HD11 ILE B 11 10.683 6.943 -7.963 1.00 0.00 H new ATOM 0 HD12 ILE B 11 9.708 5.592 -7.336 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.140 5.265 -8.341 1.00 0.00 H new ATOM 1656 N ASP B 12 6.571 2.636 -10.877 1.00 0.00 N ATOM 1657 CA ASP B 12 6.209 1.304 -11.453 1.00 0.00 C ATOM 1658 C ASP B 12 5.604 1.460 -12.861 1.00 0.00 C ATOM 1659 O ASP B 12 5.943 0.731 -13.770 1.00 0.00 O ATOM 1660 CB ASP B 12 5.180 0.616 -10.546 1.00 0.00 C ATOM 1661 CG ASP B 12 5.844 0.192 -9.233 1.00 0.00 C ATOM 1662 OD1 ASP B 12 7.059 0.096 -9.209 1.00 0.00 O ATOM 1663 OD2 ASP B 12 5.123 -0.026 -8.271 1.00 0.00 O ATOM 0 H ASP B 12 6.091 2.886 -10.012 1.00 0.00 H new ATOM 0 HA ASP B 12 7.116 0.704 -11.522 1.00 0.00 H new ATOM 0 HB2 ASP B 12 4.351 1.294 -10.342 1.00 0.00 H new ATOM 0 HB3 ASP B 12 4.763 -0.255 -11.051 1.00 0.00 H new ATOM 1668 N VAL B 13 4.701 2.393 -13.037 1.00 0.00 N ATOM 1669 CA VAL B 13 4.040 2.589 -14.376 1.00 0.00 C ATOM 1670 C VAL B 13 5.066 3.003 -15.441 1.00 0.00 C ATOM 1671 O VAL B 13 5.016 2.552 -16.578 1.00 0.00 O ATOM 1672 CB VAL B 13 2.925 3.663 -14.222 1.00 0.00 C ATOM 1673 CG1 VAL B 13 2.729 4.466 -15.521 1.00 0.00 C ATOM 1674 CG2 VAL B 13 1.589 2.981 -13.851 1.00 0.00 C ATOM 0 H VAL B 13 4.388 3.034 -12.308 1.00 0.00 H new ATOM 0 HA VAL B 13 3.598 1.650 -14.709 1.00 0.00 H new ATOM 0 HB VAL B 13 3.234 4.348 -13.433 1.00 0.00 H new ATOM 0 HG11 VAL B 13 1.943 5.207 -15.376 1.00 0.00 H new ATOM 0 HG12 VAL B 13 3.659 4.971 -15.781 1.00 0.00 H new ATOM 0 HG13 VAL B 13 2.446 3.790 -16.328 1.00 0.00 H new ATOM 0 HG21 VAL B 13 0.812 3.738 -13.744 1.00 0.00 H new ATOM 0 HG22 VAL B 13 1.308 2.280 -14.637 1.00 0.00 H new ATOM 0 HG23 VAL B 13 1.704 2.444 -12.910 1.00 0.00 H new ATOM 1684 N PHE B 14 5.992 3.846 -15.094 1.00 0.00 N ATOM 1685 CA PHE B 14 6.997 4.278 -16.096 1.00 0.00 C ATOM 1686 C PHE B 14 7.685 3.047 -16.664 1.00 0.00 C ATOM 1687 O PHE B 14 7.957 2.972 -17.833 1.00 0.00 O ATOM 1688 CB PHE B 14 8.021 5.204 -15.441 1.00 0.00 C ATOM 1689 CG PHE B 14 9.072 5.593 -16.452 1.00 0.00 C ATOM 1690 CD1 PHE B 14 8.884 6.720 -17.259 1.00 0.00 C ATOM 1691 CD2 PHE B 14 10.242 4.837 -16.568 1.00 0.00 C ATOM 1692 CE1 PHE B 14 9.868 7.092 -18.183 1.00 0.00 C ATOM 1693 CE2 PHE B 14 11.225 5.206 -17.494 1.00 0.00 C ATOM 1694 CZ PHE B 14 11.038 6.335 -18.301 1.00 0.00 C ATOM 0 H PHE B 14 6.096 4.253 -14.164 1.00 0.00 H new ATOM 0 HA PHE B 14 6.506 4.824 -16.902 1.00 0.00 H new ATOM 0 HB2 PHE B 14 7.526 6.095 -15.055 1.00 0.00 H new ATOM 0 HB3 PHE B 14 8.487 4.705 -14.591 1.00 0.00 H new ATOM 0 HD1 PHE B 14 7.980 7.303 -17.169 1.00 0.00 H new ATOM 0 HD2 PHE B 14 10.388 3.968 -15.943 1.00 0.00 H new ATOM 0 HE1 PHE B 14 9.724 7.963 -18.804 1.00 0.00 H new ATOM 0 HE2 PHE B 14 12.127 4.620 -17.586 1.00 0.00 H new ATOM 0 HZ PHE B 14 11.797 6.621 -19.014 1.00 0.00 H new ATOM 1704 N HIS B 15 7.967 2.083 -15.850 1.00 0.00 N ATOM 1705 CA HIS B 15 8.637 0.857 -16.358 1.00 0.00 C ATOM 1706 C HIS B 15 7.650 -0.033 -17.128 1.00 0.00 C ATOM 1707 O HIS B 15 8.056 -0.869 -17.911 1.00 0.00 O ATOM 1708 CB HIS B 15 9.209 0.073 -15.183 1.00 0.00 C ATOM 1709 CG HIS B 15 9.922 -1.147 -15.695 1.00 0.00 C ATOM 1710 ND1 HIS B 15 11.052 -1.063 -16.498 1.00 0.00 N ATOM 1711 CD2 HIS B 15 9.680 -2.487 -15.526 1.00 0.00 C ATOM 1712 CE1 HIS B 15 11.444 -2.320 -16.778 1.00 0.00 C ATOM 1713 NE2 HIS B 15 10.642 -3.221 -16.209 1.00 0.00 N ATOM 0 H HIS B 15 7.764 2.086 -14.850 1.00 0.00 H new ATOM 0 HA HIS B 15 9.435 1.156 -17.038 1.00 0.00 H new ATOM 0 HB2 HIS B 15 9.898 0.699 -14.615 1.00 0.00 H new ATOM 0 HB3 HIS B 15 8.409 -0.219 -14.503 1.00 0.00 H new ATOM 0 HD2 HIS B 15 8.868 -2.906 -14.951 1.00 0.00 H new ATOM 0 HE1 HIS B 15 12.301 -2.568 -17.387 1.00 0.00 H new ATOM 0 HE2 HIS B 15 10.719 -4.237 -16.264 1.00 0.00 H new ATOM 1722 N GLN B 16 6.367 0.097 -16.899 1.00 0.00 N ATOM 1723 CA GLN B 16 5.408 -0.804 -17.607 1.00 0.00 C ATOM 1724 C GLN B 16 5.525 -0.647 -19.122 1.00 0.00 C ATOM 1725 O GLN B 16 5.459 -1.623 -19.843 1.00 0.00 O ATOM 1726 CB GLN B 16 3.971 -0.456 -17.200 1.00 0.00 C ATOM 1727 CG GLN B 16 3.720 -0.864 -15.751 1.00 0.00 C ATOM 1728 CD GLN B 16 3.792 -2.386 -15.618 1.00 0.00 C ATOM 1729 OE1 GLN B 16 4.475 -2.900 -14.753 1.00 0.00 O ATOM 1730 NE2 GLN B 16 3.125 -3.135 -16.454 1.00 0.00 N ATOM 0 H GLN B 16 5.948 0.776 -16.264 1.00 0.00 H new ATOM 0 HA GLN B 16 5.649 -1.830 -17.329 1.00 0.00 H new ATOM 0 HB2 GLN B 16 3.801 0.614 -17.319 1.00 0.00 H new ATOM 0 HB3 GLN B 16 3.266 -0.966 -17.856 1.00 0.00 H new ATOM 0 HG2 GLN B 16 4.460 -0.398 -15.100 1.00 0.00 H new ATOM 0 HG3 GLN B 16 2.742 -0.508 -15.428 1.00 0.00 H new ATOM 0 HE21 GLN B 16 2.552 -2.704 -17.180 1.00 0.00 H new ATOM 0 HE22 GLN B 16 3.177 -4.151 -16.382 1.00 0.00 H new ATOM 1739 N TYR B 17 5.680 0.554 -19.621 1.00 0.00 N ATOM 1740 CA TYR B 17 5.777 0.738 -21.117 1.00 0.00 C ATOM 1741 C TYR B 17 7.126 1.360 -21.519 1.00 0.00 C ATOM 1742 O TYR B 17 7.570 1.204 -22.638 1.00 0.00 O ATOM 1743 CB TYR B 17 4.630 1.636 -21.572 1.00 0.00 C ATOM 1744 CG TYR B 17 4.794 2.991 -20.946 1.00 0.00 C ATOM 1745 CD1 TYR B 17 4.528 3.162 -19.586 1.00 0.00 C ATOM 1746 CD2 TYR B 17 5.215 4.070 -21.722 1.00 0.00 C ATOM 1747 CE1 TYR B 17 4.688 4.414 -18.995 1.00 0.00 C ATOM 1748 CE2 TYR B 17 5.372 5.328 -21.139 1.00 0.00 C ATOM 1749 CZ TYR B 17 5.110 5.505 -19.769 1.00 0.00 C ATOM 1750 OH TYR B 17 5.273 6.745 -19.185 1.00 0.00 O ATOM 0 H TYR B 17 5.744 1.411 -19.071 1.00 0.00 H new ATOM 0 HA TYR B 17 5.709 -0.237 -21.600 1.00 0.00 H new ATOM 0 HB2 TYR B 17 4.626 1.721 -22.659 1.00 0.00 H new ATOM 0 HB3 TYR B 17 3.673 1.201 -21.283 1.00 0.00 H new ATOM 0 HD1 TYR B 17 4.198 2.323 -18.991 1.00 0.00 H new ATOM 0 HD2 TYR B 17 5.419 3.932 -22.773 1.00 0.00 H new ATOM 0 HE1 TYR B 17 4.487 4.544 -17.942 1.00 0.00 H new ATOM 0 HE2 TYR B 17 5.695 6.165 -21.740 1.00 0.00 H new ATOM 0 HH TYR B 17 4.921 6.725 -18.270 1.00 0.00 H new ATOM 1760 N SER B 18 7.783 2.061 -20.636 1.00 0.00 N ATOM 1761 CA SER B 18 9.095 2.676 -21.011 1.00 0.00 C ATOM 1762 C SER B 18 10.133 1.574 -21.227 1.00 0.00 C ATOM 1763 O SER B 18 10.975 1.664 -22.099 1.00 0.00 O ATOM 1764 CB SER B 18 9.577 3.623 -19.906 1.00 0.00 C ATOM 1765 OG SER B 18 10.092 2.862 -18.821 1.00 0.00 O ATOM 0 H SER B 18 7.475 2.235 -19.679 1.00 0.00 H new ATOM 0 HA SER B 18 8.966 3.246 -21.931 1.00 0.00 H new ATOM 0 HB2 SER B 18 10.347 4.290 -20.294 1.00 0.00 H new ATOM 0 HB3 SER B 18 8.754 4.251 -19.565 1.00 0.00 H new ATOM 0 HG SER B 18 9.856 3.297 -17.975 1.00 0.00 H new ATOM 1771 N GLY B 19 10.083 0.538 -20.437 1.00 0.00 N ATOM 1772 CA GLY B 19 11.070 -0.569 -20.594 1.00 0.00 C ATOM 1773 C GLY B 19 10.680 -1.439 -21.789 1.00 0.00 C ATOM 1774 O GLY B 19 11.419 -2.312 -22.203 1.00 0.00 O ATOM 0 H GLY B 19 9.402 0.409 -19.689 1.00 0.00 H new ATOM 0 HA2 GLY B 19 12.070 -0.160 -20.740 1.00 0.00 H new ATOM 0 HA3 GLY B 19 11.102 -1.173 -19.687 1.00 0.00 H new ATOM 1778 N ARG B 20 9.527 -1.206 -22.350 1.00 0.00 N ATOM 1779 CA ARG B 20 9.087 -2.011 -23.524 1.00 0.00 C ATOM 1780 C ARG B 20 10.089 -1.840 -24.666 1.00 0.00 C ATOM 1781 O ARG B 20 10.447 -2.789 -25.337 1.00 0.00 O ATOM 1782 CB ARG B 20 7.719 -1.516 -23.982 1.00 0.00 C ATOM 1783 CG ARG B 20 7.240 -2.326 -25.190 1.00 0.00 C ATOM 1784 CD ARG B 20 5.875 -1.800 -25.613 1.00 0.00 C ATOM 1785 NE ARG B 20 5.401 -2.525 -26.823 1.00 0.00 N ATOM 1786 CZ ARG B 20 4.140 -2.476 -27.153 1.00 0.00 C ATOM 1787 NH1 ARG B 20 3.296 -1.819 -26.407 1.00 0.00 N ATOM 1788 NH2 ARG B 20 3.723 -3.086 -28.226 1.00 0.00 N ATOM 0 H ARG B 20 8.868 -0.490 -22.045 1.00 0.00 H new ATOM 0 HA ARG B 20 9.029 -3.063 -23.245 1.00 0.00 H new ATOM 0 HB2 ARG B 20 7.001 -1.605 -23.167 1.00 0.00 H new ATOM 0 HB3 ARG B 20 7.775 -0.459 -24.243 1.00 0.00 H new ATOM 0 HG2 ARG B 20 7.951 -2.238 -26.011 1.00 0.00 H new ATOM 0 HG3 ARG B 20 7.176 -3.384 -24.936 1.00 0.00 H new ATOM 0 HD2 ARG B 20 5.160 -1.926 -24.800 1.00 0.00 H new ATOM 0 HD3 ARG B 20 5.936 -0.732 -25.820 1.00 0.00 H new ATOM 0 HE ARG B 20 6.059 -3.058 -27.392 1.00 0.00 H new ATOM 0 HH11 ARG B 20 3.622 -1.343 -25.566 1.00 0.00 H new ATOM 0 HH12 ARG B 20 2.310 -1.781 -26.665 1.00 0.00 H new ATOM 0 HH21 ARG B 20 4.383 -3.602 -28.808 1.00 0.00 H new ATOM 0 HH22 ARG B 20 2.737 -3.048 -28.484 1.00 0.00 H new ATOM 1802 N GLU B 21 10.529 -0.627 -24.899 1.00 0.00 N ATOM 1803 CA GLU B 21 11.499 -0.361 -26.010 1.00 0.00 C ATOM 1804 C GLU B 21 12.847 0.080 -25.431 1.00 0.00 C ATOM 1805 O GLU B 21 12.958 0.443 -24.275 1.00 0.00 O ATOM 1806 CB GLU B 21 10.948 0.742 -26.918 1.00 0.00 C ATOM 1807 CG GLU B 21 9.740 0.205 -27.690 1.00 0.00 C ATOM 1808 CD GLU B 21 9.189 1.301 -28.600 1.00 0.00 C ATOM 1809 OE1 GLU B 21 9.622 2.431 -28.460 1.00 0.00 O ATOM 1810 OE2 GLU B 21 8.344 0.991 -29.424 1.00 0.00 O ATOM 0 H GLU B 21 10.256 0.197 -24.363 1.00 0.00 H new ATOM 0 HA GLU B 21 11.639 -1.274 -26.589 1.00 0.00 H new ATOM 0 HB2 GLU B 21 10.658 1.608 -26.323 1.00 0.00 H new ATOM 0 HB3 GLU B 21 11.719 1.076 -27.613 1.00 0.00 H new ATOM 0 HG2 GLU B 21 10.030 -0.663 -28.282 1.00 0.00 H new ATOM 0 HG3 GLU B 21 8.969 -0.127 -26.995 1.00 0.00 H new ATOM 1817 N GLY B 22 13.876 0.023 -26.230 1.00 0.00 N ATOM 1818 CA GLY B 22 15.237 0.404 -25.755 1.00 0.00 C ATOM 1819 C GLY B 22 15.208 1.753 -25.033 1.00 0.00 C ATOM 1820 O GLY B 22 16.055 2.032 -24.207 1.00 0.00 O ATOM 0 H GLY B 22 13.832 -0.275 -27.204 1.00 0.00 H new ATOM 0 HA2 GLY B 22 15.620 -0.364 -25.083 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.921 0.456 -26.602 1.00 0.00 H new ATOM 1824 N ASP B 23 14.261 2.600 -25.331 1.00 0.00 N ATOM 1825 CA ASP B 23 14.220 3.919 -24.651 1.00 0.00 C ATOM 1826 C ASP B 23 13.759 3.738 -23.200 1.00 0.00 C ATOM 1827 O ASP B 23 12.861 4.404 -22.735 1.00 0.00 O ATOM 1828 CB ASP B 23 13.250 4.837 -25.401 1.00 0.00 C ATOM 1829 CG ASP B 23 13.905 5.350 -26.689 1.00 0.00 C ATOM 1830 OD1 ASP B 23 15.108 5.198 -26.828 1.00 0.00 O ATOM 1831 OD2 ASP B 23 13.190 5.891 -27.513 1.00 0.00 O ATOM 0 H ASP B 23 13.520 2.435 -26.012 1.00 0.00 H new ATOM 0 HA ASP B 23 15.214 4.366 -24.650 1.00 0.00 H new ATOM 0 HB2 ASP B 23 12.334 4.296 -25.639 1.00 0.00 H new ATOM 0 HB3 ASP B 23 12.968 5.677 -24.767 1.00 0.00 H new ATOM 1836 N LYS B 24 14.371 2.841 -22.477 1.00 0.00 N ATOM 1837 CA LYS B 24 13.977 2.633 -21.053 1.00 0.00 C ATOM 1838 C LYS B 24 14.426 3.844 -20.209 1.00 0.00 C ATOM 1839 O LYS B 24 13.728 4.286 -19.318 1.00 0.00 O ATOM 1840 CB LYS B 24 14.647 1.359 -20.524 1.00 0.00 C ATOM 1841 CG LYS B 24 14.210 1.104 -19.076 1.00 0.00 C ATOM 1842 CD LYS B 24 14.692 -0.283 -18.616 1.00 0.00 C ATOM 1843 CE LYS B 24 16.206 -0.270 -18.360 1.00 0.00 C ATOM 1844 NZ LYS B 24 16.556 0.862 -17.455 1.00 0.00 N ATOM 0 H LYS B 24 15.127 2.243 -22.810 1.00 0.00 H new ATOM 0 HA LYS B 24 12.894 2.531 -20.985 1.00 0.00 H new ATOM 0 HB2 LYS B 24 14.377 0.509 -21.150 1.00 0.00 H new ATOM 0 HB3 LYS B 24 15.731 1.460 -20.574 1.00 0.00 H new ATOM 0 HG2 LYS B 24 14.619 1.875 -18.423 1.00 0.00 H new ATOM 0 HG3 LYS B 24 13.124 1.164 -18.999 1.00 0.00 H new ATOM 0 HD2 LYS B 24 14.166 -0.574 -17.707 1.00 0.00 H new ATOM 0 HD3 LYS B 24 14.452 -1.028 -19.375 1.00 0.00 H new ATOM 0 HE2 LYS B 24 16.516 -1.214 -17.913 1.00 0.00 H new ATOM 0 HE3 LYS B 24 16.743 -0.172 -19.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 17.529 0.742 -17.109 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 16.482 1.759 -17.976 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 15.901 0.876 -16.647 1.00 0.00 H new ATOM 1858 N HIS B 25 15.603 4.367 -20.473 1.00 0.00 N ATOM 1859 CA HIS B 25 16.121 5.528 -19.675 1.00 0.00 C ATOM 1860 C HIS B 25 15.577 6.863 -20.204 1.00 0.00 C ATOM 1861 O HIS B 25 15.724 7.892 -19.573 1.00 0.00 O ATOM 1862 CB HIS B 25 17.649 5.543 -19.749 1.00 0.00 C ATOM 1863 CG HIS B 25 18.192 4.290 -19.115 1.00 0.00 C ATOM 1864 ND1 HIS B 25 18.436 3.134 -19.847 1.00 0.00 N ATOM 1865 CD2 HIS B 25 18.531 3.988 -17.817 1.00 0.00 C ATOM 1866 CE1 HIS B 25 18.897 2.201 -18.992 1.00 0.00 C ATOM 1867 NE2 HIS B 25 18.972 2.671 -17.746 1.00 0.00 N ATOM 0 H HIS B 25 16.229 4.039 -21.209 1.00 0.00 H new ATOM 0 HA HIS B 25 15.787 5.410 -18.644 1.00 0.00 H new ATOM 0 HB2 HIS B 25 17.973 5.608 -20.788 1.00 0.00 H new ATOM 0 HB3 HIS B 25 18.040 6.422 -19.237 1.00 0.00 H new ATOM 0 HD2 HIS B 25 18.465 4.669 -16.981 1.00 0.00 H new ATOM 0 HE1 HIS B 25 19.172 1.197 -19.280 1.00 0.00 H new ATOM 0 HE2 HIS B 25 19.287 2.170 -16.915 1.00 0.00 H new ATOM 1876 N LYS B 26 14.954 6.859 -21.350 1.00 0.00 N ATOM 1877 CA LYS B 26 14.396 8.126 -21.926 1.00 0.00 C ATOM 1878 C LYS B 26 12.997 7.821 -22.456 1.00 0.00 C ATOM 1879 O LYS B 26 12.664 6.682 -22.685 1.00 0.00 O ATOM 1880 CB LYS B 26 15.311 8.618 -23.057 1.00 0.00 C ATOM 1881 CG LYS B 26 15.398 7.558 -24.157 1.00 0.00 C ATOM 1882 CD LYS B 26 16.463 7.960 -25.191 1.00 0.00 C ATOM 1883 CE LYS B 26 17.873 7.928 -24.572 1.00 0.00 C ATOM 1884 NZ LYS B 26 18.208 9.278 -24.032 1.00 0.00 N ATOM 0 H LYS B 26 14.804 6.027 -21.921 1.00 0.00 H new ATOM 0 HA LYS B 26 14.340 8.909 -21.170 1.00 0.00 H new ATOM 0 HB2 LYS B 26 14.925 9.551 -23.469 1.00 0.00 H new ATOM 0 HB3 LYS B 26 16.306 8.830 -22.665 1.00 0.00 H new ATOM 0 HG2 LYS B 26 15.648 6.590 -23.722 1.00 0.00 H new ATOM 0 HG3 LYS B 26 14.429 7.447 -24.644 1.00 0.00 H new ATOM 0 HD2 LYS B 26 16.421 7.283 -26.044 1.00 0.00 H new ATOM 0 HD3 LYS B 26 16.250 8.960 -25.568 1.00 0.00 H new ATOM 0 HE2 LYS B 26 17.916 7.185 -23.776 1.00 0.00 H new ATOM 0 HE3 LYS B 26 18.605 7.633 -25.323 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 19.085 9.620 -24.473 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 17.433 9.939 -24.244 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 18.339 9.217 -23.002 1.00 0.00 H new ATOM 1898 N LEU B 27 12.157 8.816 -22.619 1.00 0.00 N ATOM 1899 CA LEU B 27 10.759 8.550 -23.102 1.00 0.00 C ATOM 1900 C LEU B 27 10.497 9.334 -24.391 1.00 0.00 C ATOM 1901 O LEU B 27 10.357 10.533 -24.365 1.00 0.00 O ATOM 1902 CB LEU B 27 9.779 9.003 -21.995 1.00 0.00 C ATOM 1903 CG LEU B 27 8.497 8.145 -22.002 1.00 0.00 C ATOM 1904 CD1 LEU B 27 8.811 6.697 -21.561 1.00 0.00 C ATOM 1905 CD2 LEU B 27 7.485 8.766 -21.031 1.00 0.00 C ATOM 0 H LEU B 27 12.375 9.796 -22.440 1.00 0.00 H new ATOM 0 HA LEU B 27 10.624 7.489 -23.313 1.00 0.00 H new ATOM 0 HB2 LEU B 27 10.265 8.928 -21.022 1.00 0.00 H new ATOM 0 HB3 LEU B 27 9.519 10.051 -22.142 1.00 0.00 H new ATOM 0 HG LEU B 27 8.087 8.118 -23.012 1.00 0.00 H new ATOM 0 HD11 LEU B 27 7.895 6.107 -21.572 1.00 0.00 H new ATOM 0 HD12 LEU B 27 9.535 6.257 -22.247 1.00 0.00 H new ATOM 0 HD13 LEU B 27 9.225 6.705 -20.553 1.00 0.00 H new ATOM 0 HD21 LEU B 27 6.573 8.169 -21.026 1.00 0.00 H new ATOM 0 HD22 LEU B 27 7.910 8.788 -20.028 1.00 0.00 H new ATOM 0 HD23 LEU B 27 7.252 9.782 -21.349 1.00 0.00 H new ATOM 1917 N LYS B 28 10.401 8.673 -25.521 1.00 0.00 N ATOM 1918 CA LYS B 28 10.127 9.417 -26.786 1.00 0.00 C ATOM 1919 C LYS B 28 8.619 9.526 -26.981 1.00 0.00 C ATOM 1920 O LYS B 28 7.870 8.669 -26.553 1.00 0.00 O ATOM 1921 CB LYS B 28 10.746 8.675 -27.979 1.00 0.00 C ATOM 1922 CG LYS B 28 10.486 7.174 -27.848 1.00 0.00 C ATOM 1923 CD LYS B 28 10.923 6.462 -29.132 1.00 0.00 C ATOM 1924 CE LYS B 28 10.742 4.953 -28.955 1.00 0.00 C ATOM 1925 NZ LYS B 28 11.320 4.233 -30.125 1.00 0.00 N ATOM 0 H LYS B 28 10.500 7.663 -25.619 1.00 0.00 H new ATOM 0 HA LYS B 28 10.567 10.412 -26.723 1.00 0.00 H new ATOM 0 HB2 LYS B 28 10.320 9.047 -28.911 1.00 0.00 H new ATOM 0 HB3 LYS B 28 11.818 8.865 -28.020 1.00 0.00 H new ATOM 0 HG2 LYS B 28 11.032 6.773 -26.994 1.00 0.00 H new ATOM 0 HG3 LYS B 28 9.427 6.993 -27.662 1.00 0.00 H new ATOM 0 HD2 LYS B 28 10.332 6.815 -29.977 1.00 0.00 H new ATOM 0 HD3 LYS B 28 11.965 6.692 -29.353 1.00 0.00 H new ATOM 0 HE2 LYS B 28 11.230 4.624 -28.037 1.00 0.00 H new ATOM 0 HE3 LYS B 28 9.683 4.714 -28.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 11.006 3.242 -30.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 11.000 4.686 -31.004 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 12.358 4.268 -30.076 1.00 0.00 H new ATOM 1939 N LYS B 29 8.171 10.578 -27.620 1.00 0.00 N ATOM 1940 CA LYS B 29 6.706 10.762 -27.857 1.00 0.00 C ATOM 1941 C LYS B 29 6.047 9.430 -28.200 1.00 0.00 C ATOM 1942 O LYS B 29 4.861 9.256 -28.027 1.00 0.00 O ATOM 1943 CB LYS B 29 6.500 11.713 -29.032 1.00 0.00 C ATOM 1944 CG LYS B 29 7.240 11.185 -30.268 1.00 0.00 C ATOM 1945 CD LYS B 29 6.998 12.125 -31.463 1.00 0.00 C ATOM 1946 CE LYS B 29 7.988 13.297 -31.429 1.00 0.00 C ATOM 1947 NZ LYS B 29 7.803 14.136 -32.649 1.00 0.00 N ATOM 0 H LYS B 29 8.762 11.323 -27.990 1.00 0.00 H new ATOM 0 HA LYS B 29 6.258 11.167 -26.949 1.00 0.00 H new ATOM 0 HB2 LYS B 29 5.436 11.812 -29.249 1.00 0.00 H new ATOM 0 HB3 LYS B 29 6.866 12.707 -28.775 1.00 0.00 H new ATOM 0 HG2 LYS B 29 8.308 11.113 -30.061 1.00 0.00 H new ATOM 0 HG3 LYS B 29 6.894 10.180 -30.508 1.00 0.00 H new ATOM 0 HD2 LYS B 29 7.109 11.573 -32.396 1.00 0.00 H new ATOM 0 HD3 LYS B 29 5.976 12.503 -31.436 1.00 0.00 H new ATOM 0 HE2 LYS B 29 7.828 13.897 -30.533 1.00 0.00 H new ATOM 0 HE3 LYS B 29 9.011 12.923 -31.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 8.473 14.931 -32.628 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 7.976 13.559 -33.497 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 6.830 14.503 -32.673 1.00 0.00 H new ATOM 1961 N SER B 30 6.800 8.496 -28.703 1.00 0.00 N ATOM 1962 CA SER B 30 6.188 7.183 -29.063 1.00 0.00 C ATOM 1963 C SER B 30 5.857 6.403 -27.788 1.00 0.00 C ATOM 1964 O SER B 30 4.780 5.858 -27.648 1.00 0.00 O ATOM 1965 CB SER B 30 7.148 6.375 -29.933 1.00 0.00 C ATOM 1966 OG SER B 30 7.293 7.018 -31.192 1.00 0.00 O ATOM 0 H SER B 30 7.801 8.579 -28.880 1.00 0.00 H new ATOM 0 HA SER B 30 5.271 7.360 -29.625 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.117 6.288 -29.442 1.00 0.00 H new ATOM 0 HB3 SER B 30 6.769 5.362 -30.070 1.00 0.00 H new ATOM 0 HG SER B 30 7.910 6.503 -31.753 1.00 0.00 H new ATOM 1972 N GLU B 31 6.764 6.354 -26.847 1.00 0.00 N ATOM 1973 CA GLU B 31 6.476 5.619 -25.586 1.00 0.00 C ATOM 1974 C GLU B 31 5.389 6.370 -24.814 1.00 0.00 C ATOM 1975 O GLU B 31 4.507 5.777 -24.225 1.00 0.00 O ATOM 1976 CB GLU B 31 7.745 5.504 -24.741 1.00 0.00 C ATOM 1977 CG GLU B 31 8.720 4.537 -25.422 1.00 0.00 C ATOM 1978 CD GLU B 31 9.985 4.388 -24.574 1.00 0.00 C ATOM 1979 OE1 GLU B 31 10.598 5.398 -24.279 1.00 0.00 O ATOM 1980 OE2 GLU B 31 10.321 3.265 -24.237 1.00 0.00 O ATOM 0 H GLU B 31 7.685 6.789 -26.899 1.00 0.00 H new ATOM 0 HA GLU B 31 6.129 4.612 -25.818 1.00 0.00 H new ATOM 0 HB2 GLU B 31 8.208 6.484 -24.624 1.00 0.00 H new ATOM 0 HB3 GLU B 31 7.499 5.147 -23.741 1.00 0.00 H new ATOM 0 HG2 GLU B 31 8.246 3.565 -25.557 1.00 0.00 H new ATOM 0 HG3 GLU B 31 8.979 4.907 -26.414 1.00 0.00 H new ATOM 1987 N LEU B 32 5.440 7.675 -24.822 1.00 0.00 N ATOM 1988 CA LEU B 32 4.404 8.472 -24.105 1.00 0.00 C ATOM 1989 C LEU B 32 3.031 8.144 -24.691 1.00 0.00 C ATOM 1990 O LEU B 32 2.055 8.016 -23.987 1.00 0.00 O ATOM 1991 CB LEU B 32 4.708 9.965 -24.287 1.00 0.00 C ATOM 1992 CG LEU B 32 3.611 10.827 -23.642 1.00 0.00 C ATOM 1993 CD1 LEU B 32 3.511 10.524 -22.141 1.00 0.00 C ATOM 1994 CD2 LEU B 32 3.966 12.304 -23.843 1.00 0.00 C ATOM 0 H LEU B 32 6.157 8.225 -25.296 1.00 0.00 H new ATOM 0 HA LEU B 32 4.410 8.230 -23.042 1.00 0.00 H new ATOM 0 HB2 LEU B 32 5.673 10.202 -23.839 1.00 0.00 H new ATOM 0 HB3 LEU B 32 4.783 10.199 -25.349 1.00 0.00 H new ATOM 0 HG LEU B 32 2.651 10.603 -24.108 1.00 0.00 H new ATOM 0 HD11 LEU B 32 2.730 11.141 -21.696 1.00 0.00 H new ATOM 0 HD12 LEU B 32 3.267 9.471 -21.998 1.00 0.00 H new ATOM 0 HD13 LEU B 32 4.465 10.744 -21.661 1.00 0.00 H new ATOM 0 HD21 LEU B 32 3.196 12.928 -23.390 1.00 0.00 H new ATOM 0 HD22 LEU B 32 4.927 12.515 -23.373 1.00 0.00 H new ATOM 0 HD23 LEU B 32 4.029 12.521 -24.909 1.00 0.00 H new ATOM 2006 N LYS B 33 2.965 8.001 -25.978 1.00 0.00 N ATOM 2007 CA LYS B 33 1.677 7.665 -26.652 1.00 0.00 C ATOM 2008 C LYS B 33 1.168 6.324 -26.112 1.00 0.00 C ATOM 2009 O LYS B 33 -0.015 6.126 -25.917 1.00 0.00 O ATOM 2010 CB LYS B 33 1.942 7.566 -28.169 1.00 0.00 C ATOM 2011 CG LYS B 33 0.730 7.000 -28.939 1.00 0.00 C ATOM 2012 CD LYS B 33 -0.415 8.013 -28.951 1.00 0.00 C ATOM 2013 CE LYS B 33 -1.537 7.499 -29.849 1.00 0.00 C ATOM 2014 NZ LYS B 33 -1.153 7.682 -31.278 1.00 0.00 N ATOM 0 H LYS B 33 3.761 8.103 -26.608 1.00 0.00 H new ATOM 0 HA LYS B 33 0.924 8.430 -26.460 1.00 0.00 H new ATOM 0 HB2 LYS B 33 2.188 8.554 -28.558 1.00 0.00 H new ATOM 0 HB3 LYS B 33 2.810 6.930 -28.343 1.00 0.00 H new ATOM 0 HG2 LYS B 33 1.021 6.759 -29.961 1.00 0.00 H new ATOM 0 HG3 LYS B 33 0.398 6.072 -28.475 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -0.787 8.170 -27.939 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -0.058 8.978 -29.312 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -1.727 6.445 -29.644 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.461 8.037 -29.638 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -1.994 7.576 -31.880 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -0.750 8.632 -31.410 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -0.446 6.966 -31.542 1.00 0.00 H new ATOM 2028 N GLU B 34 2.059 5.390 -25.908 1.00 0.00 N ATOM 2029 CA GLU B 34 1.647 4.042 -25.422 1.00 0.00 C ATOM 2030 C GLU B 34 1.029 4.128 -24.033 1.00 0.00 C ATOM 2031 O GLU B 34 0.070 3.460 -23.740 1.00 0.00 O ATOM 2032 CB GLU B 34 2.873 3.126 -25.378 1.00 0.00 C ATOM 2033 CG GLU B 34 2.464 1.731 -24.903 1.00 0.00 C ATOM 2034 CD GLU B 34 3.686 0.819 -24.915 1.00 0.00 C ATOM 2035 OE1 GLU B 34 4.723 1.256 -25.385 1.00 0.00 O ATOM 2036 OE2 GLU B 34 3.566 -0.300 -24.448 1.00 0.00 O ATOM 0 H GLU B 34 3.061 5.505 -26.059 1.00 0.00 H new ATOM 0 HA GLU B 34 0.900 3.639 -26.106 1.00 0.00 H new ATOM 0 HB2 GLU B 34 3.327 3.064 -26.367 1.00 0.00 H new ATOM 0 HB3 GLU B 34 3.625 3.542 -24.707 1.00 0.00 H new ATOM 0 HG2 GLU B 34 2.045 1.784 -23.898 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.687 1.326 -25.551 1.00 0.00 H new ATOM 2043 N LEU B 35 1.555 4.928 -23.167 1.00 0.00 N ATOM 2044 CA LEU B 35 0.943 5.018 -21.816 1.00 0.00 C ATOM 2045 C LEU B 35 -0.439 5.656 -21.944 1.00 0.00 C ATOM 2046 O LEU B 35 -1.416 5.192 -21.403 1.00 0.00 O ATOM 2047 CB LEU B 35 1.831 5.890 -20.921 1.00 0.00 C ATOM 2048 CG LEU B 35 1.079 6.281 -19.614 1.00 0.00 C ATOM 2049 CD1 LEU B 35 2.030 6.235 -18.417 1.00 0.00 C ATOM 2050 CD2 LEU B 35 0.493 7.700 -19.727 1.00 0.00 C ATOM 0 H LEU B 35 2.371 5.519 -23.326 1.00 0.00 H new ATOM 0 HA LEU B 35 0.850 4.025 -21.377 1.00 0.00 H new ATOM 0 HB2 LEU B 35 2.746 5.352 -20.673 1.00 0.00 H new ATOM 0 HB3 LEU B 35 2.127 6.790 -21.460 1.00 0.00 H new ATOM 0 HG LEU B 35 0.270 5.565 -19.469 1.00 0.00 H new ATOM 0 HD11 LEU B 35 1.489 6.511 -17.512 1.00 0.00 H new ATOM 0 HD12 LEU B 35 2.429 5.227 -18.308 1.00 0.00 H new ATOM 0 HD13 LEU B 35 2.850 6.935 -18.577 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -0.028 7.953 -18.804 1.00 0.00 H new ATOM 0 HD22 LEU B 35 1.299 8.414 -19.896 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -0.208 7.739 -20.561 1.00 0.00 H new ATOM 2062 N ILE B 36 -0.506 6.748 -22.633 1.00 0.00 N ATOM 2063 CA ILE B 36 -1.796 7.468 -22.768 1.00 0.00 C ATOM 2064 C ILE B 36 -2.787 6.694 -23.645 1.00 0.00 C ATOM 2065 O ILE B 36 -3.960 6.620 -23.343 1.00 0.00 O ATOM 2066 CB ILE B 36 -1.513 8.839 -23.387 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -0.562 9.620 -22.473 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -2.820 9.617 -23.527 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -0.070 10.879 -23.195 1.00 0.00 C ATOM 0 H ILE B 36 0.283 7.180 -23.114 1.00 0.00 H new ATOM 0 HA ILE B 36 -2.250 7.573 -21.783 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.059 8.706 -24.369 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.073 9.894 -21.550 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.286 8.994 -22.194 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.617 10.593 -23.968 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -3.505 9.064 -24.169 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.271 9.750 -22.544 1.00 0.00 H new ATOM 0 HD11 ILE B 36 0.606 11.432 -22.543 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.457 10.594 -24.105 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -0.922 11.508 -23.451 1.00 0.00 H new ATOM 2081 N ASN B 37 -2.352 6.145 -24.742 1.00 0.00 N ATOM 2082 CA ASN B 37 -3.310 5.424 -25.627 1.00 0.00 C ATOM 2083 C ASN B 37 -3.637 4.029 -25.091 1.00 0.00 C ATOM 2084 O ASN B 37 -4.734 3.534 -25.250 1.00 0.00 O ATOM 2085 CB ASN B 37 -2.705 5.297 -27.027 1.00 0.00 C ATOM 2086 CG ASN B 37 -3.757 4.753 -27.996 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -3.715 3.598 -28.373 1.00 0.00 O ATOM 2088 ND2 ASN B 37 -4.705 5.543 -28.419 1.00 0.00 N ATOM 0 H ASN B 37 -1.384 6.162 -25.064 1.00 0.00 H new ATOM 0 HA ASN B 37 -4.236 5.998 -25.660 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -2.349 6.269 -27.369 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -1.842 4.632 -27.002 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -5.411 5.192 -29.066 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -4.740 6.512 -28.103 1.00 0.00 H new ATOM 2095 N ASN B 38 -2.677 3.371 -24.512 1.00 0.00 N ATOM 2096 CA ASN B 38 -2.902 1.966 -24.023 1.00 0.00 C ATOM 2097 C ASN B 38 -3.200 1.877 -22.518 1.00 0.00 C ATOM 2098 O ASN B 38 -3.984 1.049 -22.099 1.00 0.00 O ATOM 2099 CB ASN B 38 -1.649 1.134 -24.319 1.00 0.00 C ATOM 2100 CG ASN B 38 -1.995 -0.356 -24.263 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -1.264 -1.180 -24.775 1.00 0.00 O ATOM 2102 ND2 ASN B 38 -3.082 -0.741 -23.652 1.00 0.00 N ATOM 0 H ASN B 38 -1.739 3.738 -24.351 1.00 0.00 H new ATOM 0 HA ASN B 38 -3.780 1.588 -24.547 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.255 1.389 -25.303 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -0.868 1.364 -23.594 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -3.317 -1.733 -23.605 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -3.697 -0.050 -23.222 1.00 0.00 H new ATOM 2109 N GLU B 39 -2.563 2.665 -21.690 1.00 0.00 N ATOM 2110 CA GLU B 39 -2.812 2.534 -20.213 1.00 0.00 C ATOM 2111 C GLU B 39 -3.960 3.446 -19.775 1.00 0.00 C ATOM 2112 O GLU B 39 -4.549 3.238 -18.732 1.00 0.00 O ATOM 2113 CB GLU B 39 -1.532 2.889 -19.437 1.00 0.00 C ATOM 2114 CG GLU B 39 -1.715 2.556 -17.955 1.00 0.00 C ATOM 2115 CD GLU B 39 -0.393 2.785 -17.219 1.00 0.00 C ATOM 2116 OE1 GLU B 39 -0.050 3.936 -17.001 1.00 0.00 O ATOM 2117 OE2 GLU B 39 0.255 1.807 -16.885 1.00 0.00 O ATOM 0 H GLU B 39 -1.891 3.383 -21.961 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.091 1.503 -19.997 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -0.685 2.335 -19.842 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -1.306 3.949 -19.556 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.498 3.180 -17.524 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.034 1.520 -17.840 1.00 0.00 H new ATOM 2124 N LEU B 40 -4.294 4.446 -20.558 1.00 0.00 N ATOM 2125 CA LEU B 40 -5.420 5.370 -20.180 1.00 0.00 C ATOM 2126 C LEU B 40 -6.576 5.213 -21.181 1.00 0.00 C ATOM 2127 O LEU B 40 -7.058 6.178 -21.741 1.00 0.00 O ATOM 2128 CB LEU B 40 -4.932 6.825 -20.200 1.00 0.00 C ATOM 2129 CG LEU B 40 -3.643 6.971 -19.379 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -3.273 8.454 -19.275 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -3.846 6.404 -17.968 1.00 0.00 C ATOM 0 H LEU B 40 -3.837 4.665 -21.443 1.00 0.00 H new ATOM 0 HA LEU B 40 -5.764 5.116 -19.177 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.753 7.141 -21.228 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -5.704 7.479 -19.795 1.00 0.00 H new ATOM 0 HG LEU B 40 -2.844 6.420 -19.875 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -2.358 8.561 -18.692 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.117 8.861 -20.274 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.081 8.997 -18.784 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -2.925 6.513 -17.396 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -4.649 6.947 -17.470 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -4.108 5.348 -18.034 1.00 0.00 H new ATOM 2143 N SER B 41 -7.015 4.004 -21.421 1.00 0.00 N ATOM 2144 CA SER B 41 -8.128 3.790 -22.396 1.00 0.00 C ATOM 2145 C SER B 41 -9.465 4.279 -21.819 1.00 0.00 C ATOM 2146 O SER B 41 -10.091 5.170 -22.360 1.00 0.00 O ATOM 2147 CB SER B 41 -8.230 2.299 -22.722 1.00 0.00 C ATOM 2148 OG SER B 41 -9.257 2.096 -23.685 1.00 0.00 O ATOM 0 H SER B 41 -6.652 3.156 -20.985 1.00 0.00 H new ATOM 0 HA SER B 41 -7.914 4.360 -23.300 1.00 0.00 H new ATOM 0 HB2 SER B 41 -7.278 1.933 -23.107 1.00 0.00 H new ATOM 0 HB3 SER B 41 -8.447 1.731 -21.817 1.00 0.00 H new ATOM 0 HG SER B 41 -9.323 1.141 -23.897 1.00 0.00 H new ATOM 2154 N HIS B 42 -9.916 3.706 -20.730 1.00 0.00 N ATOM 2155 CA HIS B 42 -11.219 4.144 -20.132 1.00 0.00 C ATOM 2156 C HIS B 42 -10.966 5.189 -19.046 1.00 0.00 C ATOM 2157 O HIS B 42 -11.880 5.803 -18.533 1.00 0.00 O ATOM 2158 CB HIS B 42 -11.937 2.935 -19.523 1.00 0.00 C ATOM 2159 CG HIS B 42 -10.981 2.150 -18.664 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -9.803 2.697 -18.172 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -11.009 0.854 -18.212 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -9.176 1.740 -17.463 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -9.869 0.601 -17.457 1.00 0.00 N ATOM 0 H HIS B 42 -9.440 2.955 -20.229 1.00 0.00 H new ATOM 0 HA HIS B 42 -11.842 4.581 -20.912 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -12.786 3.268 -18.926 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -12.334 2.300 -20.315 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -11.795 0.141 -18.412 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -8.229 1.878 -16.961 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -9.616 -0.273 -16.995 1.00 0.00 H new ATOM 2172 N PHE B 43 -9.731 5.398 -18.700 1.00 0.00 N ATOM 2173 CA PHE B 43 -9.401 6.406 -17.655 1.00 0.00 C ATOM 2174 C PHE B 43 -9.863 7.787 -18.145 1.00 0.00 C ATOM 2175 O PHE B 43 -10.531 8.522 -17.445 1.00 0.00 O ATOM 2176 CB PHE B 43 -7.875 6.385 -17.455 1.00 0.00 C ATOM 2177 CG PHE B 43 -7.491 6.689 -16.021 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -8.180 7.660 -15.279 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -6.424 5.995 -15.437 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -7.801 7.929 -13.959 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -6.049 6.265 -14.127 1.00 0.00 C ATOM 2182 CZ PHE B 43 -6.734 7.233 -13.382 1.00 0.00 C ATOM 0 H PHE B 43 -8.928 4.911 -19.098 1.00 0.00 H new ATOM 0 HA PHE B 43 -9.898 6.185 -16.711 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.485 5.407 -17.736 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -7.411 7.115 -18.118 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -9.002 8.199 -15.726 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -5.891 5.248 -16.007 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -8.333 8.674 -13.386 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.226 5.726 -13.681 1.00 0.00 H new ATOM 0 HZ PHE B 43 -6.439 7.442 -12.364 1.00 0.00 H new ATOM 2192 N LEU B 44 -9.512 8.133 -19.354 1.00 0.00 N ATOM 2193 CA LEU B 44 -9.917 9.454 -19.913 1.00 0.00 C ATOM 2194 C LEU B 44 -9.849 9.403 -21.429 1.00 0.00 C ATOM 2195 O LEU B 44 -9.426 8.423 -22.012 1.00 0.00 O ATOM 2196 CB LEU B 44 -9.002 10.573 -19.393 1.00 0.00 C ATOM 2197 CG LEU B 44 -7.502 10.182 -19.496 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -6.907 10.698 -20.813 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -6.720 10.807 -18.331 1.00 0.00 C ATOM 0 H LEU B 44 -8.958 7.552 -19.983 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.937 9.668 -19.594 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.181 11.484 -19.964 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -9.250 10.793 -18.355 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.427 9.095 -19.459 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -5.855 10.417 -20.872 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.447 10.260 -21.652 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.995 11.784 -20.851 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.669 10.530 -18.408 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.813 11.892 -18.371 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -7.123 10.443 -17.386 1.00 0.00 H new ATOM 2211 N GLU B 45 -10.272 10.449 -22.080 1.00 0.00 N ATOM 2212 CA GLU B 45 -10.238 10.447 -23.560 1.00 0.00 C ATOM 2213 C GLU B 45 -8.829 10.084 -24.013 1.00 0.00 C ATOM 2214 O GLU B 45 -7.933 10.902 -24.035 1.00 0.00 O ATOM 2215 CB GLU B 45 -10.610 11.832 -24.095 1.00 0.00 C ATOM 2216 CG GLU B 45 -10.715 11.777 -25.620 1.00 0.00 C ATOM 2217 CD GLU B 45 -11.932 10.939 -26.018 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -12.788 10.733 -25.173 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -11.991 10.523 -27.164 1.00 0.00 O ATOM 0 H GLU B 45 -10.637 11.299 -21.651 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.954 9.721 -23.944 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -11.558 12.157 -23.666 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.858 12.563 -23.797 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -10.806 12.785 -26.025 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -9.808 11.344 -26.042 1.00 0.00 H new ATOM 2226 N GLU B 46 -8.640 8.853 -24.373 1.00 0.00 N ATOM 2227 CA GLU B 46 -7.303 8.400 -24.829 1.00 0.00 C ATOM 2228 C GLU B 46 -6.945 9.147 -26.118 1.00 0.00 C ATOM 2229 O GLU B 46 -7.790 9.753 -26.746 1.00 0.00 O ATOM 2230 CB GLU B 46 -7.349 6.876 -25.055 1.00 0.00 C ATOM 2231 CG GLU B 46 -7.952 6.531 -26.424 1.00 0.00 C ATOM 2232 CD GLU B 46 -8.127 5.015 -26.536 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -7.660 4.318 -25.651 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -8.730 4.580 -27.503 1.00 0.00 O ATOM 0 H GLU B 46 -9.362 8.132 -24.371 1.00 0.00 H new ATOM 0 HA GLU B 46 -6.538 8.615 -24.083 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -6.342 6.466 -24.986 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -7.939 6.407 -24.267 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -8.914 7.029 -26.546 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -7.303 6.893 -27.221 1.00 0.00 H new ATOM 2241 N ILE B 47 -5.704 9.126 -26.511 1.00 0.00 N ATOM 2242 CA ILE B 47 -5.309 9.853 -27.751 1.00 0.00 C ATOM 2243 C ILE B 47 -5.660 9.020 -28.983 1.00 0.00 C ATOM 2244 O ILE B 47 -5.504 7.814 -28.997 1.00 0.00 O ATOM 2245 CB ILE B 47 -3.806 10.118 -27.740 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -3.429 10.979 -26.509 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -3.426 10.836 -29.041 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -3.545 12.471 -26.826 1.00 0.00 C ATOM 0 H ILE B 47 -4.947 8.639 -26.031 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.849 10.799 -27.787 1.00 0.00 H new ATOM 0 HB ILE B 47 -3.260 9.177 -27.673 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -4.082 10.730 -25.673 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -2.410 10.748 -26.198 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -2.354 11.033 -29.048 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -3.685 10.207 -29.893 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -3.968 11.779 -29.108 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -3.275 13.052 -25.944 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -2.873 12.722 -27.646 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -4.570 12.703 -27.113 1.00 0.00 H new ATOM 2260 N LYS B 48 -6.142 9.660 -30.018 1.00 0.00 N ATOM 2261 CA LYS B 48 -6.521 8.931 -31.264 1.00 0.00 C ATOM 2262 C LYS B 48 -5.483 9.201 -32.360 1.00 0.00 C ATOM 2263 O LYS B 48 -5.407 8.485 -33.338 1.00 0.00 O ATOM 2264 CB LYS B 48 -7.900 9.428 -31.718 1.00 0.00 C ATOM 2265 CG LYS B 48 -8.858 9.512 -30.502 1.00 0.00 C ATOM 2266 CD LYS B 48 -8.871 10.922 -29.906 1.00 0.00 C ATOM 2267 CE LYS B 48 -9.977 10.994 -28.854 1.00 0.00 C ATOM 2268 NZ LYS B 48 -11.291 10.716 -29.497 1.00 0.00 N ATOM 0 H LYS B 48 -6.290 10.669 -30.052 1.00 0.00 H new ATOM 0 HA LYS B 48 -6.556 7.858 -31.073 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -7.807 10.408 -32.187 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -8.310 8.753 -32.469 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -9.866 9.235 -30.810 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -8.549 8.795 -29.741 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -7.905 11.152 -29.456 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -9.043 11.662 -30.688 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.787 10.270 -28.061 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -9.988 11.980 -28.390 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.050 10.815 -28.793 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.448 11.391 -30.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -11.294 9.747 -29.876 1.00 0.00 H new ATOM 2282 N GLU B 49 -4.679 10.227 -32.205 1.00 0.00 N ATOM 2283 CA GLU B 49 -3.640 10.543 -33.240 1.00 0.00 C ATOM 2284 C GLU B 49 -2.324 10.931 -32.568 1.00 0.00 C ATOM 2285 O GLU B 49 -2.299 11.449 -31.469 1.00 0.00 O ATOM 2286 CB GLU B 49 -4.107 11.717 -34.106 1.00 0.00 C ATOM 2287 CG GLU B 49 -5.190 11.258 -35.076 1.00 0.00 C ATOM 2288 CD GLU B 49 -4.586 10.309 -36.113 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -3.378 10.339 -36.282 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -5.342 9.568 -36.719 1.00 0.00 O ATOM 0 H GLU B 49 -4.697 10.860 -31.406 1.00 0.00 H new ATOM 0 HA GLU B 49 -3.491 9.657 -33.857 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -4.491 12.516 -33.472 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.263 12.128 -34.660 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -5.990 10.756 -34.532 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.635 12.120 -35.573 1.00 0.00 H new ATOM 2297 N GLN B 50 -1.231 10.700 -33.241 1.00 0.00 N ATOM 2298 CA GLN B 50 0.089 11.074 -32.674 1.00 0.00 C ATOM 2299 C GLN B 50 0.217 12.597 -32.688 1.00 0.00 C ATOM 2300 O GLN B 50 1.001 13.165 -31.963 1.00 0.00 O ATOM 2301 CB GLN B 50 1.210 10.459 -33.522 1.00 0.00 C ATOM 2302 CG GLN B 50 1.138 10.990 -34.963 1.00 0.00 C ATOM 2303 CD GLN B 50 1.768 12.386 -35.047 1.00 0.00 C ATOM 2304 OE1 GLN B 50 1.273 13.247 -35.749 1.00 0.00 O ATOM 2305 NE2 GLN B 50 2.839 12.652 -34.351 1.00 0.00 N ATOM 0 H GLN B 50 -1.198 10.266 -34.164 1.00 0.00 H new ATOM 0 HA GLN B 50 0.170 10.702 -31.653 1.00 0.00 H new ATOM 0 HB2 GLN B 50 2.180 10.700 -33.086 1.00 0.00 H new ATOM 0 HB3 GLN B 50 1.122 9.373 -33.522 1.00 0.00 H new ATOM 0 HG2 GLN B 50 1.658 10.308 -35.636 1.00 0.00 H new ATOM 0 HG3 GLN B 50 0.099 11.032 -35.291 1.00 0.00 H new ATOM 0 HE21 GLN B 50 3.256 11.932 -33.761 1.00 0.00 H new ATOM 0 HE22 GLN B 50 3.259 13.580 -34.396 1.00 0.00 H new ATOM 2314 N GLU B 51 -0.539 13.259 -33.528 1.00 0.00 N ATOM 2315 CA GLU B 51 -0.449 14.748 -33.604 1.00 0.00 C ATOM 2316 C GLU B 51 -0.817 15.373 -32.263 1.00 0.00 C ATOM 2317 O GLU B 51 -0.200 16.322 -31.831 1.00 0.00 O ATOM 2318 CB GLU B 51 -1.407 15.244 -34.695 1.00 0.00 C ATOM 2319 CG GLU B 51 -2.868 15.019 -34.249 1.00 0.00 C ATOM 2320 CD GLU B 51 -3.406 16.259 -33.524 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -2.602 17.066 -33.089 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -4.615 16.374 -33.410 1.00 0.00 O ATOM 0 H GLU B 51 -1.214 12.833 -34.163 1.00 0.00 H new ATOM 0 HA GLU B 51 0.573 15.039 -33.846 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -1.235 16.303 -34.889 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -1.216 14.714 -35.628 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -3.490 14.800 -35.117 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -2.924 14.153 -33.590 1.00 0.00 H new ATOM 2329 N VAL B 52 -1.806 14.856 -31.596 1.00 0.00 N ATOM 2330 CA VAL B 52 -2.184 15.436 -30.285 1.00 0.00 C ATOM 2331 C VAL B 52 -0.998 15.311 -29.360 1.00 0.00 C ATOM 2332 O VAL B 52 -0.706 16.191 -28.586 1.00 0.00 O ATOM 2333 CB VAL B 52 -3.376 14.682 -29.702 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -3.768 15.311 -28.366 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -4.554 14.752 -30.677 1.00 0.00 C ATOM 0 H VAL B 52 -2.366 14.060 -31.901 1.00 0.00 H new ATOM 0 HA VAL B 52 -2.465 16.482 -30.405 1.00 0.00 H new ATOM 0 HB VAL B 52 -3.107 13.638 -29.543 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -4.619 14.774 -27.947 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -2.927 15.252 -27.675 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.038 16.356 -28.521 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -5.404 14.213 -30.259 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -4.829 15.794 -30.841 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -4.268 14.299 -31.626 1.00 0.00 H new ATOM 2345 N VAL B 53 -0.320 14.211 -29.435 1.00 0.00 N ATOM 2346 CA VAL B 53 0.856 14.005 -28.566 1.00 0.00 C ATOM 2347 C VAL B 53 1.928 15.037 -28.904 1.00 0.00 C ATOM 2348 O VAL B 53 2.619 15.513 -28.038 1.00 0.00 O ATOM 2349 CB VAL B 53 1.395 12.594 -28.769 1.00 0.00 C ATOM 2350 CG1 VAL B 53 2.558 12.365 -27.806 1.00 0.00 C ATOM 2351 CG2 VAL B 53 0.271 11.571 -28.495 1.00 0.00 C ATOM 0 H VAL B 53 -0.532 13.439 -30.067 1.00 0.00 H new ATOM 0 HA VAL B 53 0.568 14.127 -27.522 1.00 0.00 H new ATOM 0 HB VAL B 53 1.744 12.470 -29.794 1.00 0.00 H new ATOM 0 HG11 VAL B 53 2.951 11.358 -27.943 1.00 0.00 H new ATOM 0 HG12 VAL B 53 3.345 13.092 -28.006 1.00 0.00 H new ATOM 0 HG13 VAL B 53 2.209 12.482 -26.780 1.00 0.00 H new ATOM 0 HG21 VAL B 53 0.655 10.561 -28.640 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -0.080 11.682 -27.469 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -0.556 11.747 -29.183 1.00 0.00 H new ATOM 2361 N ASP B 54 2.073 15.374 -30.160 1.00 0.00 N ATOM 2362 CA ASP B 54 3.102 16.378 -30.560 1.00 0.00 C ATOM 2363 C ASP B 54 2.775 17.722 -29.903 1.00 0.00 C ATOM 2364 O ASP B 54 3.638 18.443 -29.443 1.00 0.00 O ATOM 2365 CB ASP B 54 3.102 16.535 -32.086 1.00 0.00 C ATOM 2366 CG ASP B 54 4.159 17.563 -32.499 1.00 0.00 C ATOM 2367 OD1 ASP B 54 4.666 18.250 -31.627 1.00 0.00 O ATOM 2368 OD2 ASP B 54 4.445 17.643 -33.682 1.00 0.00 O ATOM 0 H ASP B 54 1.520 14.995 -30.928 1.00 0.00 H new ATOM 0 HA ASP B 54 4.087 16.043 -30.235 1.00 0.00 H new ATOM 0 HB2 ASP B 54 3.309 15.576 -32.560 1.00 0.00 H new ATOM 0 HB3 ASP B 54 2.117 16.854 -32.428 1.00 0.00 H new ATOM 2373 N LYS B 55 1.524 18.055 -29.857 1.00 0.00 N ATOM 2374 CA LYS B 55 1.103 19.341 -29.226 1.00 0.00 C ATOM 2375 C LYS B 55 1.427 19.262 -27.741 1.00 0.00 C ATOM 2376 O LYS B 55 1.898 20.202 -27.122 1.00 0.00 O ATOM 2377 CB LYS B 55 -0.403 19.537 -29.423 1.00 0.00 C ATOM 2378 CG LYS B 55 -0.832 20.901 -28.865 1.00 0.00 C ATOM 2379 CD LYS B 55 -2.358 21.059 -28.962 1.00 0.00 C ATOM 2380 CE LYS B 55 -2.772 21.457 -30.388 1.00 0.00 C ATOM 2381 NZ LYS B 55 -2.067 22.709 -30.793 1.00 0.00 N ATOM 0 H LYS B 55 0.762 17.490 -30.231 1.00 0.00 H new ATOM 0 HA LYS B 55 1.626 20.182 -29.681 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -0.651 19.474 -30.483 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -0.951 18.740 -28.920 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -0.515 20.993 -27.826 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -0.340 21.700 -29.420 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -2.844 20.124 -28.684 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -2.696 21.816 -28.255 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -2.531 20.653 -31.083 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -3.851 21.606 -30.434 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -2.638 23.217 -31.498 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -1.928 23.315 -29.959 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -1.142 22.469 -31.204 1.00 0.00 H new ATOM 2395 N VAL B 56 1.183 18.119 -27.178 1.00 0.00 N ATOM 2396 CA VAL B 56 1.470 17.898 -25.744 1.00 0.00 C ATOM 2397 C VAL B 56 2.979 17.966 -25.551 1.00 0.00 C ATOM 2398 O VAL B 56 3.473 18.324 -24.501 1.00 0.00 O ATOM 2399 CB VAL B 56 0.929 16.523 -25.342 1.00 0.00 C ATOM 2400 CG1 VAL B 56 1.491 16.097 -23.986 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -0.598 16.595 -25.261 1.00 0.00 C ATOM 0 H VAL B 56 0.789 17.313 -27.663 1.00 0.00 H new ATOM 0 HA VAL B 56 0.993 18.654 -25.120 1.00 0.00 H new ATOM 0 HB VAL B 56 1.234 15.789 -26.088 1.00 0.00 H new ATOM 0 HG11 VAL B 56 1.094 15.118 -23.719 1.00 0.00 H new ATOM 0 HG12 VAL B 56 2.578 16.045 -24.043 1.00 0.00 H new ATOM 0 HG13 VAL B 56 1.202 16.825 -23.228 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -0.994 15.620 -24.975 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -0.888 17.337 -24.517 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -1.001 16.879 -26.233 1.00 0.00 H new ATOM 2411 N MET B 57 3.714 17.634 -26.574 1.00 0.00 N ATOM 2412 CA MET B 57 5.195 17.688 -26.464 1.00 0.00 C ATOM 2413 C MET B 57 5.629 19.148 -26.391 1.00 0.00 C ATOM 2414 O MET B 57 6.584 19.481 -25.734 1.00 0.00 O ATOM 2415 CB MET B 57 5.851 16.980 -27.672 1.00 0.00 C ATOM 2416 CG MET B 57 6.161 15.491 -27.365 1.00 0.00 C ATOM 2417 SD MET B 57 7.753 15.055 -28.126 1.00 0.00 S ATOM 2418 CE MET B 57 8.325 13.846 -26.899 1.00 0.00 C ATOM 0 H MET B 57 3.354 17.329 -27.478 1.00 0.00 H new ATOM 0 HA MET B 57 5.517 17.170 -25.561 1.00 0.00 H new ATOM 0 HB2 MET B 57 5.188 17.043 -28.535 1.00 0.00 H new ATOM 0 HB3 MET B 57 6.773 17.496 -27.940 1.00 0.00 H new ATOM 0 HG2 MET B 57 6.200 15.328 -26.288 1.00 0.00 H new ATOM 0 HG3 MET B 57 5.369 14.852 -27.755 1.00 0.00 H new ATOM 0 HE1 MET B 57 8.756 12.985 -27.410 1.00 0.00 H new ATOM 0 HE2 MET B 57 9.080 14.305 -26.261 1.00 0.00 H new ATOM 0 HE3 MET B 57 7.483 13.521 -26.288 1.00 0.00 H new ATOM 2428 N GLU B 58 4.924 20.039 -27.020 1.00 0.00 N ATOM 2429 CA GLU B 58 5.330 21.464 -26.913 1.00 0.00 C ATOM 2430 C GLU B 58 5.358 21.781 -25.430 1.00 0.00 C ATOM 2431 O GLU B 58 6.181 22.527 -24.937 1.00 0.00 O ATOM 2432 CB GLU B 58 4.293 22.365 -27.586 1.00 0.00 C ATOM 2433 CG GLU B 58 4.206 22.021 -29.065 1.00 0.00 C ATOM 2434 CD GLU B 58 3.172 22.926 -29.742 1.00 0.00 C ATOM 2435 OE1 GLU B 58 3.546 24.010 -30.162 1.00 0.00 O ATOM 2436 OE2 GLU B 58 2.025 22.519 -29.831 1.00 0.00 O ATOM 0 H GLU B 58 4.101 19.850 -27.592 1.00 0.00 H new ATOM 0 HA GLU B 58 6.294 21.631 -27.394 1.00 0.00 H new ATOM 0 HB2 GLU B 58 3.320 22.233 -27.113 1.00 0.00 H new ATOM 0 HB3 GLU B 58 4.569 23.412 -27.461 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.180 22.149 -29.537 1.00 0.00 H new ATOM 0 HG3 GLU B 58 3.926 20.975 -29.190 1.00 0.00 H new ATOM 2443 N THR B 59 4.433 21.200 -24.728 1.00 0.00 N ATOM 2444 CA THR B 59 4.333 21.420 -23.268 1.00 0.00 C ATOM 2445 C THR B 59 5.303 20.523 -22.477 1.00 0.00 C ATOM 2446 O THR B 59 5.993 20.984 -21.589 1.00 0.00 O ATOM 2447 CB THR B 59 2.901 21.100 -22.847 1.00 0.00 C ATOM 2448 OG1 THR B 59 1.997 21.613 -23.817 1.00 0.00 O ATOM 2449 CG2 THR B 59 2.609 21.731 -21.498 1.00 0.00 C ATOM 0 H THR B 59 3.729 20.570 -25.114 1.00 0.00 H new ATOM 0 HA THR B 59 4.598 22.455 -23.051 1.00 0.00 H new ATOM 0 HB THR B 59 2.781 20.019 -22.771 1.00 0.00 H new ATOM 0 HG1 THR B 59 1.077 21.407 -23.549 1.00 0.00 H new ATOM 0 HG21 THR B 59 1.586 21.500 -21.202 1.00 0.00 H new ATOM 0 HG22 THR B 59 3.300 21.335 -20.754 1.00 0.00 H new ATOM 0 HG23 THR B 59 2.731 22.812 -21.568 1.00 0.00 H new ATOM 2457 N LEU B 60 5.332 19.243 -22.754 1.00 0.00 N ATOM 2458 CA LEU B 60 6.223 18.328 -21.976 1.00 0.00 C ATOM 2459 C LEU B 60 7.601 18.243 -22.614 1.00 0.00 C ATOM 2460 O LEU B 60 8.544 17.788 -21.996 1.00 0.00 O ATOM 2461 CB LEU B 60 5.617 16.922 -21.939 1.00 0.00 C ATOM 2462 CG LEU B 60 4.199 16.956 -21.358 1.00 0.00 C ATOM 2463 CD1 LEU B 60 3.687 15.518 -21.230 1.00 0.00 C ATOM 2464 CD2 LEU B 60 4.206 17.626 -19.972 1.00 0.00 C ATOM 0 H LEU B 60 4.779 18.793 -23.483 1.00 0.00 H new ATOM 0 HA LEU B 60 6.317 18.727 -20.966 1.00 0.00 H new ATOM 0 HB2 LEU B 60 5.593 16.505 -22.946 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.246 16.266 -21.337 1.00 0.00 H new ATOM 0 HG LEU B 60 3.549 17.530 -22.018 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.678 15.526 -20.817 1.00 0.00 H new ATOM 0 HD12 LEU B 60 3.673 15.048 -22.213 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.345 14.955 -20.568 1.00 0.00 H new ATOM 0 HD21 LEU B 60 3.193 17.643 -19.571 1.00 0.00 H new ATOM 0 HD22 LEU B 60 4.853 17.063 -19.299 1.00 0.00 H new ATOM 0 HD23 LEU B 60 4.578 18.647 -20.063 1.00 0.00 H new ATOM 2476 N ASP B 61 7.754 18.677 -23.831 1.00 0.00 N ATOM 2477 CA ASP B 61 9.112 18.596 -24.444 1.00 0.00 C ATOM 2478 C ASP B 61 9.919 19.761 -23.921 1.00 0.00 C ATOM 2479 O ASP B 61 10.327 20.642 -24.651 1.00 0.00 O ATOM 2480 CB ASP B 61 9.049 18.662 -25.968 1.00 0.00 C ATOM 2481 CG ASP B 61 10.407 18.253 -26.540 1.00 0.00 C ATOM 2482 OD1 ASP B 61 11.321 18.048 -25.756 1.00 0.00 O ATOM 2483 OD2 ASP B 61 10.509 18.150 -27.750 1.00 0.00 O ATOM 0 H ASP B 61 7.021 19.075 -24.418 1.00 0.00 H new ATOM 0 HA ASP B 61 9.570 17.643 -24.179 1.00 0.00 H new ATOM 0 HB2 ASP B 61 8.268 18.000 -26.342 1.00 0.00 H new ATOM 0 HB3 ASP B 61 8.793 19.671 -26.291 1.00 0.00 H new ATOM 2488 N GLU B 62 10.135 19.768 -22.646 1.00 0.00 N ATOM 2489 CA GLU B 62 10.902 20.871 -22.026 1.00 0.00 C ATOM 2490 C GLU B 62 12.289 20.910 -22.661 1.00 0.00 C ATOM 2491 O GLU B 62 12.823 21.963 -22.944 1.00 0.00 O ATOM 2492 CB GLU B 62 11.022 20.610 -20.528 1.00 0.00 C ATOM 2493 CG GLU B 62 9.625 20.421 -19.934 1.00 0.00 C ATOM 2494 CD GLU B 62 9.747 20.168 -18.431 1.00 0.00 C ATOM 2495 OE1 GLU B 62 10.860 19.970 -17.972 1.00 0.00 O ATOM 2496 OE2 GLU B 62 8.725 20.169 -17.765 1.00 0.00 O ATOM 0 H GLU B 62 9.810 19.050 -21.998 1.00 0.00 H new ATOM 0 HA GLU B 62 10.399 21.825 -22.183 1.00 0.00 H new ATOM 0 HB2 GLU B 62 11.629 19.722 -20.349 1.00 0.00 H new ATOM 0 HB3 GLU B 62 11.527 21.444 -20.041 1.00 0.00 H new ATOM 0 HG2 GLU B 62 9.016 21.306 -20.117 1.00 0.00 H new ATOM 0 HG3 GLU B 62 9.122 19.583 -20.416 1.00 0.00 H new ATOM 2503 N ASP B 63 12.868 19.769 -22.909 1.00 0.00 N ATOM 2504 CA ASP B 63 14.206 19.749 -23.555 1.00 0.00 C ATOM 2505 C ASP B 63 14.034 20.204 -25.004 1.00 0.00 C ATOM 2506 O ASP B 63 14.968 20.633 -25.653 1.00 0.00 O ATOM 2507 CB ASP B 63 14.769 18.326 -23.536 1.00 0.00 C ATOM 2508 CG ASP B 63 15.031 17.898 -22.091 1.00 0.00 C ATOM 2509 OD1 ASP B 63 15.523 18.713 -21.330 1.00 0.00 O ATOM 2510 OD2 ASP B 63 14.729 16.760 -21.771 1.00 0.00 O ATOM 0 H ASP B 63 12.473 18.854 -22.693 1.00 0.00 H new ATOM 0 HA ASP B 63 14.892 20.407 -23.022 1.00 0.00 H new ATOM 0 HB2 ASP B 63 14.066 17.639 -24.008 1.00 0.00 H new ATOM 0 HB3 ASP B 63 15.693 18.282 -24.112 1.00 0.00 H new ATOM 2515 N GLY B 64 12.828 20.118 -25.509 1.00 0.00 N ATOM 2516 CA GLY B 64 12.567 20.550 -26.916 1.00 0.00 C ATOM 2517 C GLY B 64 13.306 19.625 -27.889 1.00 0.00 C ATOM 2518 O GLY B 64 13.708 20.041 -28.957 1.00 0.00 O ATOM 0 H GLY B 64 12.013 19.767 -25.007 1.00 0.00 H new ATOM 0 HA2 GLY B 64 11.497 20.527 -27.120 1.00 0.00 H new ATOM 0 HA3 GLY B 64 12.897 21.579 -27.057 1.00 0.00 H new ATOM 2522 N ASP B 65 13.500 18.378 -27.524 1.00 0.00 N ATOM 2523 CA ASP B 65 14.228 17.419 -28.422 1.00 0.00 C ATOM 2524 C ASP B 65 13.258 16.373 -28.980 1.00 0.00 C ATOM 2525 O ASP B 65 13.667 15.353 -29.499 1.00 0.00 O ATOM 2526 CB ASP B 65 15.323 16.723 -27.614 1.00 0.00 C ATOM 2527 CG ASP B 65 14.689 16.018 -26.421 1.00 0.00 C ATOM 2528 OD1 ASP B 65 13.590 16.398 -26.061 1.00 0.00 O ATOM 2529 OD2 ASP B 65 15.311 15.113 -25.889 1.00 0.00 O ATOM 0 H ASP B 65 13.184 17.981 -26.639 1.00 0.00 H new ATOM 0 HA ASP B 65 14.667 17.966 -29.256 1.00 0.00 H new ATOM 0 HB2 ASP B 65 15.852 16.003 -28.239 1.00 0.00 H new ATOM 0 HB3 ASP B 65 16.059 17.451 -27.273 1.00 0.00 H new ATOM 2534 N GLY B 66 11.981 16.604 -28.865 1.00 0.00 N ATOM 2535 CA GLY B 66 10.997 15.604 -29.375 1.00 0.00 C ATOM 2536 C GLY B 66 11.031 14.376 -28.461 1.00 0.00 C ATOM 2537 O GLY B 66 10.589 13.301 -28.812 1.00 0.00 O ATOM 0 H GLY B 66 11.575 17.438 -28.442 1.00 0.00 H new ATOM 0 HA2 GLY B 66 9.996 16.034 -29.394 1.00 0.00 H new ATOM 0 HA3 GLY B 66 11.241 15.321 -30.399 1.00 0.00 H new ATOM 2541 N GLU B 67 11.572 14.554 -27.290 1.00 0.00 N ATOM 2542 CA GLU B 67 11.682 13.456 -26.294 1.00 0.00 C ATOM 2543 C GLU B 67 11.677 14.079 -24.892 1.00 0.00 C ATOM 2544 O GLU B 67 12.295 15.097 -24.662 1.00 0.00 O ATOM 2545 CB GLU B 67 12.997 12.707 -26.534 1.00 0.00 C ATOM 2546 CG GLU B 67 13.221 11.654 -25.450 1.00 0.00 C ATOM 2547 CD GLU B 67 14.477 10.850 -25.788 1.00 0.00 C ATOM 2548 OE1 GLU B 67 14.358 9.893 -26.536 1.00 0.00 O ATOM 2549 OE2 GLU B 67 15.535 11.207 -25.297 1.00 0.00 O ATOM 0 H GLU B 67 11.955 15.445 -26.973 1.00 0.00 H new ATOM 0 HA GLU B 67 10.850 12.758 -26.387 1.00 0.00 H new ATOM 0 HB2 GLU B 67 12.976 12.230 -27.514 1.00 0.00 H new ATOM 0 HB3 GLU B 67 13.828 13.413 -26.541 1.00 0.00 H new ATOM 0 HG2 GLU B 67 13.331 12.133 -24.477 1.00 0.00 H new ATOM 0 HG3 GLU B 67 12.357 10.993 -25.384 1.00 0.00 H new ATOM 2556 N CYS B 68 10.994 13.479 -23.953 1.00 0.00 N ATOM 2557 CA CYS B 68 10.949 14.031 -22.559 1.00 0.00 C ATOM 2558 C CYS B 68 11.647 13.037 -21.630 1.00 0.00 C ATOM 2559 O CYS B 68 11.535 11.838 -21.788 1.00 0.00 O ATOM 2560 CB CYS B 68 9.476 14.261 -22.125 1.00 0.00 C ATOM 2561 SG CYS B 68 8.365 13.995 -23.533 1.00 0.00 S ATOM 0 H CYS B 68 10.459 12.621 -24.090 1.00 0.00 H new ATOM 0 HA CYS B 68 11.460 14.993 -22.512 1.00 0.00 H new ATOM 0 HB2 CYS B 68 9.217 13.581 -21.314 1.00 0.00 H new ATOM 0 HB3 CYS B 68 9.355 15.274 -21.742 1.00 0.00 H new ATOM 0 HG CYS B 68 8.468 12.765 -23.941 1.00 0.00 H new ATOM 2567 N ASP B 69 12.374 13.528 -20.673 1.00 0.00 N ATOM 2568 CA ASP B 69 13.089 12.616 -19.746 1.00 0.00 C ATOM 2569 C ASP B 69 12.087 12.024 -18.774 1.00 0.00 C ATOM 2570 O ASP B 69 11.009 12.555 -18.586 1.00 0.00 O ATOM 2571 CB ASP B 69 14.146 13.395 -18.961 1.00 0.00 C ATOM 2572 CG ASP B 69 15.278 13.807 -19.900 1.00 0.00 C ATOM 2573 OD1 ASP B 69 15.586 13.040 -20.796 1.00 0.00 O ATOM 2574 OD2 ASP B 69 15.821 14.882 -19.703 1.00 0.00 O ATOM 0 H ASP B 69 12.505 14.523 -20.492 1.00 0.00 H new ATOM 0 HA ASP B 69 13.576 11.825 -20.317 1.00 0.00 H new ATOM 0 HB2 ASP B 69 13.698 14.278 -18.505 1.00 0.00 H new ATOM 0 HB3 ASP B 69 14.537 12.781 -18.150 1.00 0.00 H new ATOM 2579 N PHE B 70 12.431 10.936 -18.140 1.00 0.00 N ATOM 2580 CA PHE B 70 11.506 10.322 -17.164 1.00 0.00 C ATOM 2581 C PHE B 70 10.967 11.434 -16.256 1.00 0.00 C ATOM 2582 O PHE B 70 9.822 11.435 -15.875 1.00 0.00 O ATOM 2583 CB PHE B 70 12.289 9.273 -16.359 1.00 0.00 C ATOM 2584 CG PHE B 70 11.586 8.951 -15.065 1.00 0.00 C ATOM 2585 CD1 PHE B 70 10.208 8.734 -15.053 1.00 0.00 C ATOM 2586 CD2 PHE B 70 12.318 8.865 -13.877 1.00 0.00 C ATOM 2587 CE1 PHE B 70 9.560 8.434 -13.859 1.00 0.00 C ATOM 2588 CE2 PHE B 70 11.670 8.566 -12.680 1.00 0.00 C ATOM 2589 CZ PHE B 70 10.289 8.351 -12.668 1.00 0.00 C ATOM 0 H PHE B 70 13.319 10.449 -18.261 1.00 0.00 H new ATOM 0 HA PHE B 70 10.665 9.831 -17.653 1.00 0.00 H new ATOM 0 HB2 PHE B 70 12.402 8.365 -16.951 1.00 0.00 H new ATOM 0 HB3 PHE B 70 13.292 9.644 -16.150 1.00 0.00 H new ATOM 0 HD1 PHE B 70 9.644 8.799 -15.972 1.00 0.00 H new ATOM 0 HD2 PHE B 70 13.385 9.030 -13.887 1.00 0.00 H new ATOM 0 HE1 PHE B 70 8.493 8.265 -13.852 1.00 0.00 H new ATOM 0 HE2 PHE B 70 12.235 8.500 -11.762 1.00 0.00 H new ATOM 0 HZ PHE B 70 9.785 8.121 -11.741 1.00 0.00 H new ATOM 2599 N GLN B 71 11.794 12.390 -15.941 1.00 0.00 N ATOM 2600 CA GLN B 71 11.356 13.532 -15.091 1.00 0.00 C ATOM 2601 C GLN B 71 10.207 14.301 -15.761 1.00 0.00 C ATOM 2602 O GLN B 71 9.204 14.592 -15.144 1.00 0.00 O ATOM 2603 CB GLN B 71 12.550 14.470 -14.888 1.00 0.00 C ATOM 2604 CG GLN B 71 12.091 15.777 -14.234 1.00 0.00 C ATOM 2605 CD GLN B 71 13.312 16.575 -13.774 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.399 16.042 -13.676 1.00 0.00 O ATOM 2607 NE2 GLN B 71 13.176 17.839 -13.482 1.00 0.00 N ATOM 0 H GLN B 71 12.768 12.429 -16.240 1.00 0.00 H new ATOM 0 HA GLN B 71 10.999 13.153 -14.133 1.00 0.00 H new ATOM 0 HB2 GLN B 71 13.300 13.986 -14.263 1.00 0.00 H new ATOM 0 HB3 GLN B 71 13.023 14.681 -15.847 1.00 0.00 H new ATOM 0 HG2 GLN B 71 11.506 16.364 -14.942 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.443 15.563 -13.384 1.00 0.00 H new ATOM 0 HE21 GLN B 71 12.263 18.286 -13.564 1.00 0.00 H new ATOM 0 HE22 GLN B 71 13.983 18.380 -13.171 1.00 0.00 H new ATOM 2616 N GLU B 72 10.353 14.650 -17.011 1.00 0.00 N ATOM 2617 CA GLU B 72 9.279 15.427 -17.695 1.00 0.00 C ATOM 2618 C GLU B 72 7.972 14.630 -17.701 1.00 0.00 C ATOM 2619 O GLU B 72 6.900 15.169 -17.496 1.00 0.00 O ATOM 2620 CB GLU B 72 9.717 15.719 -19.129 1.00 0.00 C ATOM 2621 CG GLU B 72 10.854 16.742 -19.121 1.00 0.00 C ATOM 2622 CD GLU B 72 11.463 16.844 -20.522 1.00 0.00 C ATOM 2623 OE1 GLU B 72 10.840 17.454 -21.375 1.00 0.00 O ATOM 2624 OE2 GLU B 72 12.541 16.306 -20.719 1.00 0.00 O ATOM 0 H GLU B 72 11.166 14.432 -17.586 1.00 0.00 H new ATOM 0 HA GLU B 72 9.111 16.363 -17.162 1.00 0.00 H new ATOM 0 HB2 GLU B 72 10.045 14.800 -19.614 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.875 16.101 -19.706 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.479 17.715 -18.805 1.00 0.00 H new ATOM 0 HG3 GLU B 72 11.618 16.446 -18.402 1.00 0.00 H new ATOM 2631 N PHE B 73 8.055 13.356 -17.915 1.00 0.00 N ATOM 2632 CA PHE B 73 6.831 12.512 -17.920 1.00 0.00 C ATOM 2633 C PHE B 73 6.179 12.561 -16.532 1.00 0.00 C ATOM 2634 O PHE B 73 4.971 12.575 -16.395 1.00 0.00 O ATOM 2635 CB PHE B 73 7.220 11.065 -18.277 1.00 0.00 C ATOM 2636 CG PHE B 73 6.148 10.107 -17.799 1.00 0.00 C ATOM 2637 CD1 PHE B 73 4.915 10.050 -18.457 1.00 0.00 C ATOM 2638 CD2 PHE B 73 6.384 9.300 -16.678 1.00 0.00 C ATOM 2639 CE1 PHE B 73 3.918 9.182 -17.998 1.00 0.00 C ATOM 2640 CE2 PHE B 73 5.386 8.435 -16.216 1.00 0.00 C ATOM 2641 CZ PHE B 73 4.153 8.375 -16.876 1.00 0.00 C ATOM 0 H PHE B 73 8.926 12.854 -18.089 1.00 0.00 H new ATOM 0 HA PHE B 73 6.120 12.883 -18.658 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.350 10.970 -19.355 1.00 0.00 H new ATOM 0 HB3 PHE B 73 8.176 10.813 -17.818 1.00 0.00 H new ATOM 0 HD1 PHE B 73 4.733 10.675 -19.318 1.00 0.00 H new ATOM 0 HD2 PHE B 73 7.336 9.346 -16.171 1.00 0.00 H new ATOM 0 HE1 PHE B 73 2.967 9.134 -18.508 1.00 0.00 H new ATOM 0 HE2 PHE B 73 5.567 7.814 -15.351 1.00 0.00 H new ATOM 0 HZ PHE B 73 3.382 7.707 -16.521 1.00 0.00 H new ATOM 2651 N MET B 74 6.980 12.555 -15.512 1.00 0.00 N ATOM 2652 CA MET B 74 6.443 12.562 -14.126 1.00 0.00 C ATOM 2653 C MET B 74 5.593 13.802 -13.873 1.00 0.00 C ATOM 2654 O MET B 74 4.584 13.749 -13.196 1.00 0.00 O ATOM 2655 CB MET B 74 7.600 12.523 -13.127 1.00 0.00 C ATOM 2656 CG MET B 74 8.218 11.122 -13.109 1.00 0.00 C ATOM 2657 SD MET B 74 7.032 9.938 -12.412 1.00 0.00 S ATOM 2658 CE MET B 74 6.957 10.624 -10.743 1.00 0.00 C ATOM 0 H MET B 74 7.998 12.545 -15.578 1.00 0.00 H new ATOM 0 HA MET B 74 5.813 11.682 -13.999 1.00 0.00 H new ATOM 0 HB2 MET B 74 8.355 13.261 -13.400 1.00 0.00 H new ATOM 0 HB3 MET B 74 7.243 12.786 -12.131 1.00 0.00 H new ATOM 0 HG2 MET B 74 8.493 10.823 -14.120 1.00 0.00 H new ATOM 0 HG3 MET B 74 9.133 11.126 -12.517 1.00 0.00 H new ATOM 0 HE1 MET B 74 6.661 9.844 -10.042 1.00 0.00 H new ATOM 0 HE2 MET B 74 7.937 11.010 -10.464 1.00 0.00 H new ATOM 0 HE3 MET B 74 6.227 11.433 -10.715 1.00 0.00 H new ATOM 2668 N ALA B 75 5.999 14.925 -14.369 1.00 0.00 N ATOM 2669 CA ALA B 75 5.206 16.152 -14.106 1.00 0.00 C ATOM 2670 C ALA B 75 3.836 16.062 -14.782 1.00 0.00 C ATOM 2671 O ALA B 75 2.851 16.564 -14.282 1.00 0.00 O ATOM 2672 CB ALA B 75 5.971 17.386 -14.608 1.00 0.00 C ATOM 0 H ALA B 75 6.835 15.051 -14.939 1.00 0.00 H new ATOM 0 HA ALA B 75 5.050 16.245 -13.031 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.383 18.283 -14.412 1.00 0.00 H new ATOM 0 HB2 ALA B 75 6.927 17.458 -14.089 1.00 0.00 H new ATOM 0 HB3 ALA B 75 6.146 17.294 -15.680 1.00 0.00 H new ATOM 2678 N PHE B 76 3.761 15.434 -15.911 1.00 0.00 N ATOM 2679 CA PHE B 76 2.451 15.317 -16.616 1.00 0.00 C ATOM 2680 C PHE B 76 1.445 14.562 -15.753 1.00 0.00 C ATOM 2681 O PHE B 76 0.264 14.822 -15.779 1.00 0.00 O ATOM 2682 CB PHE B 76 2.664 14.575 -17.934 1.00 0.00 C ATOM 2683 CG PHE B 76 1.342 14.399 -18.643 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.619 15.523 -19.064 1.00 0.00 C ATOM 2685 CD2 PHE B 76 0.839 13.114 -18.886 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -0.604 15.360 -19.725 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -0.383 12.953 -19.545 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.104 14.075 -19.964 1.00 0.00 C ATOM 0 H PHE B 76 4.549 14.992 -16.384 1.00 0.00 H new ATOM 0 HA PHE B 76 2.056 16.314 -16.810 1.00 0.00 H new ATOM 0 HB2 PHE B 76 3.355 15.131 -18.567 1.00 0.00 H new ATOM 0 HB3 PHE B 76 3.118 13.602 -17.745 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.005 16.514 -18.879 1.00 0.00 H new ATOM 0 HD2 PHE B 76 1.396 12.247 -18.564 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -1.162 16.226 -20.050 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -0.770 11.962 -19.730 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.048 13.950 -20.473 1.00 0.00 H new ATOM 2698 N VAL B 77 1.904 13.609 -15.019 1.00 0.00 N ATOM 2699 CA VAL B 77 0.986 12.798 -14.166 1.00 0.00 C ATOM 2700 C VAL B 77 0.435 13.657 -13.027 1.00 0.00 C ATOM 2701 O VAL B 77 -0.681 13.479 -12.594 1.00 0.00 O ATOM 2702 CB VAL B 77 1.752 11.590 -13.585 1.00 0.00 C ATOM 2703 CG1 VAL B 77 0.823 10.375 -13.462 1.00 0.00 C ATOM 2704 CG2 VAL B 77 2.917 11.250 -14.510 1.00 0.00 C ATOM 0 H VAL B 77 2.888 13.344 -14.964 1.00 0.00 H new ATOM 0 HA VAL B 77 0.155 12.441 -14.774 1.00 0.00 H new ATOM 0 HB VAL B 77 2.124 11.845 -12.593 1.00 0.00 H new ATOM 0 HG11 VAL B 77 1.379 9.532 -13.051 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -0.009 10.618 -12.801 1.00 0.00 H new ATOM 0 HG13 VAL B 77 0.438 10.110 -14.447 1.00 0.00 H new ATOM 0 HG21 VAL B 77 3.464 10.398 -14.108 1.00 0.00 H new ATOM 0 HG22 VAL B 77 2.535 11.001 -15.500 1.00 0.00 H new ATOM 0 HG23 VAL B 77 3.585 12.108 -14.584 1.00 0.00 H new ATOM 2714 N SER B 78 1.220 14.562 -12.521 1.00 0.00 N ATOM 2715 CA SER B 78 0.741 15.406 -11.391 1.00 0.00 C ATOM 2716 C SER B 78 -0.393 16.321 -11.850 1.00 0.00 C ATOM 2717 O SER B 78 -1.345 16.545 -11.129 1.00 0.00 O ATOM 2718 CB SER B 78 1.895 16.266 -10.864 1.00 0.00 C ATOM 2719 OG SER B 78 2.617 16.811 -11.959 1.00 0.00 O ATOM 0 H SER B 78 2.170 14.755 -12.838 1.00 0.00 H new ATOM 0 HA SER B 78 0.374 14.751 -10.601 1.00 0.00 H new ATOM 0 HB2 SER B 78 1.508 17.067 -10.235 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.557 15.664 -10.242 1.00 0.00 H new ATOM 0 HG SER B 78 2.179 16.558 -12.798 1.00 0.00 H new ATOM 2725 N MET B 79 -0.297 16.875 -13.025 1.00 0.00 N ATOM 2726 CA MET B 79 -1.375 17.800 -13.483 1.00 0.00 C ATOM 2727 C MET B 79 -2.637 17.030 -13.897 1.00 0.00 C ATOM 2728 O MET B 79 -3.740 17.440 -13.596 1.00 0.00 O ATOM 2729 CB MET B 79 -0.858 18.654 -14.645 1.00 0.00 C ATOM 2730 CG MET B 79 -0.292 17.748 -15.737 1.00 0.00 C ATOM 2731 SD MET B 79 0.513 18.751 -17.010 1.00 0.00 S ATOM 2732 CE MET B 79 -0.952 19.657 -17.552 1.00 0.00 C ATOM 0 H MET B 79 0.470 16.732 -13.682 1.00 0.00 H new ATOM 0 HA MET B 79 -1.649 18.450 -12.652 1.00 0.00 H new ATOM 0 HB2 MET B 79 -1.666 19.265 -15.048 1.00 0.00 H new ATOM 0 HB3 MET B 79 -0.087 19.339 -14.291 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.424 17.048 -15.306 1.00 0.00 H new ATOM 0 HG3 MET B 79 -1.092 17.154 -16.180 1.00 0.00 H new ATOM 0 HE1 MET B 79 -0.936 19.759 -18.637 1.00 0.00 H new ATOM 0 HE2 MET B 79 -1.848 19.113 -17.252 1.00 0.00 H new ATOM 0 HE3 MET B 79 -0.958 20.646 -17.094 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.504 15.919 -14.567 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.730 15.157 -14.972 1.00 0.00 C ATOM 2744 C VAL B 80 -4.433 14.636 -13.724 1.00 0.00 C ATOM 2745 O VAL B 80 -5.645 14.585 -13.646 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.370 13.966 -15.862 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -4.656 13.261 -16.305 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -2.616 14.446 -17.096 1.00 0.00 C ATOM 0 H VAL B 80 -1.615 15.506 -14.851 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.381 15.830 -15.530 1.00 0.00 H new ATOM 0 HB VAL B 80 -2.739 13.277 -15.300 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -4.405 12.411 -16.940 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.200 12.911 -15.428 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.280 13.959 -16.863 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -2.364 13.591 -17.724 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.243 15.137 -17.659 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -1.701 14.953 -16.789 1.00 0.00 H new ATOM 2758 N THR B 81 -3.671 14.234 -12.756 1.00 0.00 N ATOM 2759 CA THR B 81 -4.262 13.689 -11.508 1.00 0.00 C ATOM 2760 C THR B 81 -5.137 14.751 -10.872 1.00 0.00 C ATOM 2761 O THR B 81 -6.204 14.475 -10.364 1.00 0.00 O ATOM 2762 CB THR B 81 -3.151 13.318 -10.534 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.325 12.319 -11.109 1.00 0.00 O ATOM 2764 CG2 THR B 81 -3.772 12.820 -9.224 1.00 0.00 C ATOM 0 H THR B 81 -2.651 14.259 -12.774 1.00 0.00 H new ATOM 0 HA THR B 81 -4.853 12.804 -11.742 1.00 0.00 H new ATOM 0 HB THR B 81 -2.536 14.193 -10.322 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.462 12.711 -11.358 1.00 0.00 H new ATOM 0 HG21 THR B 81 -2.980 12.553 -8.524 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.389 13.608 -8.791 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.389 11.944 -9.424 1.00 0.00 H new ATOM 2772 N THR B 82 -4.698 15.966 -10.902 1.00 0.00 N ATOM 2773 CA THR B 82 -5.506 17.053 -10.310 1.00 0.00 C ATOM 2774 C THR B 82 -6.884 17.010 -10.973 1.00 0.00 C ATOM 2775 O THR B 82 -7.909 17.153 -10.329 1.00 0.00 O ATOM 2776 CB THR B 82 -4.821 18.386 -10.598 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.438 18.276 -10.286 1.00 0.00 O ATOM 2778 CG2 THR B 82 -5.441 19.476 -9.735 1.00 0.00 C ATOM 0 H THR B 82 -3.811 16.256 -11.313 1.00 0.00 H new ATOM 0 HA THR B 82 -5.606 16.937 -9.231 1.00 0.00 H new ATOM 0 HB THR B 82 -4.947 18.639 -11.651 1.00 0.00 H new ATOM 0 HG1 THR B 82 -2.992 19.129 -10.471 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.950 20.427 -9.942 1.00 0.00 H new ATOM 0 HG22 THR B 82 -6.504 19.559 -9.962 1.00 0.00 H new ATOM 0 HG23 THR B 82 -5.313 19.223 -8.682 1.00 0.00 H new ATOM 2786 N ALA B 83 -6.913 16.767 -12.255 1.00 0.00 N ATOM 2787 CA ALA B 83 -8.216 16.660 -12.960 1.00 0.00 C ATOM 2788 C ALA B 83 -8.995 15.517 -12.315 1.00 0.00 C ATOM 2789 O ALA B 83 -10.199 15.562 -12.182 1.00 0.00 O ATOM 2790 CB ALA B 83 -7.987 16.346 -14.446 1.00 0.00 C ATOM 0 H ALA B 83 -6.089 16.638 -12.842 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.765 17.598 -12.885 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -8.948 16.270 -14.954 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.399 17.144 -14.900 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.451 15.402 -14.540 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.292 14.490 -11.911 1.00 0.00 N ATOM 2797 CA CYS B 84 -8.950 13.319 -11.268 1.00 0.00 C ATOM 2798 C CYS B 84 -9.676 13.772 -9.997 1.00 0.00 C ATOM 2799 O CYS B 84 -10.722 13.261 -9.660 1.00 0.00 O ATOM 2800 CB CYS B 84 -7.888 12.273 -10.906 1.00 0.00 C ATOM 2801 SG CYS B 84 -8.671 10.647 -10.774 1.00 0.00 S ATOM 0 H CYS B 84 -7.279 14.415 -12.002 1.00 0.00 H new ATOM 0 HA CYS B 84 -9.671 12.882 -11.960 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -7.107 12.253 -11.666 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -7.408 12.536 -9.963 1.00 0.00 H new ATOM 0 HG CYS B 84 -7.774 9.757 -10.469 1.00 0.00 H new ATOM 2807 N HIS B 85 -9.136 14.727 -9.288 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.819 15.190 -8.047 1.00 0.00 C ATOM 2809 C HIS B 85 -11.202 15.700 -8.419 1.00 0.00 C ATOM 2810 O HIS B 85 -12.176 15.452 -7.736 1.00 0.00 O ATOM 2811 CB HIS B 85 -9.012 16.329 -7.420 1.00 0.00 C ATOM 2812 CG HIS B 85 -9.735 16.858 -6.211 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -10.361 18.098 -6.207 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -9.942 16.330 -4.961 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -10.909 18.271 -4.990 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -10.682 17.224 -4.196 1.00 0.00 N ATOM 0 H HIS B 85 -8.261 15.202 -9.511 1.00 0.00 H new ATOM 0 HA HIS B 85 -9.900 14.369 -7.334 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -8.022 15.973 -7.136 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.867 17.128 -8.147 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -9.585 15.368 -4.624 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -11.464 19.149 -4.693 1.00 0.00 H new ATOM 0 HE2 HIS B 85 -10.987 17.104 -3.230 1.00 0.00 H new ATOM 2825 N GLU B 86 -11.297 16.388 -9.512 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.617 16.896 -9.954 1.00 0.00 C ATOM 2827 C GLU B 86 -13.519 15.709 -10.308 1.00 0.00 C ATOM 2828 O GLU B 86 -14.702 15.709 -10.035 1.00 0.00 O ATOM 2829 CB GLU B 86 -12.430 17.792 -11.180 1.00 0.00 C ATOM 2830 CG GLU B 86 -11.732 19.087 -10.755 1.00 0.00 C ATOM 2831 CD GLU B 86 -11.505 19.976 -11.979 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -11.996 19.628 -13.039 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -10.846 20.993 -11.833 1.00 0.00 O ATOM 0 H GLU B 86 -10.514 16.623 -10.123 1.00 0.00 H new ATOM 0 HA GLU B 86 -13.079 17.475 -9.155 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.837 17.276 -11.935 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -13.396 18.017 -11.632 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -12.339 19.614 -10.018 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -10.779 18.858 -10.278 1.00 0.00 H new ATOM 2840 N PHE B 87 -12.965 14.705 -10.938 1.00 0.00 N ATOM 2841 CA PHE B 87 -13.779 13.517 -11.345 1.00 0.00 C ATOM 2842 C PHE B 87 -13.897 12.511 -10.194 1.00 0.00 C ATOM 2843 O PHE B 87 -14.822 11.723 -10.145 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.104 12.839 -12.539 1.00 0.00 C ATOM 2845 CG PHE B 87 -13.951 11.680 -13.012 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -14.943 11.889 -13.978 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -13.748 10.399 -12.484 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -15.730 10.817 -14.417 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -14.536 9.328 -12.924 1.00 0.00 C ATOM 2850 CZ PHE B 87 -15.527 9.537 -13.891 1.00 0.00 C ATOM 0 H PHE B 87 -11.978 14.656 -11.190 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.781 13.854 -11.612 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -12.968 13.557 -13.348 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -12.112 12.486 -12.256 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -15.101 12.877 -14.385 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -12.984 10.237 -11.738 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -16.494 10.979 -15.163 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -14.379 8.340 -12.517 1.00 0.00 H new ATOM 0 HZ PHE B 87 -16.134 8.711 -14.230 1.00 0.00 H new ATOM 2860 N PHE B 88 -12.973 12.518 -9.275 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.042 11.553 -8.146 1.00 0.00 C ATOM 2862 C PHE B 88 -14.326 11.791 -7.363 1.00 0.00 C ATOM 2863 O PHE B 88 -14.822 10.911 -6.691 1.00 0.00 O ATOM 2864 CB PHE B 88 -11.843 11.749 -7.218 1.00 0.00 C ATOM 2865 CG PHE B 88 -11.837 10.655 -6.174 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -12.519 10.836 -4.964 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -11.147 9.458 -6.417 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -12.513 9.823 -3.997 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -11.141 8.445 -5.450 1.00 0.00 C ATOM 2870 CZ PHE B 88 -11.824 8.627 -4.240 1.00 0.00 C ATOM 0 H PHE B 88 -12.173 13.151 -9.258 1.00 0.00 H new ATOM 0 HA PHE B 88 -13.028 10.537 -8.540 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -10.916 11.726 -7.792 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.896 12.726 -6.738 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -13.050 11.758 -4.777 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -10.621 9.318 -7.350 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -13.039 9.963 -3.064 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -10.610 7.523 -5.637 1.00 0.00 H new ATOM 0 HZ PHE B 88 -11.819 7.845 -3.495 1.00 0.00 H new ATOM 3114 N ARG X 104 21.514 21.159 2.997 1.00 0.00 N ATOM 3115 CA ARG X 104 20.873 19.893 2.560 1.00 0.00 C ATOM 3116 C ARG X 104 19.743 20.209 1.578 1.00 0.00 C ATOM 3117 O ARG X 104 19.550 19.517 0.593 1.00 0.00 O ATOM 3118 CB ARG X 104 20.308 19.176 3.784 1.00 0.00 C ATOM 3119 CG ARG X 104 21.467 18.674 4.644 1.00 0.00 C ATOM 3120 CD ARG X 104 20.922 18.089 5.942 1.00 0.00 C ATOM 3121 NE ARG X 104 22.052 17.552 6.750 1.00 0.00 N ATOM 3122 CZ ARG X 104 21.879 17.261 8.009 1.00 0.00 C ATOM 3123 NH1 ARG X 104 20.723 17.468 8.578 1.00 0.00 N ATOM 3124 NH2 ARG X 104 22.868 16.771 8.701 1.00 0.00 N ATOM 0 HA ARG X 104 21.606 19.254 2.068 1.00 0.00 H new ATOM 0 HB2 ARG X 104 19.678 19.854 4.360 1.00 0.00 H new ATOM 0 HB3 ARG X 104 19.679 18.341 3.475 1.00 0.00 H new ATOM 0 HG2 ARG X 104 22.035 17.918 4.102 1.00 0.00 H new ATOM 0 HG3 ARG X 104 22.153 19.492 4.862 1.00 0.00 H new ATOM 0 HD2 ARG X 104 20.389 18.855 6.505 1.00 0.00 H new ATOM 0 HD3 ARG X 104 20.206 17.297 5.725 1.00 0.00 H new ATOM 0 HE ARG X 104 22.965 17.411 6.317 1.00 0.00 H new ATOM 0 HH11 ARG X 104 19.951 17.859 8.038 1.00 0.00 H new ATOM 0 HH12 ARG X 104 20.591 17.239 9.563 1.00 0.00 H new ATOM 0 HH21 ARG X 104 23.773 16.616 8.258 1.00 0.00 H new ATOM 0 HH22 ARG X 104 22.737 16.542 9.686 1.00 0.00 H new ATOM 3138 N HIS X 105 18.991 21.247 1.828 1.00 0.00 N ATOM 3139 CA HIS X 105 17.886 21.577 0.893 1.00 0.00 C ATOM 3140 C HIS X 105 18.475 21.789 -0.500 1.00 0.00 C ATOM 3141 O HIS X 105 17.851 21.492 -1.499 1.00 0.00 O ATOM 3142 CB HIS X 105 17.131 22.829 1.370 1.00 0.00 C ATOM 3143 CG HIS X 105 17.939 24.084 1.153 1.00 0.00 C ATOM 3144 ND1 HIS X 105 18.535 24.394 -0.062 1.00 0.00 N ATOM 3145 CD2 HIS X 105 18.221 25.139 1.986 1.00 0.00 C ATOM 3146 CE1 HIS X 105 19.136 25.591 0.074 1.00 0.00 C ATOM 3147 NE2 HIS X 105 18.974 26.085 1.301 1.00 0.00 N ATOM 0 H HIS X 105 19.094 21.871 2.628 1.00 0.00 H new ATOM 0 HA HIS X 105 17.169 20.757 0.862 1.00 0.00 H new ATOM 0 HB2 HIS X 105 16.184 22.909 0.836 1.00 0.00 H new ATOM 0 HB3 HIS X 105 16.892 22.729 2.429 1.00 0.00 H new ATOM 0 HD2 HIS X 105 17.906 25.221 3.016 1.00 0.00 H new ATOM 0 HE1 HIS X 105 19.682 26.089 -0.714 1.00 0.00 H new ATOM 0 HE2 HIS X 105 19.328 26.971 1.662 1.00 0.00 H new ATOM 3156 N LYS X 106 19.688 22.273 -0.577 1.00 0.00 N ATOM 3157 CA LYS X 106 20.323 22.472 -1.909 1.00 0.00 C ATOM 3158 C LYS X 106 20.395 21.117 -2.612 1.00 0.00 C ATOM 3159 O LYS X 106 20.304 21.017 -3.820 1.00 0.00 O ATOM 3160 CB LYS X 106 21.743 23.021 -1.754 1.00 0.00 C ATOM 3161 CG LYS X 106 22.286 23.363 -3.139 1.00 0.00 C ATOM 3162 CD LYS X 106 23.706 23.912 -3.026 1.00 0.00 C ATOM 3163 CE LYS X 106 24.192 24.318 -4.417 1.00 0.00 C ATOM 3164 NZ LYS X 106 25.554 24.912 -4.316 1.00 0.00 N ATOM 0 H LYS X 106 20.263 22.537 0.223 1.00 0.00 H new ATOM 0 HA LYS X 106 19.733 23.184 -2.486 1.00 0.00 H new ATOM 0 HB2 LYS X 106 21.739 23.907 -1.120 1.00 0.00 H new ATOM 0 HB3 LYS X 106 22.383 22.284 -1.268 1.00 0.00 H new ATOM 0 HG2 LYS X 106 22.281 22.474 -3.770 1.00 0.00 H new ATOM 0 HG3 LYS X 106 21.641 24.098 -3.619 1.00 0.00 H new ATOM 0 HD2 LYS X 106 23.726 24.770 -2.354 1.00 0.00 H new ATOM 0 HD3 LYS X 106 24.369 23.159 -2.600 1.00 0.00 H new ATOM 0 HE2 LYS X 106 24.211 23.449 -5.075 1.00 0.00 H new ATOM 0 HE3 LYS X 106 23.502 25.037 -4.859 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 25.884 25.188 -5.263 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 25.522 25.751 -3.702 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 26.209 24.212 -3.912 1.00 0.00 H new ATOM 3178 N LYS X 107 20.562 20.066 -1.867 1.00 0.00 N ATOM 3179 CA LYS X 107 20.640 18.728 -2.504 1.00 0.00 C ATOM 3180 C LYS X 107 19.339 18.487 -3.265 1.00 0.00 C ATOM 3181 O LYS X 107 19.340 17.958 -4.357 1.00 0.00 O ATOM 3182 CB LYS X 107 20.823 17.655 -1.431 1.00 0.00 C ATOM 3183 CG LYS X 107 20.960 16.283 -2.095 1.00 0.00 C ATOM 3184 CD LYS X 107 21.141 15.210 -1.018 1.00 0.00 C ATOM 3185 CE LYS X 107 21.301 13.839 -1.681 1.00 0.00 C ATOM 3186 NZ LYS X 107 19.987 13.386 -2.213 1.00 0.00 N ATOM 0 H LYS X 107 20.647 20.074 -0.851 1.00 0.00 H new ATOM 0 HA LYS X 107 21.488 18.683 -3.187 1.00 0.00 H new ATOM 0 HB2 LYS X 107 21.709 17.871 -0.834 1.00 0.00 H new ATOM 0 HB3 LYS X 107 19.971 17.658 -0.751 1.00 0.00 H new ATOM 0 HG2 LYS X 107 20.075 16.067 -2.694 1.00 0.00 H new ATOM 0 HG3 LYS X 107 21.813 16.279 -2.774 1.00 0.00 H new ATOM 0 HD2 LYS X 107 22.017 15.435 -0.409 1.00 0.00 H new ATOM 0 HD3 LYS X 107 20.281 15.203 -0.349 1.00 0.00 H new ATOM 0 HE2 LYS X 107 22.031 13.897 -2.488 1.00 0.00 H new ATOM 0 HE3 LYS X 107 21.681 13.117 -0.959 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 20.057 12.392 -2.509 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 19.263 13.477 -1.472 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 19.722 13.973 -3.030 1.00 0.00 H new ATOM 3200 N LEU X 108 18.230 18.879 -2.701 1.00 0.00 N ATOM 3201 CA LEU X 108 16.928 18.681 -3.404 1.00 0.00 C ATOM 3202 C LEU X 108 16.850 19.606 -4.631 1.00 0.00 C ATOM 3203 O LEU X 108 16.157 19.321 -5.592 1.00 0.00 O ATOM 3204 CB LEU X 108 15.765 18.978 -2.449 1.00 0.00 C ATOM 3205 CG LEU X 108 14.420 18.791 -3.174 1.00 0.00 C ATOM 3206 CD1 LEU X 108 14.290 17.346 -3.686 1.00 0.00 C ATOM 3207 CD2 LEU X 108 13.276 19.103 -2.198 1.00 0.00 C ATOM 0 H LEU X 108 18.167 19.327 -1.787 1.00 0.00 H new ATOM 0 HA LEU X 108 16.857 17.645 -3.735 1.00 0.00 H new ATOM 0 HB2 LEU X 108 15.816 18.315 -1.585 1.00 0.00 H new ATOM 0 HB3 LEU X 108 15.845 19.998 -2.073 1.00 0.00 H new ATOM 0 HG LEU X 108 14.371 19.468 -4.027 1.00 0.00 H new ATOM 0 HD11 LEU X 108 13.335 17.226 -4.197 1.00 0.00 H new ATOM 0 HD12 LEU X 108 15.102 17.131 -4.380 1.00 0.00 H new ATOM 0 HD13 LEU X 108 14.341 16.656 -2.844 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.320 18.973 -2.705 1.00 0.00 H new ATOM 0 HD22 LEU X 108 13.330 18.426 -1.345 1.00 0.00 H new ATOM 0 HD23 LEU X 108 13.365 20.132 -1.850 1.00 0.00 H new ATOM 3219 N MET X 109 17.543 20.709 -4.618 1.00 0.00 N ATOM 3220 CA MET X 109 17.489 21.623 -5.795 1.00 0.00 C ATOM 3221 C MET X 109 18.029 20.903 -7.038 1.00 0.00 C ATOM 3222 O MET X 109 17.696 21.248 -8.153 1.00 0.00 O ATOM 3223 CB MET X 109 18.303 22.898 -5.523 1.00 0.00 C ATOM 3224 CG MET X 109 17.468 23.891 -4.704 1.00 0.00 C ATOM 3225 SD MET X 109 16.640 23.020 -3.348 1.00 0.00 S ATOM 3226 CE MET X 109 15.120 24.001 -3.328 1.00 0.00 C ATOM 0 H MET X 109 18.140 21.017 -3.851 1.00 0.00 H new ATOM 0 HA MET X 109 16.452 21.908 -5.972 1.00 0.00 H new ATOM 0 HB2 MET X 109 19.217 22.648 -4.984 1.00 0.00 H new ATOM 0 HB3 MET X 109 18.604 23.355 -6.466 1.00 0.00 H new ATOM 0 HG2 MET X 109 18.109 24.678 -4.306 1.00 0.00 H new ATOM 0 HG3 MET X 109 16.729 24.374 -5.344 1.00 0.00 H new ATOM 0 HE1 MET X 109 14.455 23.626 -2.550 1.00 0.00 H new ATOM 0 HE2 MET X 109 15.363 25.044 -3.126 1.00 0.00 H new ATOM 0 HE3 MET X 109 14.625 23.924 -4.296 1.00 0.00 H new ATOM 3236 N PHE X 110 18.864 19.911 -6.871 1.00 0.00 N ATOM 3237 CA PHE X 110 19.405 19.202 -8.066 1.00 0.00 C ATOM 3238 C PHE X 110 18.246 18.818 -8.994 1.00 0.00 C ATOM 3239 O PHE X 110 18.393 18.775 -10.199 1.00 0.00 O ATOM 3240 CB PHE X 110 20.208 17.957 -7.629 1.00 0.00 C ATOM 3241 CG PHE X 110 19.307 16.765 -7.324 1.00 0.00 C ATOM 3242 CD1 PHE X 110 18.152 16.920 -6.549 1.00 0.00 C ATOM 3243 CD2 PHE X 110 19.649 15.494 -7.807 1.00 0.00 C ATOM 3244 CE1 PHE X 110 17.341 15.821 -6.260 1.00 0.00 C ATOM 3245 CE2 PHE X 110 18.837 14.390 -7.514 1.00 0.00 C ATOM 3246 CZ PHE X 110 17.681 14.556 -6.740 1.00 0.00 C ATOM 0 H PHE X 110 19.191 19.565 -5.969 1.00 0.00 H new ATOM 0 HA PHE X 110 20.083 19.860 -8.609 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.911 17.686 -8.417 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.798 18.200 -6.745 1.00 0.00 H new ATOM 0 HD1 PHE X 110 17.886 17.897 -6.172 1.00 0.00 H new ATOM 0 HD2 PHE X 110 20.539 15.366 -8.405 1.00 0.00 H new ATOM 0 HE1 PHE X 110 16.450 15.950 -5.664 1.00 0.00 H new ATOM 0 HE2 PHE X 110 19.102 13.411 -7.885 1.00 0.00 H new ATOM 0 HZ PHE X 110 17.054 13.706 -6.515 1.00 0.00 H new ATOM 3256 N LYS X 111 17.094 18.555 -8.440 1.00 0.00 N ATOM 3257 CA LYS X 111 15.919 18.191 -9.278 1.00 0.00 C ATOM 3258 C LYS X 111 15.298 19.465 -9.868 1.00 0.00 C ATOM 3259 O LYS X 111 14.751 19.449 -10.953 1.00 0.00 O ATOM 3260 CB LYS X 111 14.901 17.425 -8.400 1.00 0.00 C ATOM 3261 CG LYS X 111 14.256 16.252 -9.182 1.00 0.00 C ATOM 3262 CD LYS X 111 15.023 14.940 -8.929 1.00 0.00 C ATOM 3263 CE LYS X 111 16.468 15.043 -9.428 1.00 0.00 C ATOM 3264 NZ LYS X 111 16.480 15.358 -10.886 1.00 0.00 N ATOM 0 H LYS X 111 16.916 18.577 -7.436 1.00 0.00 H new ATOM 0 HA LYS X 111 16.222 17.549 -10.105 1.00 0.00 H new ATOM 0 HB2 LYS X 111 15.401 17.041 -7.510 1.00 0.00 H new ATOM 0 HB3 LYS X 111 14.124 18.109 -8.059 1.00 0.00 H new ATOM 0 HG2 LYS X 111 13.216 16.135 -8.879 1.00 0.00 H new ATOM 0 HG3 LYS X 111 14.253 16.477 -10.248 1.00 0.00 H new ATOM 0 HD2 LYS X 111 15.018 14.712 -7.863 1.00 0.00 H new ATOM 0 HD3 LYS X 111 14.518 14.116 -9.434 1.00 0.00 H new ATOM 0 HE2 LYS X 111 16.999 15.818 -8.875 1.00 0.00 H new ATOM 0 HE3 LYS X 111 16.993 14.105 -9.245 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 16.970 14.599 -11.401 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 15.502 15.436 -11.232 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 16.976 16.259 -11.042 1.00 0.00 H new ATOM 3278 N THR X 112 15.382 20.569 -9.175 1.00 0.00 N ATOM 3279 CA THR X 112 14.794 21.827 -9.731 1.00 0.00 C ATOM 3280 C THR X 112 15.481 22.140 -11.062 1.00 0.00 C ATOM 3281 O THR X 112 14.877 22.659 -11.980 1.00 0.00 O ATOM 3282 CB THR X 112 15.015 22.997 -8.764 1.00 0.00 C ATOM 3283 OG1 THR X 112 16.406 23.170 -8.534 1.00 0.00 O ATOM 3284 CG2 THR X 112 14.303 22.722 -7.440 1.00 0.00 C ATOM 0 H THR X 112 15.825 20.657 -8.261 1.00 0.00 H new ATOM 0 HA THR X 112 13.722 21.690 -9.875 1.00 0.00 H new ATOM 0 HB THR X 112 14.606 23.906 -9.205 1.00 0.00 H new ATOM 0 HG1 THR X 112 16.869 22.318 -8.674 1.00 0.00 H new ATOM 0 HG21 THR X 112 14.465 23.558 -6.759 1.00 0.00 H new ATOM 0 HG22 THR X 112 13.235 22.602 -7.619 1.00 0.00 H new ATOM 0 HG23 THR X 112 14.701 21.810 -6.996 1.00 0.00 H new ATOM 3292 N GLU X 113 16.744 21.824 -11.170 1.00 0.00 N ATOM 3293 CA GLU X 113 17.487 22.092 -12.435 1.00 0.00 C ATOM 3294 CB GLU X 113 17.070 21.069 -13.498 1.00 0.00 C ATOM 3295 CG GLU X 113 17.473 19.666 -13.038 1.00 0.00 C ATOM 3296 CD GLU X 113 17.060 18.643 -14.097 1.00 0.00 C ATOM 3297 OE1 GLU X 113 16.394 19.034 -15.042 1.00 0.00 O ATOM 3298 OE2 GLU X 113 17.423 17.488 -13.949 1.00 0.00 O ATOM 0 H GLU X 113 17.296 21.389 -10.431 1.00 0.00 H new ATOM 0 HB2 GLU X 113 15.993 21.115 -13.661 1.00 0.00 H new ATOM 0 HB3 GLU X 113 17.546 21.303 -14.450 1.00 0.00 H new ATOM 0 HG2 GLU X 113 18.550 19.621 -12.874 1.00 0.00 H new ATOM 0 HG3 GLU X 113 16.996 19.433 -12.086 1.00 0.00 H new ATOM 3493 N ARG Y 104 -11.179 17.851 -28.342 1.00 0.00 N ATOM 3494 CA ARG Y 104 -11.258 17.254 -26.984 1.00 0.00 C ATOM 3495 C ARG Y 104 -9.916 17.426 -26.271 1.00 0.00 C ATOM 3496 O ARG Y 104 -9.860 17.716 -25.088 1.00 0.00 O ATOM 3497 CB ARG Y 104 -11.585 15.766 -27.124 1.00 0.00 C ATOM 3498 CG ARG Y 104 -13.025 15.625 -27.610 1.00 0.00 C ATOM 3499 CD ARG Y 104 -13.316 14.159 -27.907 1.00 0.00 C ATOM 3500 NE ARG Y 104 -14.740 14.015 -28.314 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -15.154 12.910 -28.867 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -14.321 11.924 -29.056 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -16.402 12.791 -29.226 1.00 0.00 N ATOM 0 HA ARG Y 104 -12.034 17.750 -26.400 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -10.900 15.293 -27.828 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -11.458 15.260 -26.167 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -13.715 15.998 -26.853 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -13.179 16.227 -28.506 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -12.661 13.799 -28.700 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -13.114 13.550 -27.026 1.00 0.00 H new ATOM 0 HE ARG Y 104 -15.393 14.783 -28.160 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -13.346 12.018 -28.771 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -14.645 11.059 -29.489 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -17.052 13.562 -29.074 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -16.728 11.927 -29.659 1.00 0.00 H new ATOM 3517 N HIS Y 105 -8.830 17.258 -26.974 1.00 0.00 N ATOM 3518 CA HIS Y 105 -7.511 17.419 -26.314 1.00 0.00 C ATOM 3519 C HIS Y 105 -7.431 18.825 -25.725 1.00 0.00 C ATOM 3520 O HIS Y 105 -6.813 19.044 -24.704 1.00 0.00 O ATOM 3521 CB HIS Y 105 -6.374 17.168 -27.321 1.00 0.00 C ATOM 3522 CG HIS Y 105 -6.229 18.312 -28.296 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -6.173 19.642 -27.897 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -6.086 18.330 -29.664 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -6.001 20.392 -29.001 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -5.942 19.642 -30.100 1.00 0.00 N ATOM 0 H HIS Y 105 -8.801 17.019 -27.965 1.00 0.00 H new ATOM 0 HA HIS Y 105 -7.401 16.689 -25.512 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -5.436 17.027 -26.783 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -6.570 16.246 -27.868 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -6.086 17.458 -30.302 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -5.921 21.469 -28.996 1.00 0.00 H new ATOM 0 HE2 HIS Y 105 -5.817 19.963 -31.060 1.00 0.00 H new ATOM 3535 N LYS Y 106 -8.077 19.778 -26.344 1.00 0.00 N ATOM 3536 CA LYS Y 106 -8.056 21.163 -25.798 1.00 0.00 C ATOM 3537 C LYS Y 106 -8.659 21.136 -24.395 1.00 0.00 C ATOM 3538 O LYS Y 106 -8.278 21.888 -23.521 1.00 0.00 O ATOM 3539 CB LYS Y 106 -8.878 22.105 -26.683 1.00 0.00 C ATOM 3540 CG LYS Y 106 -8.721 23.534 -26.165 1.00 0.00 C ATOM 3541 CD LYS Y 106 -9.531 24.496 -27.030 1.00 0.00 C ATOM 3542 CE LYS Y 106 -9.283 25.920 -26.538 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -10.038 26.888 -27.385 1.00 0.00 N ATOM 0 H LYS Y 106 -8.616 19.656 -27.201 1.00 0.00 H new ATOM 0 HA LYS Y 106 -7.028 21.525 -25.770 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -8.541 22.040 -27.718 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -9.928 21.813 -26.671 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -9.056 23.593 -25.130 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -7.669 23.820 -26.176 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -9.240 24.401 -28.076 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -10.592 24.255 -26.972 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -9.594 26.014 -25.498 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -8.217 26.146 -26.574 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -9.865 27.855 -27.045 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -9.721 26.806 -28.372 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -11.055 26.678 -27.329 1.00 0.00 H new ATOM 3557 N LYS Y 107 -9.601 20.271 -24.167 1.00 0.00 N ATOM 3558 CA LYS Y 107 -10.216 20.207 -22.819 1.00 0.00 C ATOM 3559 C LYS Y 107 -9.118 19.886 -21.804 1.00 0.00 C ATOM 3560 O LYS Y 107 -9.089 20.434 -20.723 1.00 0.00 O ATOM 3561 CB LYS Y 107 -11.281 19.108 -22.790 1.00 0.00 C ATOM 3562 CG LYS Y 107 -11.959 19.093 -21.419 1.00 0.00 C ATOM 3563 CD LYS Y 107 -13.023 17.996 -21.391 1.00 0.00 C ATOM 3564 CE LYS Y 107 -13.712 17.978 -20.025 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -12.814 17.345 -19.021 1.00 0.00 N ATOM 0 H LYS Y 107 -9.970 19.610 -24.851 1.00 0.00 H new ATOM 0 HA LYS Y 107 -10.686 21.160 -22.575 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -12.020 19.282 -23.572 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -10.825 18.139 -22.993 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -11.220 18.918 -20.637 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -12.415 20.062 -21.216 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -13.758 18.169 -22.177 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -12.565 17.027 -21.591 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -13.959 18.994 -19.718 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -14.650 17.427 -20.087 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -13.331 17.210 -18.129 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -12.491 16.423 -19.377 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -11.991 17.959 -18.855 1.00 0.00 H new ATOM 3579 N LEU Y 108 -8.207 19.014 -22.149 1.00 0.00 N ATOM 3580 CA LEU Y 108 -7.103 18.673 -21.199 1.00 0.00 C ATOM 3581 C LEU Y 108 -6.160 19.878 -21.052 1.00 0.00 C ATOM 3582 O LEU Y 108 -5.496 20.042 -20.043 1.00 0.00 O ATOM 3583 CB LEU Y 108 -6.320 17.462 -21.721 1.00 0.00 C ATOM 3584 CG LEU Y 108 -5.181 17.104 -20.749 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -5.754 16.760 -19.359 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -4.414 15.897 -21.304 1.00 0.00 C ATOM 0 H LEU Y 108 -8.178 18.524 -23.043 1.00 0.00 H new ATOM 0 HA LEU Y 108 -7.530 18.427 -20.227 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -6.990 16.610 -21.837 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -5.910 17.682 -22.707 1.00 0.00 H new ATOM 0 HG LEU Y 108 -4.510 17.957 -20.648 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -4.938 16.509 -18.681 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -6.299 17.619 -18.968 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -6.430 15.909 -19.444 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -3.605 15.635 -20.622 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -5.092 15.050 -21.404 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -3.999 16.147 -22.281 1.00 0.00 H new ATOM 3598 N MET Y 109 -6.088 20.726 -22.038 1.00 0.00 N ATOM 3599 CA MET Y 109 -5.185 21.906 -21.921 1.00 0.00 C ATOM 3600 C MET Y 109 -5.634 22.796 -20.751 1.00 0.00 C ATOM 3601 O MET Y 109 -4.848 23.530 -20.192 1.00 0.00 O ATOM 3602 CB MET Y 109 -5.173 22.707 -23.234 1.00 0.00 C ATOM 3603 CG MET Y 109 -4.198 22.059 -24.229 1.00 0.00 C ATOM 3604 SD MET Y 109 -4.468 20.269 -24.271 1.00 0.00 S ATOM 3605 CE MET Y 109 -2.754 19.773 -24.585 1.00 0.00 C ATOM 0 H MET Y 109 -6.609 20.656 -22.912 1.00 0.00 H new ATOM 0 HA MET Y 109 -4.172 21.555 -21.726 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -6.175 22.738 -23.661 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -4.877 23.738 -23.039 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -4.343 22.482 -25.223 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -3.170 22.275 -23.938 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -2.730 18.733 -24.910 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -2.329 20.406 -25.363 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -2.171 19.881 -23.671 1.00 0.00 H new ATOM 3615 N PHE Y 110 -6.886 22.747 -20.370 1.00 0.00 N ATOM 3616 CA PHE Y 110 -7.341 23.605 -19.237 1.00 0.00 C ATOM 3617 C PHE Y 110 -6.380 23.436 -18.058 1.00 0.00 C ATOM 3618 O PHE Y 110 -6.153 24.352 -17.292 1.00 0.00 O ATOM 3619 CB PHE Y 110 -8.786 23.236 -18.831 1.00 0.00 C ATOM 3620 CG PHE Y 110 -8.844 21.999 -17.940 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -8.100 20.854 -18.250 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -9.667 21.998 -16.802 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -8.171 19.721 -17.436 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -9.739 20.860 -15.987 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -8.989 19.722 -16.305 1.00 0.00 C ATOM 0 H PHE Y 110 -7.604 22.157 -20.790 1.00 0.00 H new ATOM 0 HA PHE Y 110 -7.339 24.650 -19.547 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -9.239 24.078 -18.308 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -9.379 23.061 -19.729 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -7.467 20.847 -19.125 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -10.245 22.876 -16.554 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -7.592 18.843 -17.682 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -10.374 20.861 -15.113 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -9.043 18.846 -15.676 1.00 0.00 H new ATOM 3635 N LYS Y 111 -5.806 22.274 -17.915 1.00 0.00 N ATOM 3636 CA LYS Y 111 -4.852 22.036 -16.801 1.00 0.00 C ATOM 3637 C LYS Y 111 -3.482 22.626 -17.163 1.00 0.00 C ATOM 3638 O LYS Y 111 -2.746 23.069 -16.303 1.00 0.00 O ATOM 3639 CB LYS Y 111 -4.757 20.515 -16.551 1.00 0.00 C ATOM 3640 CG LYS Y 111 -4.693 20.199 -15.035 1.00 0.00 C ATOM 3641 CD LYS Y 111 -6.099 19.894 -14.491 1.00 0.00 C ATOM 3642 CE LYS Y 111 -6.993 21.135 -14.573 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -6.353 22.270 -13.847 1.00 0.00 N ATOM 0 H LYS Y 111 -5.960 21.474 -18.528 1.00 0.00 H new ATOM 0 HA LYS Y 111 -5.197 22.523 -15.889 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -5.620 20.017 -16.993 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -3.871 20.117 -17.046 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -4.036 19.346 -14.862 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -4.264 21.045 -14.498 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -6.546 19.080 -15.061 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -6.029 19.558 -13.456 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -7.159 21.406 -15.616 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -7.970 20.920 -14.140 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -6.977 22.586 -13.077 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -5.443 21.959 -13.450 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -6.192 23.057 -14.507 1.00 0.00 H new ATOM 3657 N THR Y 112 -3.131 22.641 -18.422 1.00 0.00 N ATOM 3658 CA THR Y 112 -1.805 23.215 -18.798 1.00 0.00 C ATOM 3659 C THR Y 112 -1.759 24.675 -18.353 1.00 0.00 C ATOM 3660 O THR Y 112 -0.727 25.188 -17.968 1.00 0.00 O ATOM 3661 CB THR Y 112 -1.607 23.151 -20.318 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -2.661 23.851 -20.966 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -1.590 21.695 -20.779 1.00 0.00 C ATOM 0 H THR Y 112 -3.694 22.287 -19.195 1.00 0.00 H new ATOM 0 HA THR Y 112 -1.015 22.641 -18.313 1.00 0.00 H new ATOM 0 HB THR Y 112 -0.655 23.615 -20.576 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -3.471 23.804 -20.416 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -1.449 21.657 -21.859 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -0.773 21.167 -20.288 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -2.536 21.220 -20.520 1.00 0.00 H new ATOM 3671 N GLU Y 113 -2.879 25.346 -18.396 1.00 0.00 N ATOM 3672 CA GLU Y 113 -2.923 26.775 -17.972 1.00 0.00 C ATOM 3673 CB GLU Y 113 -2.853 26.860 -16.445 1.00 0.00 C ATOM 3674 CG GLU Y 113 -4.083 26.176 -15.847 1.00 0.00 C ATOM 3675 CD GLU Y 113 -4.026 26.255 -14.319 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -3.014 26.702 -13.804 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -5.001 25.875 -13.689 1.00 0.00 O ATOM 0 H GLU Y 113 -3.771 24.963 -18.709 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -1.943 26.380 -16.083 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -2.811 27.902 -16.128 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -4.991 26.656 -16.212 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -4.123 25.134 -16.166 1.00 0.00 H new