USER MOD reduce.3.24.130724 H: found=0, std=0, add=1266, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1272 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 46 SER OG : rot -47:sc= 0.138 USER MOD Set 1.2: B 83 ASN : amide:sc= -0.518 K(o=-0.38,f=-5.6!) USER MOD Set 2.1: B 42 ASN : amide:sc= -0.132 K(o=-0.012,f=-4.5!) USER MOD Set 2.2: B 44 SER OG : rot 30:sc= 0.12 USER MOD Set 3.1: B 37 LYS NZ :NH3+ -179:sc= 1.26 (180deg=1.12) USER MOD Set 3.2: B 40 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: B 26 SER OG : rot -107:sc= 1.1 USER MOD Set 4.2: B 28 GLN : amide:sc= 1.94 K(o=3,f=-7.7!) USER MOD Set 5.1: A 52 SER OG : rot -115:sc= 0.389 USER MOD Set 5.2: A 54 SER OG : rot 180:sc= 0.833 USER MOD Set 6.1: A 37 LYS NZ :NH3+ -168:sc= 2.02 (180deg=0.397) USER MOD Set 6.2: A 40 THR OG1 : rot 180:sc= 1 USER MOD Single : A 24 GLN : amide:sc= -1.49 K(o=-1.5,f=-6.1!) USER MOD Single : A 26 SER OG : rot 180:sc= -0.0551 USER MOD Single : A 27 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0484) USER MOD Single : A 28 GLN : amide:sc= -2.38 X(o=-2.4,f=-2.8!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 34 LYS NZ :NH3+ 164:sc= -0.0257 (180deg=-0.246) USER MOD Single : A 42 ASN : amide:sc= -1.42 K(o=-1.4,f=-0.11) USER MOD Single : A 44 SER OG : rot 48:sc= 0.101 USER MOD Single : A 45 GLN : amide:sc= -0.429 K(o=-0.43,f=-7.9!) USER MOD Single : A 46 SER OG : rot 8:sc= 0.0905 USER MOD Single : A 49 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.22) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot -9:sc= 0.874 USER MOD Single : A 67 LYS NZ :NH3+ -166:sc= 1.13 (180deg=1.06) USER MOD Single : A 70 LYS NZ :NH3+ -151:sc= -0.0144 (180deg=-0.505) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 30:sc= -0.0327 USER MOD Single : A 73 HIS : no HE2:sc= -0.367 K(o=-0.37,f=-5.6!) USER MOD Single : A 80 HIS : no HE2:sc= 0.988 K(o=0.99,f=-6!) USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0.316 K(o=0.32,f=-5.4!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0195) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.34) USER MOD Single : A 101 HIS : no HD1:sc= -0.58 K(o=-0.58,f=0.15) USER MOD Single : A 102 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 24 GLN : amide:sc= -0.457 K(o=-0.46,f=-1.4) USER MOD Single : B 27 LYS NZ :NH3+ 165:sc=-0.00953 (180deg=-0.157) USER MOD Single : B 31 SER OG : rot -82:sc= 0.508 USER MOD Single : B 32 HIS : no HE2:sc= -2.6! K(o=-2.6!,f=-1.5) USER MOD Single : B 34 LYS NZ :NH3+ 169:sc= -0.0347 (180deg=-0.206) USER MOD Single : B 45 GLN : amide:sc= -0.252 K(o=-0.25,f=-2.3!) USER MOD Single : B 49 GLN : amide:sc= -4.87! K(o=-4.9!,f=-0.73) USER MOD Single : B 51 SER OG : rot 29:sc= 0.165 USER MOD Single : B 52 SER OG : rot -57:sc= 1.26 USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 SER OG : rot 110:sc= -1.25 USER MOD Single : B 67 LYS NZ :NH3+ 134:sc= -0.344 (180deg=-0.439) USER MOD Single : B 70 LYS NZ :NH3+ 173:sc= 1.04 (180deg=0.873) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 TYR OH : rot 0:sc= -0.865 USER MOD Single : B 73 HIS : no HE2:sc= 1.15 K(o=1.1,f=-4.6!) USER MOD Single : B 80 HIS : no HE2:sc= 1.19 K(o=1.2,f=-3.8!) USER MOD Single : B 91 TYR OH : rot 179:sc= 0.343 USER MOD Single : B 92 ASN : amide:sc= 0.176 K(o=0.18,f=-4.7!) USER MOD Single : B 95 THR OG1 : rot -15:sc= 0.929 USER MOD Single : B 96 LYS NZ :NH3+ -147:sc= 1.19 (180deg=0.788) USER MOD Single : B 99 HIS : no HD1:sc= 0 X(o=0,f=-0.0039) USER MOD Single : B 100 HIS : no HD1:sc=-0.00275 X(o=-0.0028,f=-0.0028) USER MOD Single : B 101 HIS : no HE2:sc= 0.408 K(o=0.41,f=-5.6!) USER MOD Single : B 102 HIS : no HD1:sc= -0.957 K(o=-0.96,f=0.27) USER MOD Single : B 103 HIS : no HE2:sc= 0.685 K(o=0.69,f=-4.1!) USER MOD Single : B 104 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 22 -4.493 -4.224 -8.396 1.00 0.00 N ATOM 2 CA ALA A 22 -5.070 -3.711 -7.136 1.00 0.00 C ATOM 3 C ALA A 22 -3.965 -3.207 -6.221 1.00 0.00 C ATOM 4 O ALA A 22 -3.119 -3.980 -5.775 1.00 0.00 O ATOM 5 CB ALA A 22 -5.881 -4.795 -6.442 1.00 0.00 C ATOM 0 HA ALA A 22 -5.736 -2.881 -7.370 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.299 -4.400 -5.516 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.691 -5.119 -7.096 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.236 -5.644 -6.216 1.00 0.00 H new ATOM 13 N GLU A 23 -3.977 -1.912 -5.944 1.00 0.00 N ATOM 14 CA GLU A 23 -2.928 -1.295 -5.145 1.00 0.00 C ATOM 15 C GLU A 23 -3.391 -1.131 -3.701 1.00 0.00 C ATOM 16 O GLU A 23 -4.586 -1.211 -3.411 1.00 0.00 O ATOM 17 CB GLU A 23 -2.544 0.064 -5.741 1.00 0.00 C ATOM 18 CG GLU A 23 -1.249 0.637 -5.184 1.00 0.00 C ATOM 19 CD GLU A 23 -0.082 -0.310 -5.369 1.00 0.00 C ATOM 20 OE1 GLU A 23 0.267 -0.600 -6.527 1.00 0.00 O ATOM 21 OE2 GLU A 23 0.468 -0.798 -4.360 1.00 0.00 O ATOM 0 H GLU A 23 -4.701 -1.267 -6.261 1.00 0.00 H new ATOM 0 HA GLU A 23 -2.051 -1.942 -5.155 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -2.450 -0.038 -6.822 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -3.352 0.772 -5.557 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -1.029 1.583 -5.678 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.375 0.853 -4.123 1.00 0.00 H new ATOM 28 N GLN A 24 -2.449 -0.916 -2.796 1.00 0.00 N ATOM 29 CA GLN A 24 -2.785 -0.709 -1.401 1.00 0.00 C ATOM 30 C GLN A 24 -2.596 0.747 -1.008 1.00 0.00 C ATOM 31 O GLN A 24 -1.594 1.366 -1.347 1.00 0.00 O ATOM 32 CB GLN A 24 -1.938 -1.600 -0.496 1.00 0.00 C ATOM 33 CG GLN A 24 -2.186 -1.347 0.983 1.00 0.00 C ATOM 34 CD GLN A 24 -1.479 -2.331 1.885 1.00 0.00 C ATOM 35 OE1 GLN A 24 -1.959 -2.623 2.981 1.00 0.00 O ATOM 36 NE2 GLN A 24 -0.346 -2.846 1.437 1.00 0.00 N ATOM 0 H GLN A 24 -1.451 -0.881 -3.004 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.834 -0.976 -1.273 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -2.151 -2.645 -0.721 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -0.883 -1.435 -0.716 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -1.859 -0.337 1.231 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -3.258 -1.392 1.177 1.00 0.00 H new ATOM 0 HE21 GLN A 24 0.012 -2.573 0.522 1.00 0.00 H new ATOM 0 HE22 GLN A 24 0.170 -3.516 2.007 1.00 0.00 H new ATOM 45 N VAL A 25 -3.575 1.281 -0.301 1.00 0.00 N ATOM 46 CA VAL A 25 -3.493 2.629 0.241 1.00 0.00 C ATOM 47 C VAL A 25 -3.818 2.592 1.728 1.00 0.00 C ATOM 48 O VAL A 25 -4.564 1.720 2.182 1.00 0.00 O ATOM 49 CB VAL A 25 -4.453 3.601 -0.481 1.00 0.00 C ATOM 50 CG1 VAL A 25 -3.970 3.883 -1.897 1.00 0.00 C ATOM 51 CG2 VAL A 25 -5.869 3.044 -0.505 1.00 0.00 C ATOM 0 H VAL A 25 -4.447 0.797 -0.086 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.478 2.995 0.085 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.462 4.539 0.074 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.661 4.569 -2.387 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.977 4.332 -1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.926 2.950 -2.459 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -6.527 3.745 -1.018 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.876 2.089 -1.031 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -6.220 2.898 0.517 1.00 0.00 H new ATOM 61 N SER A 26 -3.258 3.514 2.492 1.00 0.00 N ATOM 62 CA SER A 26 -3.464 3.516 3.924 1.00 0.00 C ATOM 63 C SER A 26 -4.616 4.444 4.295 1.00 0.00 C ATOM 64 O SER A 26 -5.172 5.140 3.438 1.00 0.00 O ATOM 65 CB SER A 26 -2.178 3.927 4.649 1.00 0.00 C ATOM 66 OG SER A 26 -2.295 3.749 6.052 1.00 0.00 O ATOM 0 H SER A 26 -2.661 4.265 2.145 1.00 0.00 H new ATOM 0 HA SER A 26 -3.725 2.506 4.240 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.342 3.336 4.274 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.953 4.971 4.431 1.00 0.00 H new ATOM 0 HG SER A 26 -1.459 4.018 6.487 1.00 0.00 H new ATOM 72 N LYS A 27 -4.950 4.462 5.579 1.00 0.00 N ATOM 73 CA LYS A 27 -6.085 5.225 6.088 1.00 0.00 C ATOM 74 C LYS A 27 -5.921 6.719 5.819 1.00 0.00 C ATOM 75 O LYS A 27 -6.892 7.478 5.862 1.00 0.00 O ATOM 76 CB LYS A 27 -6.250 4.965 7.588 1.00 0.00 C ATOM 77 CG LYS A 27 -4.987 5.222 8.395 1.00 0.00 C ATOM 78 CD LYS A 27 -5.138 4.752 9.833 1.00 0.00 C ATOM 79 CE LYS A 27 -3.866 4.981 10.634 1.00 0.00 C ATOM 80 NZ LYS A 27 -3.585 6.426 10.838 1.00 0.00 N ATOM 0 H LYS A 27 -4.442 3.948 6.299 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.982 4.895 5.564 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.051 5.597 7.972 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -6.562 3.931 7.737 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.146 4.708 7.930 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -4.756 6.287 8.382 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -5.966 5.282 10.304 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -5.390 3.692 9.845 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -3.955 4.489 11.603 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.025 4.518 10.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -2.790 6.535 11.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.340 6.864 9.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -4.428 6.892 11.231 1.00 0.00 H new ATOM 94 N GLN A 28 -4.696 7.133 5.529 1.00 0.00 N ATOM 95 CA GLN A 28 -4.415 8.524 5.222 1.00 0.00 C ATOM 96 C GLN A 28 -4.886 8.861 3.810 1.00 0.00 C ATOM 97 O GLN A 28 -5.558 9.869 3.598 1.00 0.00 O ATOM 98 CB GLN A 28 -2.918 8.806 5.375 1.00 0.00 C ATOM 99 CG GLN A 28 -2.524 10.238 5.046 1.00 0.00 C ATOM 100 CD GLN A 28 -1.068 10.538 5.355 1.00 0.00 C ATOM 101 OE1 GLN A 28 -0.710 11.670 5.674 1.00 0.00 O ATOM 102 NE2 GLN A 28 -0.213 9.534 5.259 1.00 0.00 N ATOM 0 H GLN A 28 -3.880 6.522 5.500 1.00 0.00 H new ATOM 0 HA GLN A 28 -4.959 9.156 5.924 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -2.619 8.583 6.399 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -2.362 8.129 4.727 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.712 10.427 3.989 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.158 10.922 5.610 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.543 8.607 4.992 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.777 9.687 5.452 1.00 0.00 H new ATOM 111 N GLU A 29 -4.561 7.999 2.851 1.00 0.00 N ATOM 112 CA GLU A 29 -4.916 8.244 1.457 1.00 0.00 C ATOM 113 C GLU A 29 -6.405 8.021 1.245 1.00 0.00 C ATOM 114 O GLU A 29 -7.070 8.799 0.555 1.00 0.00 O ATOM 115 CB GLU A 29 -4.122 7.338 0.506 1.00 0.00 C ATOM 116 CG GLU A 29 -2.617 7.360 0.728 1.00 0.00 C ATOM 117 CD GLU A 29 -2.160 6.289 1.695 1.00 0.00 C ATOM 118 OE1 GLU A 29 -2.391 6.434 2.910 1.00 0.00 O ATOM 119 OE2 GLU A 29 -1.585 5.285 1.244 1.00 0.00 O ATOM 0 H GLU A 29 -4.055 7.128 3.012 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.665 9.281 1.232 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -4.479 6.314 0.617 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -4.330 7.638 -0.521 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.110 7.224 -0.227 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.323 8.338 1.108 1.00 0.00 H new ATOM 126 N ILE A 30 -6.922 6.964 1.865 1.00 0.00 N ATOM 127 CA ILE A 30 -8.331 6.602 1.752 1.00 0.00 C ATOM 128 C ILE A 30 -9.236 7.762 2.151 1.00 0.00 C ATOM 129 O ILE A 30 -10.207 8.071 1.463 1.00 0.00 O ATOM 130 CB ILE A 30 -8.664 5.385 2.642 1.00 0.00 C ATOM 131 CG1 ILE A 30 -7.857 4.164 2.200 1.00 0.00 C ATOM 132 CG2 ILE A 30 -10.155 5.082 2.599 1.00 0.00 C ATOM 133 CD1 ILE A 30 -8.005 2.974 3.121 1.00 0.00 C ATOM 0 H ILE A 30 -6.378 6.337 2.458 1.00 0.00 H new ATOM 0 HA ILE A 30 -8.509 6.350 0.707 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.393 5.626 3.670 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -8.169 3.877 1.196 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.804 4.438 2.140 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.370 4.221 3.232 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.712 5.946 2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.452 4.861 1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.405 2.146 2.745 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -7.665 3.243 4.121 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.052 2.674 3.162 1.00 0.00 H new ATOM 145 N SER A 31 -8.902 8.407 3.254 1.00 0.00 N ATOM 146 CA SER A 31 -9.725 9.476 3.789 1.00 0.00 C ATOM 147 C SER A 31 -9.402 10.808 3.109 1.00 0.00 C ATOM 148 O SER A 31 -10.240 11.708 3.057 1.00 0.00 O ATOM 149 CB SER A 31 -9.514 9.573 5.302 1.00 0.00 C ATOM 150 OG SER A 31 -10.464 10.428 5.914 1.00 0.00 O ATOM 0 H SER A 31 -8.063 8.208 3.799 1.00 0.00 H new ATOM 0 HA SER A 31 -10.772 9.250 3.589 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.583 8.579 5.743 1.00 0.00 H new ATOM 0 HB3 SER A 31 -8.509 9.942 5.506 1.00 0.00 H new ATOM 0 HG SER A 31 -10.298 10.463 6.879 1.00 0.00 H new ATOM 156 N HIS A 32 -8.194 10.921 2.566 1.00 0.00 N ATOM 157 CA HIS A 32 -7.760 12.160 1.927 1.00 0.00 C ATOM 158 C HIS A 32 -8.458 12.351 0.584 1.00 0.00 C ATOM 159 O HIS A 32 -8.909 13.450 0.261 1.00 0.00 O ATOM 160 CB HIS A 32 -6.242 12.164 1.727 1.00 0.00 C ATOM 161 CG HIS A 32 -5.685 13.513 1.387 1.00 0.00 C ATOM 162 ND1 HIS A 32 -5.427 13.924 0.095 1.00 0.00 N ATOM 163 CD2 HIS A 32 -5.337 14.549 2.186 1.00 0.00 C ATOM 164 CE1 HIS A 32 -4.945 15.155 0.117 1.00 0.00 C ATOM 165 NE2 HIS A 32 -4.881 15.555 1.372 1.00 0.00 N ATOM 0 H HIS A 32 -7.500 10.173 2.555 1.00 0.00 H new ATOM 0 HA HIS A 32 -8.031 12.986 2.584 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -5.763 11.801 2.637 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -5.987 11.464 0.931 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -5.406 14.578 3.263 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -4.653 15.735 -0.746 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -4.546 16.466 1.687 1.00 0.00 H new ATOM 174 N PHE A 33 -8.534 11.282 -0.199 1.00 0.00 N ATOM 175 CA PHE A 33 -9.188 11.339 -1.502 1.00 0.00 C ATOM 176 C PHE A 33 -10.641 10.893 -1.390 1.00 0.00 C ATOM 177 O PHE A 33 -11.445 11.135 -2.289 1.00 0.00 O ATOM 178 CB PHE A 33 -8.448 10.462 -2.516 1.00 0.00 C ATOM 179 CG PHE A 33 -7.036 10.907 -2.782 1.00 0.00 C ATOM 180 CD1 PHE A 33 -6.775 11.915 -3.696 1.00 0.00 C ATOM 181 CD2 PHE A 33 -5.971 10.315 -2.121 1.00 0.00 C ATOM 182 CE1 PHE A 33 -5.479 12.326 -3.945 1.00 0.00 C ATOM 183 CE2 PHE A 33 -4.673 10.722 -2.365 1.00 0.00 C ATOM 184 CZ PHE A 33 -4.427 11.729 -3.277 1.00 0.00 C ATOM 0 H PHE A 33 -8.153 10.368 0.044 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.163 12.372 -1.850 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.434 9.435 -2.152 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -9.002 10.460 -3.455 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -7.594 12.385 -4.220 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.158 9.527 -1.407 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -5.289 13.112 -4.660 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.852 10.253 -1.843 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.414 12.050 -3.468 1.00 0.00 H new ATOM 194 N LYS A 34 -10.955 10.251 -0.267 1.00 0.00 N ATOM 195 CA LYS A 34 -12.291 9.730 0.011 1.00 0.00 C ATOM 196 C LYS A 34 -12.666 8.632 -0.981 1.00 0.00 C ATOM 197 O LYS A 34 -13.299 8.881 -2.009 1.00 0.00 O ATOM 198 CB LYS A 34 -13.343 10.844 0.013 1.00 0.00 C ATOM 199 CG LYS A 34 -14.691 10.395 0.554 1.00 0.00 C ATOM 200 CD LYS A 34 -14.587 9.949 2.007 1.00 0.00 C ATOM 201 CE LYS A 34 -14.296 11.117 2.936 1.00 0.00 C ATOM 202 NZ LYS A 34 -15.413 12.097 2.964 1.00 0.00 N ATOM 0 H LYS A 34 -10.284 10.076 0.481 1.00 0.00 H new ATOM 0 HA LYS A 34 -12.270 9.296 1.011 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.978 11.678 0.612 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -13.472 11.214 -1.004 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -15.408 11.212 0.473 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -15.073 9.575 -0.053 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -15.518 9.469 2.307 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -13.798 9.203 2.103 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -14.117 10.743 3.944 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -13.383 11.617 2.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -15.307 12.721 3.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -15.396 12.667 2.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -16.319 11.590 3.028 1.00 0.00 H new ATOM 216 N LEU A 35 -12.247 7.416 -0.669 1.00 0.00 N ATOM 217 CA LEU A 35 -12.527 6.269 -1.516 1.00 0.00 C ATOM 218 C LEU A 35 -13.842 5.615 -1.110 1.00 0.00 C ATOM 219 O LEU A 35 -14.334 5.829 0.000 1.00 0.00 O ATOM 220 CB LEU A 35 -11.378 5.263 -1.430 1.00 0.00 C ATOM 221 CG LEU A 35 -10.017 5.808 -1.869 1.00 0.00 C ATOM 222 CD1 LEU A 35 -8.923 4.786 -1.613 1.00 0.00 C ATOM 223 CD2 LEU A 35 -10.046 6.200 -3.338 1.00 0.00 C ATOM 0 H LEU A 35 -11.709 7.198 0.170 1.00 0.00 H new ATOM 0 HA LEU A 35 -12.619 6.608 -2.548 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.298 4.910 -0.402 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.624 4.398 -2.046 1.00 0.00 H new ATOM 0 HG LEU A 35 -9.800 6.699 -1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.963 5.193 -1.932 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.883 4.554 -0.549 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.136 3.876 -2.175 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -9.069 6.585 -3.631 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -10.288 5.326 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -10.801 6.970 -3.494 1.00 0.00 H new ATOM 235 N VAL A 36 -14.406 4.819 -2.008 1.00 0.00 N ATOM 236 CA VAL A 36 -15.693 4.183 -1.764 1.00 0.00 C ATOM 237 C VAL A 36 -15.496 2.743 -1.302 1.00 0.00 C ATOM 238 O VAL A 36 -15.073 1.890 -2.081 1.00 0.00 O ATOM 239 CB VAL A 36 -16.572 4.202 -3.034 1.00 0.00 C ATOM 240 CG1 VAL A 36 -17.946 3.607 -2.760 1.00 0.00 C ATOM 241 CG2 VAL A 36 -16.703 5.618 -3.574 1.00 0.00 C ATOM 0 H VAL A 36 -13.992 4.598 -2.913 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.199 4.748 -0.981 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.083 3.587 -3.789 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -18.543 3.634 -3.672 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -17.836 2.574 -2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.445 4.186 -1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -17.326 5.610 -4.469 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -17.162 6.255 -2.818 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -15.715 6.005 -3.823 1.00 0.00 H new ATOM 251 N LYS A 37 -15.786 2.477 -0.036 1.00 0.00 N ATOM 252 CA LYS A 37 -15.603 1.141 0.518 1.00 0.00 C ATOM 253 C LYS A 37 -16.683 0.199 0.001 1.00 0.00 C ATOM 254 O LYS A 37 -17.865 0.544 -0.027 1.00 0.00 O ATOM 255 CB LYS A 37 -15.626 1.175 2.050 1.00 0.00 C ATOM 256 CG LYS A 37 -15.131 -0.114 2.698 1.00 0.00 C ATOM 257 CD LYS A 37 -15.161 -0.023 4.215 1.00 0.00 C ATOM 258 CE LYS A 37 -14.512 -1.233 4.873 1.00 0.00 C ATOM 259 NZ LYS A 37 -15.185 -2.506 4.502 1.00 0.00 N ATOM 0 H LYS A 37 -16.147 3.165 0.625 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.628 0.774 0.196 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -15.010 2.005 2.396 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.644 1.372 2.385 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -15.751 -0.948 2.370 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.114 -0.322 2.365 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -14.645 0.883 4.534 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.194 0.062 4.553 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.462 -1.282 4.583 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.539 -1.113 5.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.847 -3.270 5.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -16.214 -2.400 4.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.965 -2.739 3.513 1.00 0.00 H new ATOM 273 N VAL A 38 -16.264 -0.981 -0.423 1.00 0.00 N ATOM 274 CA VAL A 38 -17.186 -1.981 -0.935 1.00 0.00 C ATOM 275 C VAL A 38 -17.407 -3.076 0.098 1.00 0.00 C ATOM 276 O VAL A 38 -18.544 -3.417 0.430 1.00 0.00 O ATOM 277 CB VAL A 38 -16.654 -2.607 -2.241 1.00 0.00 C ATOM 278 CG1 VAL A 38 -17.617 -3.656 -2.775 1.00 0.00 C ATOM 279 CG2 VAL A 38 -16.408 -1.527 -3.278 1.00 0.00 C ATOM 0 H VAL A 38 -15.286 -1.271 -0.423 1.00 0.00 H new ATOM 0 HA VAL A 38 -18.133 -1.484 -1.145 1.00 0.00 H new ATOM 0 HB VAL A 38 -15.708 -3.103 -2.023 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -17.218 -4.081 -3.696 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -17.741 -4.446 -2.035 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -18.583 -3.193 -2.978 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -16.033 -1.982 -4.195 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -17.341 -1.005 -3.488 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.673 -0.818 -2.897 1.00 0.00 H new ATOM 289 N GLY A 39 -16.309 -3.610 0.612 1.00 0.00 N ATOM 290 CA GLY A 39 -16.383 -4.688 1.573 1.00 0.00 C ATOM 291 C GLY A 39 -15.067 -4.890 2.289 1.00 0.00 C ATOM 292 O GLY A 39 -14.235 -3.982 2.334 1.00 0.00 O ATOM 0 H GLY A 39 -15.362 -3.312 0.378 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -17.165 -4.473 2.302 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -16.666 -5.610 1.065 1.00 0.00 H new ATOM 296 N THR A 40 -14.878 -6.074 2.841 1.00 0.00 N ATOM 297 CA THR A 40 -13.659 -6.419 3.554 1.00 0.00 C ATOM 298 C THR A 40 -13.252 -7.848 3.198 1.00 0.00 C ATOM 299 O THR A 40 -14.101 -8.731 3.111 1.00 0.00 O ATOM 300 CB THR A 40 -13.862 -6.284 5.081 1.00 0.00 C ATOM 301 OG1 THR A 40 -14.235 -4.936 5.408 1.00 0.00 O ATOM 302 CG2 THR A 40 -12.603 -6.661 5.849 1.00 0.00 C ATOM 0 H THR A 40 -15.566 -6.826 2.808 1.00 0.00 H new ATOM 0 HA THR A 40 -12.867 -5.732 3.257 1.00 0.00 H new ATOM 0 HB THR A 40 -14.657 -6.971 5.372 1.00 0.00 H new ATOM 0 HG1 THR A 40 -14.364 -4.858 6.376 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.783 -6.554 6.919 1.00 0.00 H new ATOM 0 HG22 THR A 40 -12.338 -7.695 5.628 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.785 -6.005 5.552 1.00 0.00 H new ATOM 310 N ILE A 41 -11.967 -8.070 2.963 1.00 0.00 N ATOM 311 CA ILE A 41 -11.488 -9.386 2.561 1.00 0.00 C ATOM 312 C ILE A 41 -10.585 -9.991 3.622 1.00 0.00 C ATOM 313 O ILE A 41 -9.864 -9.279 4.324 1.00 0.00 O ATOM 314 CB ILE A 41 -10.736 -9.345 1.215 1.00 0.00 C ATOM 315 CG1 ILE A 41 -9.672 -8.240 1.220 1.00 0.00 C ATOM 316 CG2 ILE A 41 -11.718 -9.154 0.070 1.00 0.00 C ATOM 317 CD1 ILE A 41 -8.857 -8.167 -0.053 1.00 0.00 C ATOM 0 H ILE A 41 -11.239 -7.360 3.043 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.373 -10.011 2.441 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.225 -10.297 1.072 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.161 -7.279 1.382 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -8.999 -8.401 2.062 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -11.175 -9.127 -0.875 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -12.427 -9.982 0.057 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.257 -8.216 0.206 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.127 -7.362 0.028 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.338 -9.113 -0.208 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.518 -7.974 -0.898 1.00 0.00 H new ATOM 329 N ASN A 42 -10.633 -11.307 3.733 1.00 0.00 N ATOM 330 CA ASN A 42 -9.846 -12.019 4.725 1.00 0.00 C ATOM 331 C ASN A 42 -9.164 -13.233 4.111 1.00 0.00 C ATOM 332 O ASN A 42 -9.822 -14.113 3.549 1.00 0.00 O ATOM 333 CB ASN A 42 -10.739 -12.453 5.890 1.00 0.00 C ATOM 334 CG ASN A 42 -10.000 -13.292 6.917 1.00 0.00 C ATOM 335 OD1 ASN A 42 -9.983 -14.521 6.842 1.00 0.00 O ATOM 336 ND2 ASN A 42 -9.393 -12.635 7.888 1.00 0.00 N ATOM 0 H ASN A 42 -11.212 -11.907 3.145 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.074 -11.345 5.096 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.148 -11.568 6.377 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -11.583 -13.023 5.502 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.887 -13.146 8.611 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.430 -11.616 7.915 1.00 0.00 H new ATOM 343 N VAL A 43 -7.843 -13.263 4.203 1.00 0.00 N ATOM 344 CA VAL A 43 -7.073 -14.424 3.792 1.00 0.00 C ATOM 345 C VAL A 43 -6.606 -15.198 5.016 1.00 0.00 C ATOM 346 O VAL A 43 -5.758 -14.730 5.775 1.00 0.00 O ATOM 347 CB VAL A 43 -5.849 -14.043 2.918 1.00 0.00 C ATOM 348 CG1 VAL A 43 -4.821 -15.167 2.884 1.00 0.00 C ATOM 349 CG2 VAL A 43 -6.284 -13.718 1.499 1.00 0.00 C ATOM 0 H VAL A 43 -7.281 -12.491 4.561 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.729 -15.046 3.184 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.391 -13.162 3.368 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.976 -14.869 2.263 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.473 -15.373 3.896 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.277 -16.065 2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.411 -13.453 0.902 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.773 -14.588 1.060 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.980 -12.880 1.515 1.00 0.00 H new ATOM 359 N SER A 44 -7.205 -16.354 5.228 1.00 0.00 N ATOM 360 CA SER A 44 -6.737 -17.280 6.238 1.00 0.00 C ATOM 361 C SER A 44 -6.096 -18.474 5.547 1.00 0.00 C ATOM 362 O SER A 44 -6.766 -19.441 5.178 1.00 0.00 O ATOM 363 CB SER A 44 -7.888 -17.707 7.158 1.00 0.00 C ATOM 364 OG SER A 44 -9.047 -18.067 6.416 1.00 0.00 O ATOM 0 H SER A 44 -8.023 -16.675 4.709 1.00 0.00 H new ATOM 0 HA SER A 44 -5.992 -16.796 6.869 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.571 -18.551 7.770 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.131 -16.892 7.840 1.00 0.00 H new ATOM 0 HG SER A 44 -8.794 -18.673 5.688 1.00 0.00 H new ATOM 370 N GLN A 45 -4.796 -18.376 5.338 1.00 0.00 N ATOM 371 CA GLN A 45 -4.078 -19.339 4.521 1.00 0.00 C ATOM 372 C GLN A 45 -2.935 -19.938 5.323 1.00 0.00 C ATOM 373 O GLN A 45 -2.497 -19.354 6.311 1.00 0.00 O ATOM 374 CB GLN A 45 -3.553 -18.632 3.269 1.00 0.00 C ATOM 375 CG GLN A 45 -3.640 -19.461 1.999 1.00 0.00 C ATOM 376 CD GLN A 45 -3.440 -18.620 0.753 1.00 0.00 C ATOM 377 OE1 GLN A 45 -3.764 -17.437 0.732 1.00 0.00 O ATOM 378 NE2 GLN A 45 -2.929 -19.226 -0.304 1.00 0.00 N ATOM 0 H GLN A 45 -4.212 -17.635 5.725 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.743 -20.148 4.219 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.114 -17.709 3.125 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -2.513 -18.350 3.434 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -2.887 -20.249 2.029 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.612 -19.951 1.953 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -2.670 -20.211 -0.252 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -2.793 -18.709 -1.172 1.00 0.00 H new ATOM 387 N SER A 46 -2.460 -21.100 4.916 1.00 0.00 N ATOM 388 CA SER A 46 -1.378 -21.752 5.629 1.00 0.00 C ATOM 389 C SER A 46 -0.046 -21.090 5.285 1.00 0.00 C ATOM 390 O SER A 46 0.165 -20.645 4.152 1.00 0.00 O ATOM 391 CB SER A 46 -1.340 -23.243 5.284 1.00 0.00 C ATOM 392 OG SER A 46 -0.599 -23.977 6.246 1.00 0.00 O ATOM 0 H SER A 46 -2.803 -21.609 4.101 1.00 0.00 H new ATOM 0 HA SER A 46 -1.550 -21.649 6.700 1.00 0.00 H new ATOM 0 HB2 SER A 46 -2.357 -23.632 5.231 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.895 -23.379 4.298 1.00 0.00 H new ATOM 0 HG SER A 46 -0.376 -23.394 7.001 1.00 0.00 H new ATOM 398 N GLY A 47 0.837 -21.009 6.275 1.00 0.00 N ATOM 399 CA GLY A 47 2.155 -20.443 6.061 1.00 0.00 C ATOM 400 C GLY A 47 2.926 -21.205 5.003 1.00 0.00 C ATOM 401 O GLY A 47 2.768 -22.419 4.868 1.00 0.00 O ATOM 0 H GLY A 47 0.661 -21.328 7.228 1.00 0.00 H new ATOM 0 HA2 GLY A 47 2.059 -19.400 5.761 1.00 0.00 H new ATOM 0 HA3 GLY A 47 2.713 -20.455 6.997 1.00 0.00 H new ATOM 405 N GLY A 48 3.753 -20.504 4.251 1.00 0.00 N ATOM 406 CA GLY A 48 4.450 -21.125 3.148 1.00 0.00 C ATOM 407 C GLY A 48 3.788 -20.812 1.825 1.00 0.00 C ATOM 408 O GLY A 48 4.461 -20.605 0.818 1.00 0.00 O ATOM 0 H GLY A 48 3.956 -19.513 4.384 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.484 -20.780 3.129 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.477 -22.205 3.296 1.00 0.00 H new ATOM 412 N GLN A 49 2.460 -20.781 1.826 1.00 0.00 N ATOM 413 CA GLN A 49 1.709 -20.378 0.646 1.00 0.00 C ATOM 414 C GLN A 49 1.892 -18.885 0.414 1.00 0.00 C ATOM 415 O GLN A 49 2.104 -18.435 -0.712 1.00 0.00 O ATOM 416 CB GLN A 49 0.223 -20.707 0.809 1.00 0.00 C ATOM 417 CG GLN A 49 -0.065 -22.196 0.929 1.00 0.00 C ATOM 418 CD GLN A 49 0.389 -22.976 -0.289 1.00 0.00 C ATOM 419 OE1 GLN A 49 1.519 -23.462 -0.349 1.00 0.00 O ATOM 420 NE2 GLN A 49 -0.486 -23.097 -1.275 1.00 0.00 N ATOM 0 H GLN A 49 1.883 -21.030 2.630 1.00 0.00 H new ATOM 0 HA GLN A 49 2.086 -20.929 -0.216 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -0.157 -20.200 1.696 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.324 -20.308 -0.045 1.00 0.00 H new ATOM 0 HG2 GLN A 49 0.434 -22.589 1.815 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.135 -22.345 1.074 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -1.413 -22.680 -1.188 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -0.233 -23.607 -2.121 1.00 0.00 H new ATOM 429 N ILE A 50 1.812 -18.128 1.497 1.00 0.00 N ATOM 430 CA ILE A 50 2.087 -16.704 1.457 1.00 0.00 C ATOM 431 C ILE A 50 3.214 -16.370 2.415 1.00 0.00 C ATOM 432 O ILE A 50 3.076 -16.506 3.633 1.00 0.00 O ATOM 433 CB ILE A 50 0.850 -15.856 1.806 1.00 0.00 C ATOM 434 CG1 ILE A 50 -0.236 -16.055 0.747 1.00 0.00 C ATOM 435 CG2 ILE A 50 1.225 -14.382 1.925 1.00 0.00 C ATOM 436 CD1 ILE A 50 -1.412 -15.127 0.916 1.00 0.00 C ATOM 0 H ILE A 50 1.557 -18.481 2.419 1.00 0.00 H new ATOM 0 HA ILE A 50 2.375 -16.461 0.434 1.00 0.00 H new ATOM 0 HB ILE A 50 0.461 -16.183 2.770 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.198 -15.904 -0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.587 -17.086 0.786 1.00 0.00 H new ATOM 0 HG21 ILE A 50 0.337 -13.800 2.172 1.00 0.00 H new ATOM 0 HG22 ILE A 50 1.970 -14.258 2.711 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.636 -14.033 0.977 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.144 -15.321 0.132 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.870 -15.294 1.891 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.073 -14.093 0.847 1.00 0.00 H new ATOM 448 N SER A 51 4.328 -15.949 1.856 1.00 0.00 N ATOM 449 CA SER A 51 5.505 -15.619 2.647 1.00 0.00 C ATOM 450 C SER A 51 6.053 -14.248 2.260 1.00 0.00 C ATOM 451 O SER A 51 6.722 -13.588 3.054 1.00 0.00 O ATOM 452 CB SER A 51 6.577 -16.696 2.466 1.00 0.00 C ATOM 453 OG SER A 51 6.081 -17.974 2.837 1.00 0.00 O ATOM 0 H SER A 51 4.448 -15.825 0.851 1.00 0.00 H new ATOM 0 HA SER A 51 5.217 -15.582 3.698 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.905 -16.717 1.427 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.450 -16.451 3.071 1.00 0.00 H new ATOM 0 HG SER A 51 6.783 -18.646 2.711 1.00 0.00 H new ATOM 459 N SER A 52 5.764 -13.828 1.038 1.00 0.00 N ATOM 460 CA SER A 52 6.173 -12.528 0.550 1.00 0.00 C ATOM 461 C SER A 52 4.932 -11.669 0.301 1.00 0.00 C ATOM 462 O SER A 52 3.858 -12.204 0.013 1.00 0.00 O ATOM 463 CB SER A 52 6.985 -12.709 -0.741 1.00 0.00 C ATOM 464 OG SER A 52 7.440 -11.471 -1.258 1.00 0.00 O ATOM 0 H SER A 52 5.240 -14.381 0.360 1.00 0.00 H new ATOM 0 HA SER A 52 6.799 -12.025 1.287 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.840 -13.356 -0.544 1.00 0.00 H new ATOM 0 HB3 SER A 52 6.371 -13.211 -1.489 1.00 0.00 H new ATOM 0 HG SER A 52 7.011 -11.300 -2.122 1.00 0.00 H new ATOM 470 N PRO A 53 5.049 -10.332 0.429 1.00 0.00 N ATOM 471 CA PRO A 53 3.942 -9.407 0.147 1.00 0.00 C ATOM 472 C PRO A 53 3.377 -9.606 -1.258 1.00 0.00 C ATOM 473 O PRO A 53 2.208 -9.325 -1.519 1.00 0.00 O ATOM 474 CB PRO A 53 4.584 -8.023 0.274 1.00 0.00 C ATOM 475 CG PRO A 53 5.763 -8.228 1.160 1.00 0.00 C ATOM 476 CD PRO A 53 6.261 -9.616 0.872 1.00 0.00 C ATOM 0 HA PRO A 53 3.101 -9.558 0.823 1.00 0.00 H new ATOM 0 HB2 PRO A 53 4.884 -7.636 -0.700 1.00 0.00 H new ATOM 0 HB3 PRO A 53 3.888 -7.302 0.703 1.00 0.00 H new ATOM 0 HG2 PRO A 53 6.536 -7.486 0.959 1.00 0.00 H new ATOM 0 HG3 PRO A 53 5.486 -8.123 2.209 1.00 0.00 H new ATOM 0 HD2 PRO A 53 7.031 -9.614 0.100 1.00 0.00 H new ATOM 0 HD3 PRO A 53 6.699 -10.077 1.757 1.00 0.00 H new ATOM 484 N SER A 54 4.218 -10.108 -2.152 1.00 0.00 N ATOM 485 CA SER A 54 3.807 -10.405 -3.513 1.00 0.00 C ATOM 486 C SER A 54 2.742 -11.502 -3.539 1.00 0.00 C ATOM 487 O SER A 54 1.728 -11.369 -4.231 1.00 0.00 O ATOM 488 CB SER A 54 5.026 -10.819 -4.332 1.00 0.00 C ATOM 489 OG SER A 54 5.876 -11.662 -3.573 1.00 0.00 O ATOM 0 H SER A 54 5.196 -10.319 -1.954 1.00 0.00 H new ATOM 0 HA SER A 54 3.367 -9.509 -3.951 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.705 -11.337 -5.236 1.00 0.00 H new ATOM 0 HB3 SER A 54 5.575 -9.933 -4.651 1.00 0.00 H new ATOM 0 HG SER A 54 6.651 -11.918 -4.115 1.00 0.00 H new ATOM 495 N ASP A 55 2.969 -12.573 -2.771 1.00 0.00 N ATOM 496 CA ASP A 55 2.000 -13.668 -2.669 1.00 0.00 C ATOM 497 C ASP A 55 0.687 -13.125 -2.140 1.00 0.00 C ATOM 498 O ASP A 55 -0.391 -13.409 -2.667 1.00 0.00 O ATOM 499 CB ASP A 55 2.476 -14.769 -1.707 1.00 0.00 C ATOM 500 CG ASP A 55 3.888 -15.253 -1.958 1.00 0.00 C ATOM 501 OD1 ASP A 55 4.187 -15.695 -3.087 1.00 0.00 O ATOM 502 OD2 ASP A 55 4.698 -15.229 -1.007 1.00 0.00 O ATOM 0 H ASP A 55 3.813 -12.704 -2.213 1.00 0.00 H new ATOM 0 HA ASP A 55 1.885 -14.096 -3.665 1.00 0.00 H new ATOM 0 HB2 ASP A 55 2.410 -14.395 -0.685 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.796 -15.618 -1.781 1.00 0.00 H new ATOM 507 N LEU A 56 0.805 -12.326 -1.089 1.00 0.00 N ATOM 508 CA LEU A 56 -0.344 -11.754 -0.412 1.00 0.00 C ATOM 509 C LEU A 56 -1.139 -10.856 -1.353 1.00 0.00 C ATOM 510 O LEU A 56 -2.359 -10.976 -1.450 1.00 0.00 O ATOM 511 CB LEU A 56 0.124 -10.962 0.811 1.00 0.00 C ATOM 512 CG LEU A 56 -0.990 -10.398 1.691 1.00 0.00 C ATOM 513 CD1 LEU A 56 -1.885 -11.516 2.199 1.00 0.00 C ATOM 514 CD2 LEU A 56 -0.400 -9.615 2.856 1.00 0.00 C ATOM 0 H LEU A 56 1.702 -12.058 -0.684 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.999 -12.563 -0.089 1.00 0.00 H new ATOM 0 HB2 LEU A 56 0.755 -11.608 1.422 1.00 0.00 H new ATOM 0 HB3 LEU A 56 0.749 -10.136 0.471 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.596 -9.720 1.090 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.673 -11.096 2.824 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -2.332 -12.037 1.353 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.293 -12.218 2.785 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.206 -9.219 3.474 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.228 -10.274 3.456 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.201 -8.791 2.473 1.00 0.00 H new ATOM 526 N ARG A 57 -0.434 -9.976 -2.058 1.00 0.00 N ATOM 527 CA ARG A 57 -1.069 -9.038 -2.977 1.00 0.00 C ATOM 528 C ARG A 57 -1.906 -9.770 -4.023 1.00 0.00 C ATOM 529 O ARG A 57 -2.995 -9.317 -4.373 1.00 0.00 O ATOM 530 CB ARG A 57 -0.014 -8.163 -3.662 1.00 0.00 C ATOM 531 CG ARG A 57 -0.596 -7.141 -4.627 1.00 0.00 C ATOM 532 CD ARG A 57 0.473 -6.195 -5.149 1.00 0.00 C ATOM 533 NE ARG A 57 -0.065 -5.235 -6.113 1.00 0.00 N ATOM 534 CZ ARG A 57 0.100 -3.916 -6.020 1.00 0.00 C ATOM 535 NH1 ARG A 57 0.703 -3.391 -4.960 1.00 0.00 N ATOM 536 NH2 ARG A 57 -0.364 -3.115 -6.972 1.00 0.00 N ATOM 0 H ARG A 57 0.581 -9.893 -2.010 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.735 -8.400 -2.396 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.563 -7.641 -2.899 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.681 -8.805 -4.203 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.067 -7.657 -5.464 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.376 -6.569 -4.125 1.00 0.00 H new ATOM 0 HD2 ARG A 57 0.920 -5.657 -4.313 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.269 -6.772 -5.619 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.598 -5.597 -6.904 1.00 0.00 H new ATOM 0 HH11 ARG A 57 1.042 -3.998 -4.213 1.00 0.00 H new ATOM 0 HH12 ARG A 57 0.828 -2.381 -4.892 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.849 -3.509 -7.778 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.236 -2.106 -6.897 1.00 0.00 H new ATOM 550 N GLU A 58 -1.412 -10.907 -4.500 1.00 0.00 N ATOM 551 CA GLU A 58 -2.125 -11.674 -5.514 1.00 0.00 C ATOM 552 C GLU A 58 -3.433 -12.233 -4.964 1.00 0.00 C ATOM 553 O GLU A 58 -4.482 -12.109 -5.599 1.00 0.00 O ATOM 554 CB GLU A 58 -1.251 -12.803 -6.062 1.00 0.00 C ATOM 555 CG GLU A 58 -0.032 -12.300 -6.815 1.00 0.00 C ATOM 556 CD GLU A 58 0.699 -13.401 -7.549 1.00 0.00 C ATOM 557 OE1 GLU A 58 0.280 -13.742 -8.674 1.00 0.00 O ATOM 558 OE2 GLU A 58 1.701 -13.917 -7.019 1.00 0.00 O ATOM 0 H GLU A 58 -0.526 -11.316 -4.203 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.363 -10.995 -6.333 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.925 -13.436 -5.236 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.849 -13.428 -6.726 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.341 -11.537 -7.529 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.651 -11.822 -6.113 1.00 0.00 H new ATOM 565 N LYS A 59 -3.376 -12.829 -3.779 1.00 0.00 N ATOM 566 CA LYS A 59 -4.577 -13.357 -3.140 1.00 0.00 C ATOM 567 C LYS A 59 -5.549 -12.238 -2.791 1.00 0.00 C ATOM 568 O LYS A 59 -6.760 -12.378 -2.965 1.00 0.00 O ATOM 569 CB LYS A 59 -4.222 -14.158 -1.885 1.00 0.00 C ATOM 570 CG LYS A 59 -4.071 -15.648 -2.144 1.00 0.00 C ATOM 571 CD LYS A 59 -5.392 -16.267 -2.577 1.00 0.00 C ATOM 572 CE LYS A 59 -5.247 -17.746 -2.885 1.00 0.00 C ATOM 573 NZ LYS A 59 -6.533 -18.358 -3.310 1.00 0.00 N ATOM 0 H LYS A 59 -2.518 -12.959 -3.243 1.00 0.00 H new ATOM 0 HA LYS A 59 -5.062 -14.025 -3.852 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.291 -13.773 -1.468 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -4.996 -14.004 -1.133 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -3.319 -15.811 -2.916 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.713 -16.143 -1.241 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -6.133 -16.131 -1.789 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -5.765 -15.747 -3.459 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.505 -17.881 -3.672 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.874 -18.265 -2.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -6.387 -19.368 -3.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -7.235 -18.253 -2.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.878 -17.881 -4.168 1.00 0.00 H new ATOM 587 N LEU A 60 -5.015 -11.121 -2.315 1.00 0.00 N ATOM 588 CA LEU A 60 -5.842 -9.978 -1.962 1.00 0.00 C ATOM 589 C LEU A 60 -6.512 -9.390 -3.198 1.00 0.00 C ATOM 590 O LEU A 60 -7.700 -9.086 -3.175 1.00 0.00 O ATOM 591 CB LEU A 60 -5.014 -8.904 -1.250 1.00 0.00 C ATOM 592 CG LEU A 60 -4.439 -9.319 0.107 1.00 0.00 C ATOM 593 CD1 LEU A 60 -3.640 -8.180 0.715 1.00 0.00 C ATOM 594 CD2 LEU A 60 -5.550 -9.755 1.052 1.00 0.00 C ATOM 0 H LEU A 60 -4.015 -10.983 -2.165 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.617 -10.327 -1.280 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.191 -8.611 -1.902 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.638 -8.021 -1.108 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.771 -10.166 -0.049 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.238 -8.491 1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.819 -7.915 0.048 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.288 -7.315 0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -5.119 -10.046 2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.245 -8.929 1.202 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.082 -10.603 0.621 1.00 0.00 H new ATOM 606 N SER A 61 -5.754 -9.247 -4.282 1.00 0.00 N ATOM 607 CA SER A 61 -6.295 -8.683 -5.513 1.00 0.00 C ATOM 608 C SER A 61 -7.393 -9.574 -6.090 1.00 0.00 C ATOM 609 O SER A 61 -8.358 -9.080 -6.673 1.00 0.00 O ATOM 610 CB SER A 61 -5.183 -8.459 -6.545 1.00 0.00 C ATOM 611 OG SER A 61 -4.483 -9.659 -6.839 1.00 0.00 O ATOM 0 H SER A 61 -4.770 -9.512 -4.332 1.00 0.00 H new ATOM 0 HA SER A 61 -6.737 -7.717 -5.271 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.614 -8.057 -7.462 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.483 -7.713 -6.168 1.00 0.00 H new ATOM 0 HG SER A 61 -4.757 -10.360 -6.211 1.00 0.00 H new ATOM 617 N GLU A 62 -7.252 -10.884 -5.905 1.00 0.00 N ATOM 618 CA GLU A 62 -8.257 -11.830 -6.365 1.00 0.00 C ATOM 619 C GLU A 62 -9.569 -11.604 -5.625 1.00 0.00 C ATOM 620 O GLU A 62 -10.617 -11.403 -6.242 1.00 0.00 O ATOM 621 CB GLU A 62 -7.776 -13.266 -6.149 1.00 0.00 C ATOM 622 CG GLU A 62 -8.762 -14.318 -6.631 1.00 0.00 C ATOM 623 CD GLU A 62 -8.926 -14.325 -8.137 1.00 0.00 C ATOM 624 OE1 GLU A 62 -9.621 -13.437 -8.677 1.00 0.00 O ATOM 625 OE2 GLU A 62 -8.363 -15.225 -8.790 1.00 0.00 O ATOM 0 H GLU A 62 -6.451 -11.311 -5.440 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.420 -11.672 -7.431 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.828 -13.404 -6.668 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.584 -13.420 -5.087 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.426 -15.301 -6.302 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.732 -14.141 -6.166 1.00 0.00 H new ATOM 632 N LEU A 63 -9.498 -11.608 -4.300 1.00 0.00 N ATOM 633 CA LEU A 63 -10.681 -11.426 -3.471 1.00 0.00 C ATOM 634 C LEU A 63 -11.252 -10.021 -3.653 1.00 0.00 C ATOM 635 O LEU A 63 -12.468 -9.822 -3.620 1.00 0.00 O ATOM 636 CB LEU A 63 -10.344 -11.671 -1.997 1.00 0.00 C ATOM 637 CG LEU A 63 -9.660 -13.007 -1.690 1.00 0.00 C ATOM 638 CD1 LEU A 63 -9.451 -13.160 -0.192 1.00 0.00 C ATOM 639 CD2 LEU A 63 -10.469 -14.176 -2.235 1.00 0.00 C ATOM 0 H LEU A 63 -8.632 -11.736 -3.776 1.00 0.00 H new ATOM 0 HA LEU A 63 -11.433 -12.151 -3.783 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -9.698 -10.864 -1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.265 -11.613 -1.417 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.688 -13.011 -2.184 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.964 -14.114 0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -8.823 -12.347 0.173 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -10.415 -13.129 0.315 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.959 -15.111 -2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -11.458 -14.178 -1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -10.569 -14.077 -3.316 1.00 0.00 H new ATOM 651 N ALA A 64 -10.367 -9.051 -3.853 1.00 0.00 N ATOM 652 CA ALA A 64 -10.775 -7.671 -4.080 1.00 0.00 C ATOM 653 C ALA A 64 -11.521 -7.535 -5.401 1.00 0.00 C ATOM 654 O ALA A 64 -12.521 -6.830 -5.485 1.00 0.00 O ATOM 655 CB ALA A 64 -9.571 -6.742 -4.053 1.00 0.00 C ATOM 0 H ALA A 64 -9.358 -9.197 -3.862 1.00 0.00 H new ATOM 0 HA ALA A 64 -11.451 -7.384 -3.274 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.899 -5.717 -4.225 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.082 -6.809 -3.081 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.869 -7.034 -4.834 1.00 0.00 H new ATOM 661 N ASP A 65 -11.034 -8.219 -6.432 1.00 0.00 N ATOM 662 CA ASP A 65 -11.676 -8.185 -7.743 1.00 0.00 C ATOM 663 C ASP A 65 -13.000 -8.932 -7.705 1.00 0.00 C ATOM 664 O ASP A 65 -13.973 -8.528 -8.343 1.00 0.00 O ATOM 665 CB ASP A 65 -10.768 -8.795 -8.812 1.00 0.00 C ATOM 666 CG ASP A 65 -11.408 -8.793 -10.187 1.00 0.00 C ATOM 667 OD1 ASP A 65 -11.376 -7.746 -10.862 1.00 0.00 O ATOM 668 OD2 ASP A 65 -11.943 -9.844 -10.604 1.00 0.00 O ATOM 0 H ASP A 65 -10.199 -8.803 -6.386 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.862 -7.142 -7.999 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -9.832 -8.238 -8.850 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -10.519 -9.819 -8.532 1.00 0.00 H new ATOM 673 N ALA A 66 -13.027 -10.021 -6.946 1.00 0.00 N ATOM 674 CA ALA A 66 -14.236 -10.813 -6.780 1.00 0.00 C ATOM 675 C ALA A 66 -15.377 -9.958 -6.239 1.00 0.00 C ATOM 676 O ALA A 66 -16.504 -10.032 -6.728 1.00 0.00 O ATOM 677 CB ALA A 66 -13.973 -11.993 -5.855 1.00 0.00 C ATOM 0 H ALA A 66 -12.220 -10.376 -6.434 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.531 -11.193 -7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.887 -12.576 -5.740 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -13.192 -12.622 -6.281 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.652 -11.626 -4.880 1.00 0.00 H new ATOM 683 N LYS A 67 -15.074 -9.135 -5.242 1.00 0.00 N ATOM 684 CA LYS A 67 -16.086 -8.285 -4.630 1.00 0.00 C ATOM 685 C LYS A 67 -16.248 -6.979 -5.406 1.00 0.00 C ATOM 686 O LYS A 67 -17.363 -6.482 -5.563 1.00 0.00 O ATOM 687 CB LYS A 67 -15.744 -8.026 -3.161 1.00 0.00 C ATOM 688 CG LYS A 67 -15.576 -9.316 -2.375 1.00 0.00 C ATOM 689 CD LYS A 67 -15.470 -9.089 -0.877 1.00 0.00 C ATOM 690 CE LYS A 67 -15.239 -10.410 -0.159 1.00 0.00 C ATOM 691 NZ LYS A 67 -15.306 -10.286 1.319 1.00 0.00 N ATOM 0 H LYS A 67 -14.140 -9.039 -4.842 1.00 0.00 H new ATOM 0 HA LYS A 67 -17.044 -8.804 -4.667 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -14.825 -7.444 -3.101 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -16.532 -7.426 -2.707 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -16.423 -9.972 -2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.682 -9.833 -2.723 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -14.651 -8.403 -0.663 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.382 -8.621 -0.508 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -15.984 -11.133 -0.492 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -14.263 -10.805 -0.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -14.914 -11.144 1.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -14.755 -9.458 1.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -16.297 -10.169 1.613 1.00 0.00 H new ATOM 705 N GLY A 68 -15.143 -6.439 -5.904 1.00 0.00 N ATOM 706 CA GLY A 68 -15.211 -5.264 -6.752 1.00 0.00 C ATOM 707 C GLY A 68 -14.490 -4.064 -6.171 1.00 0.00 C ATOM 708 O GLY A 68 -15.120 -3.077 -5.798 1.00 0.00 O ATOM 0 H GLY A 68 -14.201 -6.793 -5.736 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -14.781 -5.501 -7.725 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -16.256 -5.005 -6.920 1.00 0.00 H new ATOM 712 N GLY A 69 -13.168 -4.135 -6.102 1.00 0.00 N ATOM 713 CA GLY A 69 -12.391 -3.016 -5.602 1.00 0.00 C ATOM 714 C GLY A 69 -11.058 -2.874 -6.308 1.00 0.00 C ATOM 715 O GLY A 69 -10.477 -3.867 -6.751 1.00 0.00 O ATOM 0 H GLY A 69 -12.619 -4.947 -6.383 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -12.963 -2.097 -5.725 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -12.221 -3.145 -4.533 1.00 0.00 H new ATOM 719 N LYS A 70 -10.573 -1.640 -6.420 1.00 0.00 N ATOM 720 CA LYS A 70 -9.284 -1.376 -7.055 1.00 0.00 C ATOM 721 C LYS A 70 -8.180 -1.317 -6.007 1.00 0.00 C ATOM 722 O LYS A 70 -7.021 -1.619 -6.287 1.00 0.00 O ATOM 723 CB LYS A 70 -9.296 -0.045 -7.819 1.00 0.00 C ATOM 724 CG LYS A 70 -10.266 0.026 -8.989 1.00 0.00 C ATOM 725 CD LYS A 70 -10.121 1.354 -9.722 1.00 0.00 C ATOM 726 CE LYS A 70 -11.166 1.523 -10.814 1.00 0.00 C ATOM 727 NZ LYS A 70 -11.097 2.869 -11.454 1.00 0.00 N ATOM 0 H LYS A 70 -11.053 -0.807 -6.079 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.098 -2.190 -7.756 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.538 0.754 -7.119 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -8.290 0.151 -8.190 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -10.077 -0.798 -9.677 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.288 -0.088 -8.629 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -10.208 2.173 -9.008 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -9.125 1.418 -10.161 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -11.024 0.754 -11.573 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.159 1.374 -10.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -12.041 3.139 -11.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.769 3.568 -10.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -10.433 2.839 -12.254 1.00 0.00 H new ATOM 741 N TYR A 71 -8.547 -0.918 -4.798 1.00 0.00 N ATOM 742 CA TYR A 71 -7.573 -0.697 -3.743 1.00 0.00 C ATOM 743 C TYR A 71 -7.935 -1.496 -2.505 1.00 0.00 C ATOM 744 O TYR A 71 -9.115 -1.719 -2.220 1.00 0.00 O ATOM 745 CB TYR A 71 -7.494 0.793 -3.394 1.00 0.00 C ATOM 746 CG TYR A 71 -7.186 1.677 -4.581 1.00 0.00 C ATOM 747 CD1 TYR A 71 -5.878 1.886 -4.997 1.00 0.00 C ATOM 748 CD2 TYR A 71 -8.208 2.287 -5.297 1.00 0.00 C ATOM 749 CE1 TYR A 71 -5.598 2.684 -6.090 1.00 0.00 C ATOM 750 CE2 TYR A 71 -7.937 3.080 -6.392 1.00 0.00 C ATOM 751 CZ TYR A 71 -6.631 3.275 -6.785 1.00 0.00 C ATOM 752 OH TYR A 71 -6.358 4.060 -7.882 1.00 0.00 O ATOM 0 H TYR A 71 -9.514 -0.741 -4.525 1.00 0.00 H new ATOM 0 HA TYR A 71 -6.600 -1.030 -4.103 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -8.441 1.106 -2.955 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.727 0.939 -2.634 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -5.067 1.418 -4.458 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -9.233 2.138 -4.991 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -4.575 2.844 -6.398 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -8.744 3.546 -6.938 1.00 0.00 H new ATOM 0 HH TYR A 71 -7.197 4.400 -8.258 1.00 0.00 H new ATOM 762 N TYR A 72 -6.922 -1.929 -1.777 1.00 0.00 N ATOM 763 CA TYR A 72 -7.138 -2.628 -0.526 1.00 0.00 C ATOM 764 C TYR A 72 -6.329 -1.975 0.585 1.00 0.00 C ATOM 765 O TYR A 72 -5.347 -1.282 0.326 1.00 0.00 O ATOM 766 CB TYR A 72 -6.795 -4.123 -0.650 1.00 0.00 C ATOM 767 CG TYR A 72 -5.351 -4.424 -1.003 1.00 0.00 C ATOM 768 CD1 TYR A 72 -4.383 -4.548 -0.013 1.00 0.00 C ATOM 769 CD2 TYR A 72 -4.960 -4.603 -2.325 1.00 0.00 C ATOM 770 CE1 TYR A 72 -3.069 -4.834 -0.329 1.00 0.00 C ATOM 771 CE2 TYR A 72 -3.646 -4.893 -2.648 1.00 0.00 C ATOM 772 CZ TYR A 72 -2.706 -5.008 -1.645 1.00 0.00 C ATOM 773 OH TYR A 72 -1.397 -5.295 -1.962 1.00 0.00 O ATOM 0 H TYR A 72 -5.942 -1.808 -2.032 1.00 0.00 H new ATOM 0 HA TYR A 72 -8.197 -2.558 -0.276 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -7.032 -4.614 0.294 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -7.439 -4.566 -1.410 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -4.663 -4.418 1.022 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -5.694 -4.514 -3.113 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -2.330 -4.921 0.453 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -3.358 -5.029 -3.680 1.00 0.00 H new ATOM 0 HH TYR A 72 -0.984 -5.793 -1.226 1.00 0.00 H new ATOM 783 N HIS A 73 -6.765 -2.174 1.815 1.00 0.00 N ATOM 784 CA HIS A 73 -6.082 -1.618 2.972 1.00 0.00 C ATOM 785 C HIS A 73 -5.949 -2.673 4.062 1.00 0.00 C ATOM 786 O HIS A 73 -6.936 -3.044 4.693 1.00 0.00 O ATOM 787 CB HIS A 73 -6.848 -0.401 3.503 1.00 0.00 C ATOM 788 CG HIS A 73 -6.282 0.174 4.768 1.00 0.00 C ATOM 789 ND1 HIS A 73 -7.041 0.410 5.891 1.00 0.00 N ATOM 790 CD2 HIS A 73 -5.023 0.563 5.079 1.00 0.00 C ATOM 791 CE1 HIS A 73 -6.277 0.919 6.837 1.00 0.00 C ATOM 792 NE2 HIS A 73 -5.043 1.021 6.374 1.00 0.00 N ATOM 0 H HIS A 73 -7.596 -2.721 2.041 1.00 0.00 H new ATOM 0 HA HIS A 73 -5.084 -1.300 2.670 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -6.855 0.373 2.736 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.885 -0.686 3.678 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.039 0.221 5.978 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.162 0.521 4.429 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -6.605 1.205 7.826 1.00 0.00 H new ATOM 801 N ILE A 74 -4.735 -3.160 4.268 1.00 0.00 N ATOM 802 CA ILE A 74 -4.485 -4.166 5.288 1.00 0.00 C ATOM 803 C ILE A 74 -4.560 -3.552 6.684 1.00 0.00 C ATOM 804 O ILE A 74 -3.838 -2.606 7.004 1.00 0.00 O ATOM 805 CB ILE A 74 -3.115 -4.848 5.085 1.00 0.00 C ATOM 806 CG1 ILE A 74 -3.082 -5.562 3.731 1.00 0.00 C ATOM 807 CG2 ILE A 74 -2.826 -5.829 6.216 1.00 0.00 C ATOM 808 CD1 ILE A 74 -1.747 -6.197 3.408 1.00 0.00 C ATOM 0 H ILE A 74 -3.908 -2.875 3.743 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.261 -4.925 5.193 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.339 -4.082 5.098 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.853 -6.332 3.718 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.333 -4.847 2.947 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -1.856 -6.298 6.052 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -2.815 -5.296 7.166 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -3.600 -6.596 6.239 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.802 -6.683 2.434 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.974 -5.429 3.387 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.502 -6.937 4.170 1.00 0.00 H new ATOM 820 N ILE A 75 -5.458 -4.084 7.499 1.00 0.00 N ATOM 821 CA ILE A 75 -5.622 -3.619 8.868 1.00 0.00 C ATOM 822 C ILE A 75 -5.062 -4.642 9.846 1.00 0.00 C ATOM 823 O ILE A 75 -4.921 -4.368 11.039 1.00 0.00 O ATOM 824 CB ILE A 75 -7.103 -3.345 9.205 1.00 0.00 C ATOM 825 CG1 ILE A 75 -7.948 -4.604 8.982 1.00 0.00 C ATOM 826 CG2 ILE A 75 -7.629 -2.188 8.368 1.00 0.00 C ATOM 827 CD1 ILE A 75 -9.405 -4.434 9.347 1.00 0.00 C ATOM 0 H ILE A 75 -6.087 -4.842 7.234 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.071 -2.683 8.960 1.00 0.00 H new ATOM 0 HB ILE A 75 -7.175 -3.070 10.257 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -7.877 -4.897 7.934 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.529 -5.420 9.570 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -8.675 -2.006 8.616 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -7.045 -1.292 8.578 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -7.545 -2.437 7.310 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -9.938 -5.367 9.162 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -9.488 -4.172 10.402 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.842 -3.640 8.741 1.00 0.00 H new ATOM 839 N ALA A 76 -4.756 -5.827 9.330 1.00 0.00 N ATOM 840 CA ALA A 76 -4.172 -6.886 10.137 1.00 0.00 C ATOM 841 C ALA A 76 -3.479 -7.911 9.252 1.00 0.00 C ATOM 842 O ALA A 76 -4.031 -8.339 8.241 1.00 0.00 O ATOM 843 CB ALA A 76 -5.242 -7.560 10.986 1.00 0.00 C ATOM 0 H ALA A 76 -4.904 -6.077 8.352 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.430 -6.442 10.800 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.788 -8.350 11.584 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.700 -6.823 11.646 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.005 -7.989 10.337 1.00 0.00 H new ATOM 849 N ALA A 77 -2.267 -8.281 9.622 1.00 0.00 N ATOM 850 CA ALA A 77 -1.524 -9.315 8.916 1.00 0.00 C ATOM 851 C ALA A 77 -0.698 -10.110 9.913 1.00 0.00 C ATOM 852 O ALA A 77 0.503 -9.888 10.063 1.00 0.00 O ATOM 853 CB ALA A 77 -0.637 -8.708 7.837 1.00 0.00 C ATOM 0 H ALA A 77 -1.770 -7.877 10.416 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.228 -9.984 8.421 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.093 -9.501 7.325 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.255 -8.169 7.119 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.072 -8.018 8.295 1.00 0.00 H new ATOM 859 N ARG A 78 -1.355 -11.024 10.607 1.00 0.00 N ATOM 860 CA ARG A 78 -0.734 -11.721 11.722 1.00 0.00 C ATOM 861 C ARG A 78 -0.131 -13.048 11.290 1.00 0.00 C ATOM 862 O ARG A 78 -0.637 -13.716 10.384 1.00 0.00 O ATOM 863 CB ARG A 78 -1.754 -11.966 12.836 1.00 0.00 C ATOM 864 CG ARG A 78 -2.915 -12.853 12.414 1.00 0.00 C ATOM 865 CD ARG A 78 -3.748 -13.292 13.605 1.00 0.00 C ATOM 866 NE ARG A 78 -4.366 -12.165 14.296 1.00 0.00 N ATOM 867 CZ ARG A 78 -4.216 -11.916 15.596 1.00 0.00 C ATOM 868 NH1 ARG A 78 -3.395 -12.659 16.328 1.00 0.00 N ATOM 869 NH2 ARG A 78 -4.875 -10.911 16.160 1.00 0.00 N ATOM 0 H ARG A 78 -2.318 -11.301 10.418 1.00 0.00 H new ATOM 0 HA ARG A 78 0.068 -11.084 12.094 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.248 -12.424 13.686 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.145 -11.007 13.176 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.546 -12.314 11.707 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -2.532 -13.731 11.894 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.525 -13.979 13.269 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -3.117 -13.842 14.304 1.00 0.00 H new ATOM 0 HE ARG A 78 -4.948 -11.529 13.751 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.877 -13.423 15.895 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -3.283 -12.465 17.323 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -5.496 -10.329 15.598 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -4.760 -10.721 17.155 1.00 0.00 H new ATOM 883 N GLU A 79 0.951 -13.421 11.950 1.00 0.00 N ATOM 884 CA GLU A 79 1.564 -14.716 11.744 1.00 0.00 C ATOM 885 C GLU A 79 1.113 -15.654 12.857 1.00 0.00 C ATOM 886 O GLU A 79 1.724 -15.729 13.927 1.00 0.00 O ATOM 887 CB GLU A 79 3.087 -14.582 11.709 1.00 0.00 C ATOM 888 CG GLU A 79 3.811 -15.833 11.242 1.00 0.00 C ATOM 889 CD GLU A 79 5.283 -15.580 10.998 1.00 0.00 C ATOM 890 OE1 GLU A 79 6.031 -15.409 11.985 1.00 0.00 O ATOM 891 OE2 GLU A 79 5.698 -15.540 9.821 1.00 0.00 O ATOM 0 H GLU A 79 1.425 -12.837 12.639 1.00 0.00 H new ATOM 0 HA GLU A 79 1.252 -15.130 10.785 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.353 -13.755 11.051 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.441 -14.322 12.707 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.697 -16.618 11.990 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.349 -16.198 10.325 1.00 0.00 H new ATOM 898 N HIS A 80 0.015 -16.341 12.601 1.00 0.00 N ATOM 899 CA HIS A 80 -0.633 -17.193 13.591 1.00 0.00 C ATOM 900 C HIS A 80 -0.002 -18.583 13.563 1.00 0.00 C ATOM 901 O HIS A 80 -0.697 -19.598 13.487 1.00 0.00 O ATOM 902 CB HIS A 80 -2.136 -17.263 13.275 1.00 0.00 C ATOM 903 CG HIS A 80 -3.010 -17.766 14.392 1.00 0.00 C ATOM 904 ND1 HIS A 80 -4.354 -17.474 14.464 1.00 0.00 N ATOM 905 CD2 HIS A 80 -2.744 -18.554 15.462 1.00 0.00 C ATOM 906 CE1 HIS A 80 -4.875 -18.061 15.523 1.00 0.00 C ATOM 907 NE2 HIS A 80 -3.921 -18.722 16.146 1.00 0.00 N ATOM 0 H HIS A 80 -0.458 -16.326 11.697 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.500 -16.781 14.591 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -2.477 -16.267 12.991 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.278 -17.908 12.408 1.00 0.00 H new ATOM 0 HD1 HIS A 80 -4.867 -16.893 13.801 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -1.784 -18.972 15.727 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.910 -18.009 15.828 1.00 0.00 H new ATOM 916 N GLY A 81 1.321 -18.621 13.628 1.00 0.00 N ATOM 917 CA GLY A 81 2.036 -19.875 13.562 1.00 0.00 C ATOM 918 C GLY A 81 2.045 -20.436 12.158 1.00 0.00 C ATOM 919 O GLY A 81 2.569 -19.804 11.242 1.00 0.00 O ATOM 0 H GLY A 81 1.914 -17.797 13.726 1.00 0.00 H new ATOM 0 HA2 GLY A 81 3.061 -19.729 13.903 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.575 -20.594 14.239 1.00 0.00 H new ATOM 923 N PRO A 82 1.463 -21.624 11.951 1.00 0.00 N ATOM 924 CA PRO A 82 1.324 -22.216 10.622 1.00 0.00 C ATOM 925 C PRO A 82 0.181 -21.586 9.826 1.00 0.00 C ATOM 926 O PRO A 82 -0.063 -21.946 8.675 1.00 0.00 O ATOM 927 CB PRO A 82 1.026 -23.682 10.922 1.00 0.00 C ATOM 928 CG PRO A 82 0.337 -23.663 12.244 1.00 0.00 C ATOM 929 CD PRO A 82 0.910 -22.497 13.006 1.00 0.00 C ATOM 0 HA PRO A 82 2.212 -22.065 10.009 1.00 0.00 H new ATOM 0 HB2 PRO A 82 0.394 -24.124 10.152 1.00 0.00 H new ATOM 0 HB3 PRO A 82 1.941 -24.273 10.960 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.740 -23.553 12.119 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.502 -24.597 12.781 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.144 -21.985 13.588 1.00 0.00 H new ATOM 0 HD3 PRO A 82 1.682 -22.817 13.706 1.00 0.00 H new ATOM 937 N ASN A 83 -0.517 -20.647 10.451 1.00 0.00 N ATOM 938 CA ASN A 83 -1.625 -19.953 9.808 1.00 0.00 C ATOM 939 C ASN A 83 -1.280 -18.489 9.589 1.00 0.00 C ATOM 940 O ASN A 83 -0.742 -17.834 10.475 1.00 0.00 O ATOM 941 CB ASN A 83 -2.895 -20.050 10.660 1.00 0.00 C ATOM 942 CG ASN A 83 -3.473 -21.449 10.699 1.00 0.00 C ATOM 943 OD1 ASN A 83 -3.093 -22.270 11.536 1.00 0.00 O ATOM 944 ND2 ASN A 83 -4.415 -21.720 9.812 1.00 0.00 N ATOM 0 H ASN A 83 -0.334 -20.347 11.409 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.804 -20.431 8.845 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -2.670 -19.727 11.676 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -3.644 -19.364 10.266 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.858 -22.639 9.803 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.699 -21.010 9.137 1.00 0.00 H new ATOM 951 N PHE A 84 -1.580 -17.983 8.411 1.00 0.00 N ATOM 952 CA PHE A 84 -1.395 -16.574 8.122 1.00 0.00 C ATOM 953 C PHE A 84 -2.753 -15.926 7.900 1.00 0.00 C ATOM 954 O PHE A 84 -3.510 -16.339 7.019 1.00 0.00 O ATOM 955 CB PHE A 84 -0.503 -16.384 6.891 1.00 0.00 C ATOM 956 CG PHE A 84 -0.188 -14.945 6.593 1.00 0.00 C ATOM 957 CD1 PHE A 84 0.809 -14.283 7.292 1.00 0.00 C ATOM 958 CD2 PHE A 84 -0.891 -14.253 5.620 1.00 0.00 C ATOM 959 CE1 PHE A 84 1.099 -12.959 7.026 1.00 0.00 C ATOM 960 CE2 PHE A 84 -0.605 -12.928 5.351 1.00 0.00 C ATOM 961 CZ PHE A 84 0.391 -12.281 6.054 1.00 0.00 C ATOM 0 H PHE A 84 -1.955 -18.528 7.634 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.900 -16.098 8.969 1.00 0.00 H new ATOM 0 HB2 PHE A 84 0.430 -16.928 7.041 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -0.994 -16.827 6.025 1.00 0.00 H new ATOM 0 HD1 PHE A 84 1.366 -14.809 8.054 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -1.671 -14.754 5.066 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.879 -12.455 7.578 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.161 -12.399 4.591 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.616 -11.246 5.844 1.00 0.00 H new ATOM 971 N GLU A 85 -3.070 -14.930 8.710 1.00 0.00 N ATOM 972 CA GLU A 85 -4.359 -14.266 8.622 1.00 0.00 C ATOM 973 C GLU A 85 -4.185 -12.816 8.195 1.00 0.00 C ATOM 974 O GLU A 85 -3.640 -11.997 8.939 1.00 0.00 O ATOM 975 CB GLU A 85 -5.097 -14.341 9.958 1.00 0.00 C ATOM 976 CG GLU A 85 -5.380 -15.761 10.420 1.00 0.00 C ATOM 977 CD GLU A 85 -6.171 -15.808 11.710 1.00 0.00 C ATOM 978 OE1 GLU A 85 -7.414 -15.769 11.650 1.00 0.00 O ATOM 979 OE2 GLU A 85 -5.551 -15.879 12.790 1.00 0.00 O ATOM 0 H GLU A 85 -2.453 -14.564 9.435 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.956 -14.780 7.869 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -4.506 -13.832 10.719 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -6.040 -13.801 9.873 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -5.930 -16.289 9.641 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.436 -16.289 10.558 1.00 0.00 H new ATOM 986 N ALA A 86 -4.633 -12.514 6.989 1.00 0.00 N ATOM 987 CA ALA A 86 -4.551 -11.168 6.454 1.00 0.00 C ATOM 988 C ALA A 86 -5.938 -10.557 6.329 1.00 0.00 C ATOM 989 O ALA A 86 -6.797 -11.082 5.620 1.00 0.00 O ATOM 990 CB ALA A 86 -3.852 -11.177 5.105 1.00 0.00 C ATOM 0 H ALA A 86 -5.061 -13.191 6.357 1.00 0.00 H new ATOM 0 HA ALA A 86 -3.968 -10.558 7.144 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.798 -10.160 4.716 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -2.844 -11.575 5.220 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.412 -11.802 4.409 1.00 0.00 H new ATOM 996 N VAL A 87 -6.149 -9.456 7.027 1.00 0.00 N ATOM 997 CA VAL A 87 -7.422 -8.761 7.001 1.00 0.00 C ATOM 998 C VAL A 87 -7.259 -7.418 6.298 1.00 0.00 C ATOM 999 O VAL A 87 -6.471 -6.572 6.737 1.00 0.00 O ATOM 1000 CB VAL A 87 -7.967 -8.522 8.427 1.00 0.00 C ATOM 1001 CG1 VAL A 87 -9.423 -8.084 8.378 1.00 0.00 C ATOM 1002 CG2 VAL A 87 -7.799 -9.762 9.294 1.00 0.00 C ATOM 0 H VAL A 87 -5.447 -9.021 7.625 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.133 -9.387 6.461 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.385 -7.720 8.881 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -9.788 -7.921 9.392 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -9.505 -7.158 7.809 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -10.020 -8.859 7.898 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.191 -9.564 10.292 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -8.344 -10.594 8.848 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.741 -10.017 9.364 1.00 0.00 H new ATOM 1012 N ALA A 88 -7.990 -7.226 5.210 1.00 0.00 N ATOM 1013 CA ALA A 88 -7.871 -6.007 4.423 1.00 0.00 C ATOM 1014 C ALA A 88 -9.240 -5.459 4.039 1.00 0.00 C ATOM 1015 O ALA A 88 -10.209 -6.205 3.923 1.00 0.00 O ATOM 1016 CB ALA A 88 -7.036 -6.265 3.177 1.00 0.00 C ATOM 0 H ALA A 88 -8.670 -7.897 4.852 1.00 0.00 H new ATOM 0 HA ALA A 88 -7.371 -5.258 5.037 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.954 -5.346 2.597 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.040 -6.599 3.469 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.514 -7.035 2.571 1.00 0.00 H new ATOM 1022 N GLU A 89 -9.303 -4.155 3.821 1.00 0.00 N ATOM 1023 CA GLU A 89 -10.546 -3.496 3.447 1.00 0.00 C ATOM 1024 C GLU A 89 -10.548 -3.222 1.948 1.00 0.00 C ATOM 1025 O GLU A 89 -9.531 -2.823 1.388 1.00 0.00 O ATOM 1026 CB GLU A 89 -10.694 -2.174 4.205 1.00 0.00 C ATOM 1027 CG GLU A 89 -10.540 -2.303 5.712 1.00 0.00 C ATOM 1028 CD GLU A 89 -10.598 -0.963 6.420 1.00 0.00 C ATOM 1029 OE1 GLU A 89 -9.593 -0.217 6.378 1.00 0.00 O ATOM 1030 OE2 GLU A 89 -11.644 -0.651 7.027 1.00 0.00 O ATOM 0 H GLU A 89 -8.502 -3.528 3.897 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.381 -4.148 3.703 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -9.950 -1.469 3.833 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -11.674 -1.749 3.986 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.327 -2.949 6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -9.590 -2.788 5.936 1.00 0.00 H new ATOM 1037 N VAL A 90 -11.688 -3.443 1.306 1.00 0.00 N ATOM 1038 CA VAL A 90 -11.794 -3.286 -0.141 1.00 0.00 C ATOM 1039 C VAL A 90 -12.422 -1.947 -0.500 1.00 0.00 C ATOM 1040 O VAL A 90 -13.547 -1.648 -0.085 1.00 0.00 O ATOM 1041 CB VAL A 90 -12.637 -4.417 -0.768 1.00 0.00 C ATOM 1042 CG1 VAL A 90 -12.677 -4.292 -2.284 1.00 0.00 C ATOM 1043 CG2 VAL A 90 -12.096 -5.774 -0.358 1.00 0.00 C ATOM 0 H VAL A 90 -12.553 -3.732 1.763 1.00 0.00 H new ATOM 0 HA VAL A 90 -10.781 -3.331 -0.541 1.00 0.00 H new ATOM 0 HB VAL A 90 -13.657 -4.324 -0.396 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -13.277 -5.101 -2.700 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -13.119 -3.334 -2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -11.664 -4.351 -2.681 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -12.703 -6.559 -0.809 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -11.065 -5.872 -0.697 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -12.131 -5.867 0.727 1.00 0.00 H new ATOM 1053 N TYR A 91 -11.698 -1.148 -1.271 1.00 0.00 N ATOM 1054 CA TYR A 91 -12.185 0.152 -1.702 1.00 0.00 C ATOM 1055 C TYR A 91 -12.232 0.237 -3.223 1.00 0.00 C ATOM 1056 O TYR A 91 -11.311 -0.203 -3.918 1.00 0.00 O ATOM 1057 CB TYR A 91 -11.304 1.271 -1.138 1.00 0.00 C ATOM 1058 CG TYR A 91 -11.414 1.429 0.362 1.00 0.00 C ATOM 1059 CD1 TYR A 91 -10.616 0.686 1.222 1.00 0.00 C ATOM 1060 CD2 TYR A 91 -12.321 2.320 0.917 1.00 0.00 C ATOM 1061 CE1 TYR A 91 -10.723 0.824 2.593 1.00 0.00 C ATOM 1062 CE2 TYR A 91 -12.433 2.466 2.287 1.00 0.00 C ATOM 1063 CZ TYR A 91 -11.632 1.716 3.120 1.00 0.00 C ATOM 1064 OH TYR A 91 -11.742 1.856 4.486 1.00 0.00 O ATOM 0 H TYR A 91 -10.765 -1.381 -1.612 1.00 0.00 H new ATOM 0 HA TYR A 91 -13.198 0.276 -1.318 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -10.265 1.070 -1.399 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -11.576 2.212 -1.615 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -9.900 -0.011 0.813 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -12.951 2.910 0.267 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -10.097 0.236 3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -13.145 3.164 2.702 1.00 0.00 H new ATOM 0 HH TYR A 91 -12.427 2.525 4.692 1.00 0.00 H new ATOM 1074 N ASN A 92 -13.314 0.797 -3.735 1.00 0.00 N ATOM 1075 CA ASN A 92 -13.487 0.961 -5.167 1.00 0.00 C ATOM 1076 C ASN A 92 -13.326 2.427 -5.538 1.00 0.00 C ATOM 1077 O ASN A 92 -13.539 3.319 -4.711 1.00 0.00 O ATOM 1078 CB ASN A 92 -14.867 0.464 -5.611 1.00 0.00 C ATOM 1079 CG ASN A 92 -14.958 0.264 -7.114 1.00 0.00 C ATOM 1080 OD1 ASN A 92 -15.210 1.202 -7.865 1.00 0.00 O ATOM 1081 ND2 ASN A 92 -14.775 -0.968 -7.559 1.00 0.00 N ATOM 0 H ASN A 92 -14.091 1.148 -3.175 1.00 0.00 H new ATOM 0 HA ASN A 92 -12.727 0.368 -5.676 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.089 -0.477 -5.108 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -15.626 1.180 -5.297 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -14.842 -1.165 -8.558 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -14.567 -1.721 -6.904 1.00 0.00 H new ATOM 1088 N ASP A 93 -12.956 2.671 -6.780 1.00 0.00 N ATOM 1089 CA ASP A 93 -12.728 4.022 -7.260 1.00 0.00 C ATOM 1090 C ASP A 93 -13.996 4.586 -7.901 1.00 0.00 C ATOM 1091 O ASP A 93 -14.167 4.538 -9.118 1.00 0.00 O ATOM 1092 CB ASP A 93 -11.556 4.028 -8.244 1.00 0.00 C ATOM 1093 CG ASP A 93 -11.291 5.382 -8.865 1.00 0.00 C ATOM 1094 OD1 ASP A 93 -11.050 6.351 -8.116 1.00 0.00 O ATOM 1095 OD2 ASP A 93 -11.286 5.468 -10.108 1.00 0.00 O ATOM 0 H ASP A 93 -12.806 1.945 -7.481 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.474 4.665 -6.417 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -10.657 3.693 -7.727 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -11.755 3.307 -9.037 1.00 0.00 H new ATOM 1100 N ALA A 94 -14.912 5.037 -7.040 1.00 0.00 N ATOM 1101 CA ALA A 94 -16.139 5.737 -7.448 1.00 0.00 C ATOM 1102 C ALA A 94 -17.102 4.861 -8.259 1.00 0.00 C ATOM 1103 O ALA A 94 -18.119 5.353 -8.745 1.00 0.00 O ATOM 1104 CB ALA A 94 -15.795 7.001 -8.223 1.00 0.00 C ATOM 0 H ALA A 94 -14.824 4.927 -6.030 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.662 5.999 -6.528 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -16.714 7.508 -8.518 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -15.201 7.663 -7.593 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.224 6.738 -9.113 1.00 0.00 H new ATOM 1110 N THR A 95 -16.797 3.568 -8.372 1.00 0.00 N ATOM 1111 CA THR A 95 -17.615 2.626 -9.138 1.00 0.00 C ATOM 1112 C THR A 95 -17.500 2.888 -10.643 1.00 0.00 C ATOM 1113 O THR A 95 -17.734 3.999 -11.116 1.00 0.00 O ATOM 1114 CB THR A 95 -19.101 2.671 -8.714 1.00 0.00 C ATOM 1115 OG1 THR A 95 -19.208 2.502 -7.294 1.00 0.00 O ATOM 1116 CG2 THR A 95 -19.901 1.582 -9.412 1.00 0.00 C ATOM 0 H THR A 95 -15.978 3.144 -7.936 1.00 0.00 H new ATOM 0 HA THR A 95 -17.229 1.630 -8.920 1.00 0.00 H new ATOM 0 HB THR A 95 -19.506 3.641 -9.003 1.00 0.00 H new ATOM 0 HG1 THR A 95 -20.152 2.533 -7.031 1.00 0.00 H new ATOM 0 HG21 THR A 95 -20.943 1.636 -9.096 1.00 0.00 H new ATOM 0 HG22 THR A 95 -19.842 1.722 -10.491 1.00 0.00 H new ATOM 0 HG23 THR A 95 -19.493 0.606 -9.150 1.00 0.00 H new ATOM 1124 N LYS A 96 -17.136 1.854 -11.393 1.00 0.00 N ATOM 1125 CA LYS A 96 -16.961 1.988 -12.834 1.00 0.00 C ATOM 1126 C LYS A 96 -18.306 2.112 -13.551 1.00 0.00 C ATOM 1127 O LYS A 96 -18.401 2.775 -14.584 1.00 0.00 O ATOM 1128 CB LYS A 96 -16.170 0.801 -13.401 1.00 0.00 C ATOM 1129 CG LYS A 96 -16.861 -0.545 -13.238 1.00 0.00 C ATOM 1130 CD LYS A 96 -16.095 -1.648 -13.950 1.00 0.00 C ATOM 1131 CE LYS A 96 -16.842 -2.972 -13.901 1.00 0.00 C ATOM 1132 NZ LYS A 96 -16.957 -3.506 -12.518 1.00 0.00 N ATOM 0 H LYS A 96 -16.957 0.918 -11.029 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.396 2.903 -13.009 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -15.985 0.976 -14.461 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -15.198 0.759 -12.910 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -16.949 -0.785 -12.178 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -17.874 -0.487 -13.636 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -15.927 -1.363 -14.989 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.114 -1.766 -13.489 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.839 -2.839 -14.321 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.327 -3.700 -14.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.413 -4.440 -12.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -16.009 -3.595 -12.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -17.530 -2.857 -11.942 1.00 0.00 H new ATOM 1146 N LEU A 97 -19.338 1.476 -12.988 1.00 0.00 N ATOM 1147 CA LEU A 97 -20.681 1.472 -13.580 1.00 0.00 C ATOM 1148 C LEU A 97 -20.680 0.800 -14.954 1.00 0.00 C ATOM 1149 O LEU A 97 -19.681 0.195 -15.358 1.00 0.00 O ATOM 1150 CB LEU A 97 -21.233 2.901 -13.687 1.00 0.00 C ATOM 1151 CG LEU A 97 -21.478 3.608 -12.353 1.00 0.00 C ATOM 1152 CD1 LEU A 97 -21.837 5.067 -12.585 1.00 0.00 C ATOM 1153 CD2 LEU A 97 -22.583 2.911 -11.575 1.00 0.00 C ATOM 0 H LEU A 97 -19.268 0.953 -12.115 1.00 0.00 H new ATOM 0 HA LEU A 97 -21.330 0.896 -12.921 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -20.536 3.499 -14.274 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -22.171 2.870 -14.241 1.00 0.00 H new ATOM 0 HG LEU A 97 -20.560 3.563 -11.766 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -22.008 5.556 -11.626 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -21.019 5.565 -13.105 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -22.742 5.127 -13.190 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -22.743 3.428 -10.629 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -23.504 2.927 -12.158 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -22.295 1.878 -11.380 1.00 0.00 H new ATOM 1165 N GLU A 98 -21.818 0.890 -15.644 1.00 0.00 N ATOM 1166 CA GLU A 98 -21.978 0.351 -16.997 1.00 0.00 C ATOM 1167 C GLU A 98 -21.672 -1.148 -17.072 1.00 0.00 C ATOM 1168 O GLU A 98 -21.612 -1.850 -16.059 1.00 0.00 O ATOM 1169 CB GLU A 98 -21.079 1.102 -17.987 1.00 0.00 C ATOM 1170 CG GLU A 98 -21.355 2.593 -18.068 1.00 0.00 C ATOM 1171 CD GLU A 98 -20.640 3.246 -19.230 1.00 0.00 C ATOM 1172 OE1 GLU A 98 -21.208 3.260 -20.343 1.00 0.00 O ATOM 1173 OE2 GLU A 98 -19.512 3.748 -19.045 1.00 0.00 O ATOM 0 H GLU A 98 -22.658 1.340 -15.280 1.00 0.00 H new ATOM 0 HA GLU A 98 -23.025 0.493 -17.265 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -20.038 0.951 -17.702 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -21.205 0.666 -18.978 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -22.428 2.757 -18.166 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -21.043 3.069 -17.138 1.00 0.00 H new ATOM 1180 N HIS A 99 -21.520 -1.628 -18.299 1.00 0.00 N ATOM 1181 CA HIS A 99 -21.090 -2.991 -18.567 1.00 0.00 C ATOM 1182 C HIS A 99 -19.966 -2.958 -19.592 1.00 0.00 C ATOM 1183 O HIS A 99 -19.310 -1.926 -19.743 1.00 0.00 O ATOM 1184 CB HIS A 99 -22.259 -3.845 -19.075 1.00 0.00 C ATOM 1185 CG HIS A 99 -23.129 -4.386 -17.983 1.00 0.00 C ATOM 1186 ND1 HIS A 99 -24.375 -3.881 -17.688 1.00 0.00 N ATOM 1187 CD2 HIS A 99 -22.927 -5.409 -17.120 1.00 0.00 C ATOM 1188 CE1 HIS A 99 -24.901 -4.568 -16.691 1.00 0.00 C ATOM 1189 NE2 HIS A 99 -24.044 -5.503 -16.327 1.00 0.00 N ATOM 0 H HIS A 99 -21.693 -1.078 -19.140 1.00 0.00 H new ATOM 0 HA HIS A 99 -20.731 -3.444 -17.643 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -22.869 -3.245 -19.750 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -21.863 -4.677 -19.658 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -22.049 -6.036 -17.065 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -25.870 -4.394 -16.248 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -24.188 -6.183 -15.580 1.00 0.00 H new ATOM 1198 N HIS A 100 -19.725 -4.082 -20.273 1.00 0.00 N ATOM 1199 CA HIS A 100 -18.686 -4.166 -21.309 1.00 0.00 C ATOM 1200 C HIS A 100 -17.282 -4.080 -20.690 1.00 0.00 C ATOM 1201 O HIS A 100 -16.273 -4.079 -21.391 1.00 0.00 O ATOM 1202 CB HIS A 100 -18.906 -3.066 -22.373 1.00 0.00 C ATOM 1203 CG HIS A 100 -17.878 -3.022 -23.467 1.00 0.00 C ATOM 1204 ND1 HIS A 100 -17.047 -1.942 -23.667 1.00 0.00 N ATOM 1205 CD2 HIS A 100 -17.551 -3.927 -24.419 1.00 0.00 C ATOM 1206 CE1 HIS A 100 -16.251 -2.185 -24.692 1.00 0.00 C ATOM 1207 NE2 HIS A 100 -16.535 -3.382 -25.166 1.00 0.00 N ATOM 0 H HIS A 100 -20.237 -4.952 -20.126 1.00 0.00 H new ATOM 0 HA HIS A 100 -18.762 -5.135 -21.802 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -19.888 -3.210 -22.824 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -18.924 -2.097 -21.873 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -18.004 -4.896 -24.564 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -15.495 -1.516 -25.077 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -16.075 -3.830 -25.958 1.00 0.00 H new ATOM 1216 N HIS A 101 -17.219 -4.048 -19.366 1.00 0.00 N ATOM 1217 CA HIS A 101 -15.939 -3.963 -18.672 1.00 0.00 C ATOM 1218 C HIS A 101 -15.461 -5.342 -18.238 1.00 0.00 C ATOM 1219 O HIS A 101 -14.482 -5.475 -17.506 1.00 0.00 O ATOM 1220 CB HIS A 101 -16.027 -3.015 -17.474 1.00 0.00 C ATOM 1221 CG HIS A 101 -15.869 -1.569 -17.846 1.00 0.00 C ATOM 1222 ND1 HIS A 101 -14.698 -0.870 -17.651 1.00 0.00 N ATOM 1223 CD2 HIS A 101 -16.739 -0.692 -18.404 1.00 0.00 C ATOM 1224 CE1 HIS A 101 -14.853 0.372 -18.072 1.00 0.00 C ATOM 1225 NE2 HIS A 101 -16.080 0.503 -18.532 1.00 0.00 N ATOM 0 H HIS A 101 -18.033 -4.079 -18.753 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.207 -3.557 -19.370 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -16.989 -3.153 -16.981 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.257 -3.283 -16.751 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -17.759 -0.896 -18.693 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -14.102 1.148 -18.044 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -16.477 1.358 -18.922 1.00 0.00 H new ATOM 1234 N HIS A 102 -16.175 -6.365 -18.679 1.00 0.00 N ATOM 1235 CA HIS A 102 -15.727 -7.742 -18.525 1.00 0.00 C ATOM 1236 C HIS A 102 -15.799 -8.442 -19.872 1.00 0.00 C ATOM 1237 O HIS A 102 -14.773 -8.774 -20.465 1.00 0.00 O ATOM 1238 CB HIS A 102 -16.574 -8.497 -17.496 1.00 0.00 C ATOM 1239 CG HIS A 102 -16.280 -8.136 -16.073 1.00 0.00 C ATOM 1240 ND1 HIS A 102 -17.212 -7.575 -15.230 1.00 0.00 N ATOM 1241 CD2 HIS A 102 -15.154 -8.285 -15.337 1.00 0.00 C ATOM 1242 CE1 HIS A 102 -16.674 -7.395 -14.039 1.00 0.00 C ATOM 1243 NE2 HIS A 102 -15.424 -7.819 -14.074 1.00 0.00 N ATOM 0 H HIS A 102 -17.074 -6.267 -19.150 1.00 0.00 H new ATOM 0 HA HIS A 102 -14.699 -7.733 -18.162 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -17.628 -8.304 -17.698 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -16.416 -9.567 -17.627 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -14.216 -8.695 -15.680 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -17.172 -6.972 -13.179 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -14.768 -7.803 -13.293 1.00 0.00 H new ATOM 1252 N HIS A 103 -17.020 -8.639 -20.353 1.00 0.00 N ATOM 1253 CA HIS A 103 -17.259 -9.227 -21.665 1.00 0.00 C ATOM 1254 C HIS A 103 -18.740 -9.161 -21.999 1.00 0.00 C ATOM 1255 O HIS A 103 -19.587 -9.263 -21.110 1.00 0.00 O ATOM 1256 CB HIS A 103 -16.776 -10.686 -21.731 1.00 0.00 C ATOM 1257 CG HIS A 103 -17.420 -11.601 -20.731 1.00 0.00 C ATOM 1258 ND1 HIS A 103 -18.582 -12.304 -20.979 1.00 0.00 N ATOM 1259 CD2 HIS A 103 -17.047 -11.934 -19.475 1.00 0.00 C ATOM 1260 CE1 HIS A 103 -18.893 -13.024 -19.919 1.00 0.00 C ATOM 1261 NE2 HIS A 103 -17.978 -12.818 -18.994 1.00 0.00 N ATOM 0 H HIS A 103 -17.871 -8.396 -19.846 1.00 0.00 H new ATOM 0 HA HIS A 103 -16.690 -8.652 -22.396 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -16.965 -11.073 -22.732 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -15.697 -10.705 -21.580 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -16.177 -11.571 -18.948 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -19.752 -13.672 -19.825 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -17.964 -13.247 -18.069 1.00 0.00 H new ATOM 1270 N HIS A 104 -19.049 -8.984 -23.269 1.00 0.00 N ATOM 1271 CA HIS A 104 -20.431 -8.977 -23.715 1.00 0.00 C ATOM 1272 C HIS A 104 -20.828 -10.379 -24.154 1.00 0.00 C ATOM 1273 O HIS A 104 -20.541 -10.740 -25.311 1.00 0.00 O ATOM 1274 CB HIS A 104 -20.627 -7.982 -24.865 1.00 0.00 C ATOM 1275 CG HIS A 104 -22.052 -7.857 -25.318 1.00 0.00 C ATOM 1276 ND1 HIS A 104 -22.606 -8.657 -26.291 1.00 0.00 N ATOM 1277 CD2 HIS A 104 -23.037 -7.018 -24.921 1.00 0.00 C ATOM 1278 CE1 HIS A 104 -23.866 -8.317 -26.475 1.00 0.00 C ATOM 1279 NE2 HIS A 104 -24.154 -7.325 -25.658 1.00 0.00 N ATOM 1280 OXT HIS A 104 -21.395 -11.120 -23.332 1.00 0.00 O ATOM 0 H HIS A 104 -18.363 -8.843 -24.011 1.00 0.00 H new ATOM 0 HA HIS A 104 -21.068 -8.664 -22.888 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -20.268 -7.002 -24.551 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -20.012 -8.291 -25.710 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -22.959 -6.250 -24.165 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -24.547 -8.775 -27.177 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -25.059 -6.861 -25.585 1.00 0.00 H new TER 1289 HIS A 104 ATOM 1290 N ALA B 22 7.734 -2.132 -8.064 1.00 0.00 N ATOM 1291 CA ALA B 22 7.593 -1.283 -6.862 1.00 0.00 C ATOM 1292 C ALA B 22 6.135 -1.239 -6.422 1.00 0.00 C ATOM 1293 O ALA B 22 5.268 -0.737 -7.142 1.00 0.00 O ATOM 1294 CB ALA B 22 8.116 0.120 -7.131 1.00 0.00 C ATOM 0 HA ALA B 22 8.187 -1.716 -6.057 1.00 0.00 H new ATOM 0 HB1 ALA B 22 8.003 0.729 -6.234 1.00 0.00 H new ATOM 0 HB2 ALA B 22 9.170 0.069 -7.405 1.00 0.00 H new ATOM 0 HB3 ALA B 22 7.550 0.569 -7.948 1.00 0.00 H new ATOM 1302 N GLU B 23 5.873 -1.783 -5.244 1.00 0.00 N ATOM 1303 CA GLU B 23 4.515 -1.898 -4.735 1.00 0.00 C ATOM 1304 C GLU B 23 4.375 -1.116 -3.433 1.00 0.00 C ATOM 1305 O GLU B 23 5.368 -0.857 -2.749 1.00 0.00 O ATOM 1306 CB GLU B 23 4.146 -3.372 -4.505 1.00 0.00 C ATOM 1307 CG GLU B 23 4.226 -4.251 -5.753 1.00 0.00 C ATOM 1308 CD GLU B 23 5.648 -4.626 -6.141 1.00 0.00 C ATOM 1309 OE1 GLU B 23 6.261 -5.448 -5.433 1.00 0.00 O ATOM 1310 OE2 GLU B 23 6.155 -4.105 -7.159 1.00 0.00 O ATOM 0 H GLU B 23 6.588 -2.154 -4.619 1.00 0.00 H new ATOM 0 HA GLU B 23 3.833 -1.481 -5.476 1.00 0.00 H new ATOM 0 HB2 GLU B 23 4.808 -3.784 -3.744 1.00 0.00 H new ATOM 0 HB3 GLU B 23 3.133 -3.421 -4.107 1.00 0.00 H new ATOM 0 HG2 GLU B 23 3.652 -5.162 -5.583 1.00 0.00 H new ATOM 0 HG3 GLU B 23 3.756 -3.729 -6.586 1.00 0.00 H new ATOM 1317 N GLN B 24 3.151 -0.732 -3.096 1.00 0.00 N ATOM 1318 CA GLN B 24 2.903 0.019 -1.877 1.00 0.00 C ATOM 1319 C GLN B 24 2.399 -0.902 -0.769 1.00 0.00 C ATOM 1320 O GLN B 24 1.430 -1.640 -0.950 1.00 0.00 O ATOM 1321 CB GLN B 24 1.902 1.144 -2.146 1.00 0.00 C ATOM 1322 CG GLN B 24 1.633 2.026 -0.940 1.00 0.00 C ATOM 1323 CD GLN B 24 0.860 3.277 -1.298 1.00 0.00 C ATOM 1324 OE1 GLN B 24 0.993 3.817 -2.396 1.00 0.00 O ATOM 1325 NE2 GLN B 24 0.042 3.742 -0.370 1.00 0.00 N ATOM 0 H GLN B 24 2.317 -0.929 -3.650 1.00 0.00 H new ATOM 0 HA GLN B 24 3.841 0.463 -1.544 1.00 0.00 H new ATOM 0 HB2 GLN B 24 2.276 1.763 -2.961 1.00 0.00 H new ATOM 0 HB3 GLN B 24 0.961 0.708 -2.483 1.00 0.00 H new ATOM 0 HG2 GLN B 24 1.074 1.458 -0.196 1.00 0.00 H new ATOM 0 HG3 GLN B 24 2.581 2.307 -0.481 1.00 0.00 H new ATOM 0 HE21 GLN B 24 -0.037 3.262 0.527 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -0.510 4.580 -0.551 1.00 0.00 H new ATOM 1334 N VAL B 25 3.072 -0.860 0.374 1.00 0.00 N ATOM 1335 CA VAL B 25 2.736 -1.728 1.497 1.00 0.00 C ATOM 1336 C VAL B 25 2.312 -0.920 2.720 1.00 0.00 C ATOM 1337 O VAL B 25 2.529 0.295 2.787 1.00 0.00 O ATOM 1338 CB VAL B 25 3.920 -2.639 1.889 1.00 0.00 C ATOM 1339 CG1 VAL B 25 4.252 -3.602 0.763 1.00 0.00 C ATOM 1340 CG2 VAL B 25 5.143 -1.811 2.264 1.00 0.00 C ATOM 0 H VAL B 25 3.857 -0.232 0.549 1.00 0.00 H new ATOM 0 HA VAL B 25 1.903 -2.348 1.166 1.00 0.00 H new ATOM 0 HB VAL B 25 3.623 -3.220 2.762 1.00 0.00 H new ATOM 0 HG11 VAL B 25 5.089 -4.234 1.060 1.00 0.00 H new ATOM 0 HG12 VAL B 25 3.384 -4.225 0.550 1.00 0.00 H new ATOM 0 HG13 VAL B 25 4.522 -3.038 -0.130 1.00 0.00 H new ATOM 0 HG21 VAL B 25 5.963 -2.476 2.536 1.00 0.00 H new ATOM 0 HG22 VAL B 25 5.441 -1.196 1.414 1.00 0.00 H new ATOM 0 HG23 VAL B 25 4.901 -1.168 3.110 1.00 0.00 H new ATOM 1350 N SER B 26 1.713 -1.598 3.686 1.00 0.00 N ATOM 1351 CA SER B 26 1.292 -0.962 4.921 1.00 0.00 C ATOM 1352 C SER B 26 2.321 -1.218 6.023 1.00 0.00 C ATOM 1353 O SER B 26 3.249 -2.013 5.851 1.00 0.00 O ATOM 1354 CB SER B 26 -0.089 -1.472 5.344 1.00 0.00 C ATOM 1355 OG SER B 26 -0.622 -0.680 6.394 1.00 0.00 O ATOM 0 H SER B 26 1.507 -2.596 3.636 1.00 0.00 H new ATOM 0 HA SER B 26 1.222 0.113 4.754 1.00 0.00 H new ATOM 0 HB2 SER B 26 -0.765 -1.453 4.490 1.00 0.00 H new ATOM 0 HB3 SER B 26 -0.014 -2.510 5.668 1.00 0.00 H new ATOM 0 HG SER B 26 -0.586 -1.184 7.234 1.00 0.00 H new ATOM 1361 N LYS B 27 2.147 -0.554 7.161 1.00 0.00 N ATOM 1362 CA LYS B 27 3.130 -0.620 8.233 1.00 0.00 C ATOM 1363 C LYS B 27 3.132 -1.996 8.891 1.00 0.00 C ATOM 1364 O LYS B 27 4.158 -2.441 9.404 1.00 0.00 O ATOM 1365 CB LYS B 27 2.880 0.484 9.270 1.00 0.00 C ATOM 1366 CG LYS B 27 1.593 0.330 10.064 1.00 0.00 C ATOM 1367 CD LYS B 27 1.330 1.562 10.915 1.00 0.00 C ATOM 1368 CE LYS B 27 0.201 1.339 11.909 1.00 0.00 C ATOM 1369 NZ LYS B 27 0.585 0.376 12.976 1.00 0.00 N ATOM 0 H LYS B 27 1.338 0.033 7.363 1.00 0.00 H new ATOM 0 HA LYS B 27 4.116 -0.458 7.796 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.719 0.507 9.965 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.863 1.447 8.759 1.00 0.00 H new ATOM 0 HG2 LYS B 27 0.758 0.169 9.383 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.658 -0.551 10.703 1.00 0.00 H new ATOM 0 HD2 LYS B 27 2.239 1.831 11.453 1.00 0.00 H new ATOM 0 HD3 LYS B 27 1.082 2.403 10.268 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -0.078 2.291 12.362 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -0.678 0.967 11.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -0.094 0.439 13.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 0.580 -0.590 12.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 1.538 0.605 13.323 1.00 0.00 H new ATOM 1383 N GLN B 28 1.989 -2.677 8.845 1.00 0.00 N ATOM 1384 CA GLN B 28 1.877 -4.024 9.392 1.00 0.00 C ATOM 1385 C GLN B 28 2.770 -4.993 8.627 1.00 0.00 C ATOM 1386 O GLN B 28 3.283 -5.954 9.194 1.00 0.00 O ATOM 1387 CB GLN B 28 0.424 -4.522 9.360 1.00 0.00 C ATOM 1388 CG GLN B 28 -0.505 -3.782 10.313 1.00 0.00 C ATOM 1389 CD GLN B 28 -1.140 -2.547 9.699 1.00 0.00 C ATOM 1390 OE1 GLN B 28 -0.591 -1.931 8.787 1.00 0.00 O ATOM 1391 NE2 GLN B 28 -2.291 -2.158 10.223 1.00 0.00 N ATOM 0 H GLN B 28 1.128 -2.317 8.434 1.00 0.00 H new ATOM 0 HA GLN B 28 2.204 -3.982 10.431 1.00 0.00 H new ATOM 0 HB2 GLN B 28 0.039 -4.424 8.345 1.00 0.00 H new ATOM 0 HB3 GLN B 28 0.409 -5.584 9.606 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -1.292 -4.461 10.642 1.00 0.00 H new ATOM 0 HG3 GLN B 28 0.055 -3.490 11.201 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -2.715 -2.696 10.979 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -2.754 -1.320 9.871 1.00 0.00 H new ATOM 1400 N GLU B 29 2.967 -4.730 7.341 1.00 0.00 N ATOM 1401 CA GLU B 29 3.825 -5.570 6.519 1.00 0.00 C ATOM 1402 C GLU B 29 5.286 -5.259 6.805 1.00 0.00 C ATOM 1403 O GLU B 29 6.123 -6.158 6.892 1.00 0.00 O ATOM 1404 CB GLU B 29 3.517 -5.349 5.040 1.00 0.00 C ATOM 1405 CG GLU B 29 2.102 -5.738 4.657 1.00 0.00 C ATOM 1406 CD GLU B 29 1.738 -5.284 3.263 1.00 0.00 C ATOM 1407 OE1 GLU B 29 1.228 -4.151 3.129 1.00 0.00 O ATOM 1408 OE2 GLU B 29 1.964 -6.047 2.304 1.00 0.00 O ATOM 0 H GLU B 29 2.545 -3.944 6.847 1.00 0.00 H new ATOM 0 HA GLU B 29 3.634 -6.615 6.762 1.00 0.00 H new ATOM 0 HB2 GLU B 29 3.676 -4.299 4.796 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.220 -5.926 4.439 1.00 0.00 H new ATOM 0 HG2 GLU B 29 1.995 -6.821 4.723 1.00 0.00 H new ATOM 0 HG3 GLU B 29 1.403 -5.304 5.372 1.00 0.00 H new ATOM 1415 N ILE B 30 5.575 -3.977 6.975 1.00 0.00 N ATOM 1416 CA ILE B 30 6.925 -3.524 7.277 1.00 0.00 C ATOM 1417 C ILE B 30 7.422 -4.127 8.589 1.00 0.00 C ATOM 1418 O ILE B 30 8.553 -4.607 8.673 1.00 0.00 O ATOM 1419 CB ILE B 30 6.986 -1.985 7.363 1.00 0.00 C ATOM 1420 CG1 ILE B 30 6.485 -1.367 6.056 1.00 0.00 C ATOM 1421 CG2 ILE B 30 8.405 -1.521 7.668 1.00 0.00 C ATOM 1422 CD1 ILE B 30 6.357 0.139 6.103 1.00 0.00 C ATOM 0 H ILE B 30 4.887 -3.227 6.908 1.00 0.00 H new ATOM 0 HA ILE B 30 7.571 -3.859 6.465 1.00 0.00 H new ATOM 0 HB ILE B 30 6.340 -1.654 8.176 1.00 0.00 H new ATOM 0 HG12 ILE B 30 7.168 -1.639 5.251 1.00 0.00 H new ATOM 0 HG13 ILE B 30 5.514 -1.797 5.810 1.00 0.00 H new ATOM 0 HG21 ILE B 30 8.428 -0.433 7.725 1.00 0.00 H new ATOM 0 HG22 ILE B 30 8.728 -1.941 8.621 1.00 0.00 H new ATOM 0 HG23 ILE B 30 9.076 -1.857 6.877 1.00 0.00 H new ATOM 0 HD11 ILE B 30 5.997 0.504 5.141 1.00 0.00 H new ATOM 0 HD12 ILE B 30 5.651 0.420 6.885 1.00 0.00 H new ATOM 0 HD13 ILE B 30 7.330 0.580 6.317 1.00 0.00 H new ATOM 1434 N SER B 31 6.563 -4.119 9.601 1.00 0.00 N ATOM 1435 CA SER B 31 6.918 -4.651 10.910 1.00 0.00 C ATOM 1436 C SER B 31 6.877 -6.178 10.913 1.00 0.00 C ATOM 1437 O SER B 31 7.502 -6.826 11.753 1.00 0.00 O ATOM 1438 CB SER B 31 5.967 -4.096 11.970 1.00 0.00 C ATOM 1439 OG SER B 31 4.614 -4.337 11.617 1.00 0.00 O ATOM 0 H SER B 31 5.614 -3.749 9.540 1.00 0.00 H new ATOM 0 HA SER B 31 7.937 -4.341 11.142 1.00 0.00 H new ATOM 0 HB2 SER B 31 6.183 -4.557 12.934 1.00 0.00 H new ATOM 0 HB3 SER B 31 6.131 -3.025 12.085 1.00 0.00 H new ATOM 0 HG SER B 31 4.315 -3.654 10.981 1.00 0.00 H new ATOM 1445 N HIS B 32 6.141 -6.748 9.971 1.00 0.00 N ATOM 1446 CA HIS B 32 6.009 -8.194 9.878 1.00 0.00 C ATOM 1447 C HIS B 32 7.237 -8.802 9.213 1.00 0.00 C ATOM 1448 O HIS B 32 7.854 -9.722 9.748 1.00 0.00 O ATOM 1449 CB HIS B 32 4.747 -8.557 9.090 1.00 0.00 C ATOM 1450 CG HIS B 32 4.399 -10.013 9.123 1.00 0.00 C ATOM 1451 ND1 HIS B 32 3.398 -10.526 9.916 1.00 0.00 N ATOM 1452 CD2 HIS B 32 4.906 -11.062 8.437 1.00 0.00 C ATOM 1453 CE1 HIS B 32 3.305 -11.826 9.716 1.00 0.00 C ATOM 1454 NE2 HIS B 32 4.209 -12.178 8.822 1.00 0.00 N ATOM 0 H HIS B 32 5.625 -6.230 9.259 1.00 0.00 H new ATOM 0 HA HIS B 32 5.926 -8.600 10.886 1.00 0.00 H new ATOM 0 HB2 HIS B 32 3.908 -7.986 9.487 1.00 0.00 H new ATOM 0 HB3 HIS B 32 4.880 -8.250 8.052 1.00 0.00 H new ATOM 0 HD1 HIS B 32 2.819 -9.985 10.558 1.00 0.00 H new ATOM 0 HD2 HIS B 32 5.711 -11.027 7.718 1.00 0.00 H new ATOM 0 HE1 HIS B 32 2.606 -12.491 10.202 1.00 0.00 H new ATOM 1463 N PHE B 33 7.592 -8.275 8.048 1.00 0.00 N ATOM 1464 CA PHE B 33 8.701 -8.816 7.273 1.00 0.00 C ATOM 1465 C PHE B 33 10.018 -8.152 7.661 1.00 0.00 C ATOM 1466 O PHE B 33 11.082 -8.547 7.183 1.00 0.00 O ATOM 1467 CB PHE B 33 8.437 -8.640 5.775 1.00 0.00 C ATOM 1468 CG PHE B 33 7.156 -9.282 5.316 1.00 0.00 C ATOM 1469 CD1 PHE B 33 7.042 -10.661 5.251 1.00 0.00 C ATOM 1470 CD2 PHE B 33 6.065 -8.507 4.960 1.00 0.00 C ATOM 1471 CE1 PHE B 33 5.863 -11.252 4.839 1.00 0.00 C ATOM 1472 CE2 PHE B 33 4.884 -9.093 4.549 1.00 0.00 C ATOM 1473 CZ PHE B 33 4.784 -10.468 4.487 1.00 0.00 C ATOM 0 H PHE B 33 7.128 -7.474 7.619 1.00 0.00 H new ATOM 0 HA PHE B 33 8.782 -9.880 7.495 1.00 0.00 H new ATOM 0 HB2 PHE B 33 8.406 -7.576 5.541 1.00 0.00 H new ATOM 0 HB3 PHE B 33 9.269 -9.065 5.214 1.00 0.00 H new ATOM 0 HD1 PHE B 33 7.883 -11.280 5.525 1.00 0.00 H new ATOM 0 HD2 PHE B 33 6.139 -7.430 5.004 1.00 0.00 H new ATOM 0 HE1 PHE B 33 5.786 -12.328 4.793 1.00 0.00 H new ATOM 0 HE2 PHE B 33 4.040 -8.476 4.277 1.00 0.00 H new ATOM 0 HZ PHE B 33 3.863 -10.929 4.163 1.00 0.00 H new ATOM 1483 N LYS B 34 9.930 -7.140 8.527 1.00 0.00 N ATOM 1484 CA LYS B 34 11.108 -6.442 9.041 1.00 0.00 C ATOM 1485 C LYS B 34 11.932 -5.860 7.898 1.00 0.00 C ATOM 1486 O LYS B 34 13.136 -6.095 7.792 1.00 0.00 O ATOM 1487 CB LYS B 34 11.956 -7.388 9.897 1.00 0.00 C ATOM 1488 CG LYS B 34 11.235 -7.886 11.139 1.00 0.00 C ATOM 1489 CD LYS B 34 11.031 -6.769 12.150 1.00 0.00 C ATOM 1490 CE LYS B 34 10.161 -7.213 13.316 1.00 0.00 C ATOM 1491 NZ LYS B 34 10.612 -8.504 13.900 1.00 0.00 N ATOM 0 H LYS B 34 9.045 -6.784 8.889 1.00 0.00 H new ATOM 0 HA LYS B 34 10.774 -5.616 9.669 1.00 0.00 H new ATOM 0 HB2 LYS B 34 12.256 -8.244 9.292 1.00 0.00 H new ATOM 0 HB3 LYS B 34 12.869 -6.874 10.197 1.00 0.00 H new ATOM 0 HG2 LYS B 34 10.269 -8.304 10.857 1.00 0.00 H new ATOM 0 HG3 LYS B 34 11.810 -8.692 11.596 1.00 0.00 H new ATOM 0 HD2 LYS B 34 11.999 -6.437 12.525 1.00 0.00 H new ATOM 0 HD3 LYS B 34 10.569 -5.913 11.658 1.00 0.00 H new ATOM 0 HE2 LYS B 34 10.173 -6.444 14.088 1.00 0.00 H new ATOM 0 HE3 LYS B 34 9.129 -7.310 12.979 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 10.113 -8.672 14.797 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 10.402 -9.277 13.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 11.636 -8.467 14.075 1.00 0.00 H new ATOM 1505 N LEU B 35 11.267 -5.089 7.051 1.00 0.00 N ATOM 1506 CA LEU B 35 11.902 -4.501 5.880 1.00 0.00 C ATOM 1507 C LEU B 35 12.898 -3.419 6.286 1.00 0.00 C ATOM 1508 O LEU B 35 12.718 -2.741 7.300 1.00 0.00 O ATOM 1509 CB LEU B 35 10.840 -3.916 4.947 1.00 0.00 C ATOM 1510 CG LEU B 35 9.814 -4.922 4.417 1.00 0.00 C ATOM 1511 CD1 LEU B 35 8.755 -4.218 3.584 1.00 0.00 C ATOM 1512 CD2 LEU B 35 10.502 -6.006 3.598 1.00 0.00 C ATOM 0 H LEU B 35 10.280 -4.854 7.154 1.00 0.00 H new ATOM 0 HA LEU B 35 12.447 -5.286 5.355 1.00 0.00 H new ATOM 0 HB2 LEU B 35 10.309 -3.125 5.477 1.00 0.00 H new ATOM 0 HB3 LEU B 35 11.341 -3.451 4.098 1.00 0.00 H new ATOM 0 HG LEU B 35 9.324 -5.392 5.270 1.00 0.00 H new ATOM 0 HD11 LEU B 35 8.035 -4.950 3.217 1.00 0.00 H new ATOM 0 HD12 LEU B 35 8.240 -3.480 4.199 1.00 0.00 H new ATOM 0 HD13 LEU B 35 9.229 -3.719 2.739 1.00 0.00 H new ATOM 0 HD21 LEU B 35 9.757 -6.712 3.230 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.019 -5.551 2.753 1.00 0.00 H new ATOM 0 HD23 LEU B 35 11.223 -6.533 4.224 1.00 0.00 H new ATOM 1524 N VAL B 36 13.953 -3.271 5.501 1.00 0.00 N ATOM 1525 CA VAL B 36 14.977 -2.272 5.770 1.00 0.00 C ATOM 1526 C VAL B 36 14.711 -1.015 4.947 1.00 0.00 C ATOM 1527 O VAL B 36 14.434 -1.097 3.750 1.00 0.00 O ATOM 1528 CB VAL B 36 16.390 -2.809 5.448 1.00 0.00 C ATOM 1529 CG1 VAL B 36 17.456 -1.774 5.780 1.00 0.00 C ATOM 1530 CG2 VAL B 36 16.653 -4.106 6.199 1.00 0.00 C ATOM 0 H VAL B 36 14.124 -3.833 4.667 1.00 0.00 H new ATOM 0 HA VAL B 36 14.935 -2.033 6.833 1.00 0.00 H new ATOM 0 HB VAL B 36 16.438 -3.012 4.378 1.00 0.00 H new ATOM 0 HG11 VAL B 36 18.441 -2.177 5.544 1.00 0.00 H new ATOM 0 HG12 VAL B 36 17.283 -0.872 5.193 1.00 0.00 H new ATOM 0 HG13 VAL B 36 17.409 -1.530 6.841 1.00 0.00 H new ATOM 0 HG21 VAL B 36 17.653 -4.469 5.960 1.00 0.00 H new ATOM 0 HG22 VAL B 36 16.579 -3.927 7.272 1.00 0.00 H new ATOM 0 HG23 VAL B 36 15.916 -4.853 5.904 1.00 0.00 H new ATOM 1540 N LYS B 37 14.779 0.141 5.595 1.00 0.00 N ATOM 1541 CA LYS B 37 14.538 1.408 4.919 1.00 0.00 C ATOM 1542 C LYS B 37 15.770 1.829 4.128 1.00 0.00 C ATOM 1543 O LYS B 37 16.800 2.186 4.702 1.00 0.00 O ATOM 1544 CB LYS B 37 14.155 2.490 5.934 1.00 0.00 C ATOM 1545 CG LYS B 37 13.807 3.830 5.303 1.00 0.00 C ATOM 1546 CD LYS B 37 13.316 4.824 6.344 1.00 0.00 C ATOM 1547 CE LYS B 37 12.974 6.167 5.719 1.00 0.00 C ATOM 1548 NZ LYS B 37 12.384 7.104 6.711 1.00 0.00 N ATOM 0 H LYS B 37 14.999 0.227 6.587 1.00 0.00 H new ATOM 0 HA LYS B 37 13.709 1.279 4.223 1.00 0.00 H new ATOM 0 HB2 LYS B 37 13.303 2.142 6.518 1.00 0.00 H new ATOM 0 HB3 LYS B 37 14.982 2.631 6.630 1.00 0.00 H new ATOM 0 HG2 LYS B 37 14.684 4.234 4.797 1.00 0.00 H new ATOM 0 HG3 LYS B 37 13.038 3.687 4.543 1.00 0.00 H new ATOM 0 HD2 LYS B 37 12.436 4.421 6.846 1.00 0.00 H new ATOM 0 HD3 LYS B 37 14.083 4.962 7.106 1.00 0.00 H new ATOM 0 HE2 LYS B 37 13.874 6.609 5.292 1.00 0.00 H new ATOM 0 HE3 LYS B 37 12.273 6.018 4.898 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 12.149 8.002 6.243 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 11.520 6.686 7.112 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 13.070 7.280 7.473 1.00 0.00 H new ATOM 1562 N VAL B 38 15.659 1.770 2.809 1.00 0.00 N ATOM 1563 CA VAL B 38 16.759 2.133 1.924 1.00 0.00 C ATOM 1564 C VAL B 38 16.894 3.649 1.847 1.00 0.00 C ATOM 1565 O VAL B 38 17.999 4.190 1.771 1.00 0.00 O ATOM 1566 CB VAL B 38 16.548 1.567 0.502 1.00 0.00 C ATOM 1567 CG1 VAL B 38 17.744 1.866 -0.390 1.00 0.00 C ATOM 1568 CG2 VAL B 38 16.282 0.070 0.556 1.00 0.00 C ATOM 0 H VAL B 38 14.812 1.472 2.324 1.00 0.00 H new ATOM 0 HA VAL B 38 17.671 1.702 2.337 1.00 0.00 H new ATOM 0 HB VAL B 38 15.676 2.058 0.071 1.00 0.00 H new ATOM 0 HG11 VAL B 38 17.568 1.456 -1.384 1.00 0.00 H new ATOM 0 HG12 VAL B 38 17.884 2.945 -0.462 1.00 0.00 H new ATOM 0 HG13 VAL B 38 18.638 1.412 0.036 1.00 0.00 H new ATOM 0 HG21 VAL B 38 16.136 -0.310 -0.455 1.00 0.00 H new ATOM 0 HG22 VAL B 38 17.133 -0.434 1.014 1.00 0.00 H new ATOM 0 HG23 VAL B 38 15.386 -0.119 1.148 1.00 0.00 H new ATOM 1578 N GLY B 39 15.755 4.325 1.884 1.00 0.00 N ATOM 1579 CA GLY B 39 15.743 5.768 1.822 1.00 0.00 C ATOM 1580 C GLY B 39 14.334 6.314 1.804 1.00 0.00 C ATOM 1581 O GLY B 39 13.378 5.579 2.057 1.00 0.00 O ATOM 0 H GLY B 39 14.833 3.894 1.956 1.00 0.00 H new ATOM 0 HA2 GLY B 39 16.280 6.174 2.680 1.00 0.00 H new ATOM 0 HA3 GLY B 39 16.273 6.098 0.929 1.00 0.00 H new ATOM 1585 N THR B 40 14.202 7.591 1.496 1.00 0.00 N ATOM 1586 CA THR B 40 12.902 8.235 1.454 1.00 0.00 C ATOM 1587 C THR B 40 12.685 8.873 0.087 1.00 0.00 C ATOM 1588 O THR B 40 13.635 9.336 -0.543 1.00 0.00 O ATOM 1589 CB THR B 40 12.791 9.319 2.547 1.00 0.00 C ATOM 1590 OG1 THR B 40 13.247 8.800 3.802 1.00 0.00 O ATOM 1591 CG2 THR B 40 11.357 9.811 2.695 1.00 0.00 C ATOM 0 H THR B 40 14.984 8.206 1.270 1.00 0.00 H new ATOM 0 HA THR B 40 12.139 7.477 1.633 1.00 0.00 H new ATOM 0 HB THR B 40 13.416 10.160 2.247 1.00 0.00 H new ATOM 0 HG1 THR B 40 13.175 9.495 4.489 1.00 0.00 H new ATOM 0 HG21 THR B 40 11.312 10.574 3.472 1.00 0.00 H new ATOM 0 HG22 THR B 40 11.019 10.236 1.750 1.00 0.00 H new ATOM 0 HG23 THR B 40 10.712 8.976 2.969 1.00 0.00 H new ATOM 1599 N ILE B 41 11.451 8.871 -0.384 1.00 0.00 N ATOM 1600 CA ILE B 41 11.115 9.534 -1.632 1.00 0.00 C ATOM 1601 C ILE B 41 10.110 10.647 -1.378 1.00 0.00 C ATOM 1602 O ILE B 41 9.144 10.470 -0.631 1.00 0.00 O ATOM 1603 CB ILE B 41 10.575 8.549 -2.692 1.00 0.00 C ATOM 1604 CG1 ILE B 41 9.490 7.645 -2.094 1.00 0.00 C ATOM 1605 CG2 ILE B 41 11.715 7.721 -3.268 1.00 0.00 C ATOM 1606 CD1 ILE B 41 8.934 6.630 -3.071 1.00 0.00 C ATOM 0 H ILE B 41 10.664 8.417 0.079 1.00 0.00 H new ATOM 0 HA ILE B 41 12.034 9.962 -2.033 1.00 0.00 H new ATOM 0 HB ILE B 41 10.122 9.123 -3.500 1.00 0.00 H new ATOM 0 HG12 ILE B 41 9.902 7.119 -1.233 1.00 0.00 H new ATOM 0 HG13 ILE B 41 8.674 8.267 -1.727 1.00 0.00 H new ATOM 0 HG21 ILE B 41 11.322 7.030 -4.014 1.00 0.00 H new ATOM 0 HG22 ILE B 41 12.445 8.382 -3.734 1.00 0.00 H new ATOM 0 HG23 ILE B 41 12.195 7.157 -2.468 1.00 0.00 H new ATOM 0 HD11 ILE B 41 8.172 6.028 -2.576 1.00 0.00 H new ATOM 0 HD12 ILE B 41 8.491 7.148 -3.921 1.00 0.00 H new ATOM 0 HD13 ILE B 41 9.738 5.982 -3.420 1.00 0.00 H new ATOM 1618 N ASN B 42 10.357 11.798 -1.980 1.00 0.00 N ATOM 1619 CA ASN B 42 9.550 12.984 -1.731 1.00 0.00 C ATOM 1620 C ASN B 42 9.164 13.647 -3.044 1.00 0.00 C ATOM 1621 O ASN B 42 10.019 14.173 -3.762 1.00 0.00 O ATOM 1622 CB ASN B 42 10.334 13.971 -0.857 1.00 0.00 C ATOM 1623 CG ASN B 42 9.518 15.174 -0.404 1.00 0.00 C ATOM 1624 OD1 ASN B 42 8.564 15.592 -1.061 1.00 0.00 O ATOM 1625 ND2 ASN B 42 9.904 15.749 0.725 1.00 0.00 N ATOM 0 H ASN B 42 11.114 11.938 -2.649 1.00 0.00 H new ATOM 0 HA ASN B 42 8.640 12.687 -1.210 1.00 0.00 H new ATOM 0 HB2 ASN B 42 10.708 13.446 0.022 1.00 0.00 H new ATOM 0 HB3 ASN B 42 11.204 14.322 -1.412 1.00 0.00 H new ATOM 0 HD21 ASN B 42 9.406 16.567 1.077 1.00 0.00 H new ATOM 0 HD22 ASN B 42 10.699 15.374 1.242 1.00 0.00 H new ATOM 1632 N VAL B 43 7.883 13.608 -3.365 1.00 0.00 N ATOM 1633 CA VAL B 43 7.380 14.284 -4.544 1.00 0.00 C ATOM 1634 C VAL B 43 6.665 15.563 -4.141 1.00 0.00 C ATOM 1635 O VAL B 43 5.526 15.529 -3.673 1.00 0.00 O ATOM 1636 CB VAL B 43 6.409 13.397 -5.354 1.00 0.00 C ATOM 1637 CG1 VAL B 43 5.969 14.103 -6.624 1.00 0.00 C ATOM 1638 CG2 VAL B 43 7.039 12.056 -5.685 1.00 0.00 C ATOM 0 H VAL B 43 7.173 13.114 -2.824 1.00 0.00 H new ATOM 0 HA VAL B 43 8.238 14.511 -5.177 1.00 0.00 H new ATOM 0 HB VAL B 43 5.530 13.215 -4.736 1.00 0.00 H new ATOM 0 HG11 VAL B 43 5.286 13.461 -7.179 1.00 0.00 H new ATOM 0 HG12 VAL B 43 5.464 15.034 -6.366 1.00 0.00 H new ATOM 0 HG13 VAL B 43 6.842 14.322 -7.239 1.00 0.00 H new ATOM 0 HG21 VAL B 43 6.333 11.453 -6.255 1.00 0.00 H new ATOM 0 HG22 VAL B 43 7.941 12.214 -6.276 1.00 0.00 H new ATOM 0 HG23 VAL B 43 7.296 11.537 -4.762 1.00 0.00 H new ATOM 1648 N SER B 44 7.344 16.686 -4.294 1.00 0.00 N ATOM 1649 CA SER B 44 6.743 17.979 -4.030 1.00 0.00 C ATOM 1650 C SER B 44 6.390 18.658 -5.347 1.00 0.00 C ATOM 1651 O SER B 44 7.251 19.239 -6.012 1.00 0.00 O ATOM 1652 CB SER B 44 7.694 18.855 -3.213 1.00 0.00 C ATOM 1653 OG SER B 44 8.143 18.176 -2.052 1.00 0.00 O ATOM 0 H SER B 44 8.316 16.727 -4.601 1.00 0.00 H new ATOM 0 HA SER B 44 5.832 17.835 -3.449 1.00 0.00 H new ATOM 0 HB2 SER B 44 8.550 19.138 -3.826 1.00 0.00 H new ATOM 0 HB3 SER B 44 7.188 19.777 -2.926 1.00 0.00 H new ATOM 0 HG SER B 44 8.163 17.212 -2.224 1.00 0.00 H new ATOM 1659 N GLN B 45 5.134 18.546 -5.744 1.00 0.00 N ATOM 1660 CA GLN B 45 4.676 19.114 -7.003 1.00 0.00 C ATOM 1661 C GLN B 45 3.529 20.072 -6.756 1.00 0.00 C ATOM 1662 O GLN B 45 2.878 20.006 -5.718 1.00 0.00 O ATOM 1663 CB GLN B 45 4.216 18.013 -7.964 1.00 0.00 C ATOM 1664 CG GLN B 45 5.309 17.034 -8.359 1.00 0.00 C ATOM 1665 CD GLN B 45 6.485 17.706 -9.039 1.00 0.00 C ATOM 1666 OE1 GLN B 45 6.334 18.726 -9.711 1.00 0.00 O ATOM 1667 NE2 GLN B 45 7.668 17.138 -8.874 1.00 0.00 N ATOM 0 H GLN B 45 4.410 18.065 -5.211 1.00 0.00 H new ATOM 0 HA GLN B 45 5.511 19.650 -7.454 1.00 0.00 H new ATOM 0 HB2 GLN B 45 3.399 17.460 -7.501 1.00 0.00 H new ATOM 0 HB3 GLN B 45 3.816 18.477 -8.866 1.00 0.00 H new ATOM 0 HG2 GLN B 45 5.660 16.511 -7.469 1.00 0.00 H new ATOM 0 HG3 GLN B 45 4.891 16.281 -9.027 1.00 0.00 H new ATOM 0 HE21 GLN B 45 7.754 16.293 -8.310 1.00 0.00 H new ATOM 0 HE22 GLN B 45 8.495 17.545 -9.311 1.00 0.00 H new ATOM 1676 N SER B 46 3.282 20.956 -7.704 1.00 0.00 N ATOM 1677 CA SER B 46 2.142 21.848 -7.617 1.00 0.00 C ATOM 1678 C SER B 46 0.861 21.083 -7.943 1.00 0.00 C ATOM 1679 O SER B 46 0.915 19.971 -8.487 1.00 0.00 O ATOM 1680 CB SER B 46 2.326 23.025 -8.576 1.00 0.00 C ATOM 1681 OG SER B 46 3.567 23.675 -8.355 1.00 0.00 O ATOM 0 H SER B 46 3.853 21.075 -8.540 1.00 0.00 H new ATOM 0 HA SER B 46 2.066 22.238 -6.602 1.00 0.00 H new ATOM 0 HB2 SER B 46 2.276 22.670 -9.605 1.00 0.00 H new ATOM 0 HB3 SER B 46 1.511 23.736 -8.444 1.00 0.00 H new ATOM 0 HG SER B 46 3.692 23.824 -7.394 1.00 0.00 H new ATOM 1687 N GLY B 47 -0.282 21.667 -7.597 1.00 0.00 N ATOM 1688 CA GLY B 47 -1.564 21.040 -7.863 1.00 0.00 C ATOM 1689 C GLY B 47 -1.895 21.003 -9.343 1.00 0.00 C ATOM 1690 O GLY B 47 -2.735 21.766 -9.823 1.00 0.00 O ATOM 0 H GLY B 47 -0.343 22.573 -7.132 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -1.556 20.023 -7.470 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.347 21.581 -7.332 1.00 0.00 H new ATOM 1694 N GLY B 48 -1.217 20.121 -10.060 1.00 0.00 N ATOM 1695 CA GLY B 48 -1.418 19.988 -11.486 1.00 0.00 C ATOM 1696 C GLY B 48 -0.628 18.830 -12.058 1.00 0.00 C ATOM 1697 O GLY B 48 -1.084 18.157 -12.982 1.00 0.00 O ATOM 0 H GLY B 48 -0.520 19.486 -9.671 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -2.478 19.842 -11.692 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -1.121 20.912 -11.983 1.00 0.00 H new ATOM 1701 N GLN B 49 0.564 18.596 -11.510 1.00 0.00 N ATOM 1702 CA GLN B 49 1.391 17.470 -11.934 1.00 0.00 C ATOM 1703 C GLN B 49 0.773 16.154 -11.478 1.00 0.00 C ATOM 1704 O GLN B 49 0.723 15.185 -12.232 1.00 0.00 O ATOM 1705 CB GLN B 49 2.810 17.598 -11.376 1.00 0.00 C ATOM 1706 CG GLN B 49 3.565 18.828 -11.862 1.00 0.00 C ATOM 1707 CD GLN B 49 4.075 18.716 -13.294 1.00 0.00 C ATOM 1708 OE1 GLN B 49 5.105 19.298 -13.637 1.00 0.00 O ATOM 1709 NE2 GLN B 49 3.368 17.980 -14.140 1.00 0.00 N ATOM 0 H GLN B 49 0.976 19.170 -10.774 1.00 0.00 H new ATOM 0 HA GLN B 49 1.442 17.480 -13.023 1.00 0.00 H new ATOM 0 HB2 GLN B 49 2.759 17.624 -10.287 1.00 0.00 H new ATOM 0 HB3 GLN B 49 3.377 16.707 -11.648 1.00 0.00 H new ATOM 0 HG2 GLN B 49 2.911 19.697 -11.787 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.411 19.008 -11.199 1.00 0.00 H new ATOM 0 HE21 GLN B 49 2.519 17.511 -13.822 1.00 0.00 H new ATOM 0 HE22 GLN B 49 3.673 17.882 -15.109 1.00 0.00 H new ATOM 1718 N ILE B 50 0.319 16.126 -10.235 1.00 0.00 N ATOM 1719 CA ILE B 50 -0.380 14.966 -9.704 1.00 0.00 C ATOM 1720 C ILE B 50 -1.853 15.292 -9.536 1.00 0.00 C ATOM 1721 O ILE B 50 -2.207 16.272 -8.880 1.00 0.00 O ATOM 1722 CB ILE B 50 0.209 14.507 -8.351 1.00 0.00 C ATOM 1723 CG1 ILE B 50 1.659 14.050 -8.533 1.00 0.00 C ATOM 1724 CG2 ILE B 50 -0.635 13.391 -7.744 1.00 0.00 C ATOM 1725 CD1 ILE B 50 2.292 13.523 -7.265 1.00 0.00 C ATOM 0 H ILE B 50 0.422 16.895 -9.573 1.00 0.00 H new ATOM 0 HA ILE B 50 -0.256 14.148 -10.414 1.00 0.00 H new ATOM 0 HB ILE B 50 0.195 15.352 -7.663 1.00 0.00 H new ATOM 0 HG12 ILE B 50 1.693 13.273 -9.296 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.251 14.887 -8.904 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -0.202 13.084 -6.792 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -1.651 13.751 -7.581 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -0.656 12.540 -8.425 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.318 13.218 -7.470 1.00 0.00 H new ATOM 0 HD12 ILE B 50 2.291 14.305 -6.506 1.00 0.00 H new ATOM 0 HD13 ILE B 50 1.724 12.666 -6.904 1.00 0.00 H new ATOM 1737 N SER B 51 -2.704 14.485 -10.145 1.00 0.00 N ATOM 1738 CA SER B 51 -4.139 14.712 -10.094 1.00 0.00 C ATOM 1739 C SER B 51 -4.864 13.542 -9.432 1.00 0.00 C ATOM 1740 O SER B 51 -5.759 13.738 -8.608 1.00 0.00 O ATOM 1741 CB SER B 51 -4.671 14.955 -11.507 1.00 0.00 C ATOM 1742 OG SER B 51 -4.067 14.067 -12.434 1.00 0.00 O ATOM 0 H SER B 51 -2.426 13.664 -10.682 1.00 0.00 H new ATOM 0 HA SER B 51 -4.330 15.596 -9.485 1.00 0.00 H new ATOM 0 HB2 SER B 51 -5.753 14.821 -11.521 1.00 0.00 H new ATOM 0 HB3 SER B 51 -4.473 15.985 -11.802 1.00 0.00 H new ATOM 0 HG SER B 51 -3.818 13.237 -11.977 1.00 0.00 H new ATOM 1748 N SER B 52 -4.470 12.328 -9.781 1.00 0.00 N ATOM 1749 CA SER B 52 -5.096 11.139 -9.226 1.00 0.00 C ATOM 1750 C SER B 52 -4.081 10.329 -8.421 1.00 0.00 C ATOM 1751 O SER B 52 -2.874 10.560 -8.525 1.00 0.00 O ATOM 1752 CB SER B 52 -5.680 10.286 -10.358 1.00 0.00 C ATOM 1753 OG SER B 52 -4.667 9.841 -11.247 1.00 0.00 O ATOM 0 H SER B 52 -3.720 12.140 -10.446 1.00 0.00 H new ATOM 0 HA SER B 52 -5.901 11.442 -8.557 1.00 0.00 H new ATOM 0 HB2 SER B 52 -6.200 9.426 -9.936 1.00 0.00 H new ATOM 0 HB3 SER B 52 -6.420 10.867 -10.909 1.00 0.00 H new ATOM 0 HG SER B 52 -4.182 10.614 -11.603 1.00 0.00 H new ATOM 1759 N PRO B 53 -4.551 9.376 -7.594 1.00 0.00 N ATOM 1760 CA PRO B 53 -3.668 8.457 -6.869 1.00 0.00 C ATOM 1761 C PRO B 53 -2.811 7.617 -7.817 1.00 0.00 C ATOM 1762 O PRO B 53 -1.800 7.042 -7.411 1.00 0.00 O ATOM 1763 CB PRO B 53 -4.629 7.561 -6.074 1.00 0.00 C ATOM 1764 CG PRO B 53 -5.961 7.743 -6.719 1.00 0.00 C ATOM 1765 CD PRO B 53 -5.968 9.137 -7.273 1.00 0.00 C ATOM 0 HA PRO B 53 -2.960 8.993 -6.237 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -4.314 6.518 -6.109 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -4.658 7.850 -5.023 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -6.115 7.009 -7.510 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -6.766 7.607 -5.997 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -6.601 9.216 -8.157 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -6.344 9.858 -6.547 1.00 0.00 H new ATOM 1773 N SER B 54 -3.216 7.555 -9.083 1.00 0.00 N ATOM 1774 CA SER B 54 -2.441 6.864 -10.098 1.00 0.00 C ATOM 1775 C SER B 54 -1.127 7.607 -10.327 1.00 0.00 C ATOM 1776 O SER B 54 -0.056 7.005 -10.312 1.00 0.00 O ATOM 1777 CB SER B 54 -3.236 6.762 -11.405 1.00 0.00 C ATOM 1778 OG SER B 54 -2.655 5.822 -12.294 1.00 0.00 O ATOM 0 H SER B 54 -4.079 7.977 -9.426 1.00 0.00 H new ATOM 0 HA SER B 54 -2.225 5.852 -9.755 1.00 0.00 H new ATOM 0 HB2 SER B 54 -4.263 6.470 -11.186 1.00 0.00 H new ATOM 0 HB3 SER B 54 -3.278 7.740 -11.884 1.00 0.00 H new ATOM 0 HG SER B 54 -3.186 5.779 -13.117 1.00 0.00 H new ATOM 1784 N ASP B 55 -1.222 8.927 -10.498 1.00 0.00 N ATOM 1785 CA ASP B 55 -0.041 9.771 -10.673 1.00 0.00 C ATOM 1786 C ASP B 55 0.835 9.683 -9.433 1.00 0.00 C ATOM 1787 O ASP B 55 2.065 9.653 -9.517 1.00 0.00 O ATOM 1788 CB ASP B 55 -0.441 11.235 -10.899 1.00 0.00 C ATOM 1789 CG ASP B 55 -1.486 11.408 -11.981 1.00 0.00 C ATOM 1790 OD1 ASP B 55 -1.122 11.436 -13.175 1.00 0.00 O ATOM 1791 OD2 ASP B 55 -2.681 11.524 -11.639 1.00 0.00 O ATOM 0 H ASP B 55 -2.107 9.434 -10.519 1.00 0.00 H new ATOM 0 HA ASP B 55 0.505 9.417 -11.547 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -0.822 11.649 -9.965 1.00 0.00 H new ATOM 0 HB3 ASP B 55 0.446 11.810 -11.164 1.00 0.00 H new ATOM 1796 N LEU B 56 0.170 9.643 -8.282 1.00 0.00 N ATOM 1797 CA LEU B 56 0.836 9.489 -6.994 1.00 0.00 C ATOM 1798 C LEU B 56 1.697 8.229 -6.982 1.00 0.00 C ATOM 1799 O LEU B 56 2.905 8.293 -6.745 1.00 0.00 O ATOM 1800 CB LEU B 56 -0.217 9.426 -5.880 1.00 0.00 C ATOM 1801 CG LEU B 56 0.322 9.227 -4.464 1.00 0.00 C ATOM 1802 CD1 LEU B 56 1.174 10.412 -4.047 1.00 0.00 C ATOM 1803 CD2 LEU B 56 -0.826 9.024 -3.487 1.00 0.00 C ATOM 0 H LEU B 56 -0.845 9.716 -8.217 1.00 0.00 H new ATOM 0 HA LEU B 56 1.488 10.346 -6.826 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -0.796 10.349 -5.901 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.906 8.612 -6.104 1.00 0.00 H new ATOM 0 HG LEU B 56 0.949 8.335 -4.453 1.00 0.00 H new ATOM 0 HD11 LEU B 56 1.549 10.253 -3.036 1.00 0.00 H new ATOM 0 HD12 LEU B 56 2.014 10.516 -4.734 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.571 11.320 -4.071 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -0.428 8.883 -2.482 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.475 9.900 -3.501 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.399 8.143 -3.777 1.00 0.00 H new ATOM 1815 N ARG B 57 1.071 7.087 -7.253 1.00 0.00 N ATOM 1816 CA ARG B 57 1.784 5.816 -7.302 1.00 0.00 C ATOM 1817 C ARG B 57 2.864 5.832 -8.377 1.00 0.00 C ATOM 1818 O ARG B 57 3.981 5.382 -8.141 1.00 0.00 O ATOM 1819 CB ARG B 57 0.818 4.651 -7.552 1.00 0.00 C ATOM 1820 CG ARG B 57 1.500 3.423 -8.140 1.00 0.00 C ATOM 1821 CD ARG B 57 0.591 2.210 -8.162 1.00 0.00 C ATOM 1822 NE ARG B 57 1.119 1.150 -9.024 1.00 0.00 N ATOM 1823 CZ ARG B 57 2.172 0.381 -8.731 1.00 0.00 C ATOM 1824 NH1 ARG B 57 2.856 0.558 -7.604 1.00 0.00 N ATOM 1825 NH2 ARG B 57 2.538 -0.571 -9.579 1.00 0.00 N ATOM 0 H ARG B 57 0.071 7.017 -7.442 1.00 0.00 H new ATOM 0 HA ARG B 57 2.260 5.673 -6.332 1.00 0.00 H new ATOM 0 HB2 ARG B 57 0.338 4.377 -6.612 1.00 0.00 H new ATOM 0 HB3 ARG B 57 0.029 4.980 -8.229 1.00 0.00 H new ATOM 0 HG2 ARG B 57 1.829 3.645 -9.155 1.00 0.00 H new ATOM 0 HG3 ARG B 57 2.393 3.194 -7.558 1.00 0.00 H new ATOM 0 HD2 ARG B 57 0.470 1.828 -7.148 1.00 0.00 H new ATOM 0 HD3 ARG B 57 -0.399 2.504 -8.512 1.00 0.00 H new ATOM 0 HE ARG B 57 0.648 0.987 -9.914 1.00 0.00 H new ATOM 0 HH11 ARG B 57 2.579 1.289 -6.949 1.00 0.00 H new ATOM 0 HH12 ARG B 57 3.657 -0.037 -7.395 1.00 0.00 H new ATOM 0 HH21 ARG B 57 2.017 -0.710 -10.445 1.00 0.00 H new ATOM 0 HH22 ARG B 57 3.340 -1.164 -9.365 1.00 0.00 H new ATOM 1839 N GLU B 58 2.521 6.359 -9.546 1.00 0.00 N ATOM 1840 CA GLU B 58 3.426 6.381 -10.689 1.00 0.00 C ATOM 1841 C GLU B 58 4.764 7.014 -10.320 1.00 0.00 C ATOM 1842 O GLU B 58 5.825 6.432 -10.553 1.00 0.00 O ATOM 1843 CB GLU B 58 2.783 7.152 -11.840 1.00 0.00 C ATOM 1844 CG GLU B 58 3.536 7.035 -13.152 1.00 0.00 C ATOM 1845 CD GLU B 58 2.898 7.847 -14.257 1.00 0.00 C ATOM 1846 OE1 GLU B 58 1.676 7.717 -14.467 1.00 0.00 O ATOM 1847 OE2 GLU B 58 3.618 8.621 -14.920 1.00 0.00 O ATOM 0 H GLU B 58 1.611 6.782 -9.728 1.00 0.00 H new ATOM 0 HA GLU B 58 3.613 5.353 -10.998 1.00 0.00 H new ATOM 0 HB2 GLU B 58 1.765 6.791 -11.983 1.00 0.00 H new ATOM 0 HB3 GLU B 58 2.712 8.204 -11.565 1.00 0.00 H new ATOM 0 HG2 GLU B 58 4.564 7.367 -13.008 1.00 0.00 H new ATOM 0 HG3 GLU B 58 3.578 5.988 -13.452 1.00 0.00 H new ATOM 1854 N LYS B 59 4.704 8.200 -9.727 1.00 0.00 N ATOM 1855 CA LYS B 59 5.909 8.919 -9.338 1.00 0.00 C ATOM 1856 C LYS B 59 6.684 8.166 -8.264 1.00 0.00 C ATOM 1857 O LYS B 59 7.897 7.991 -8.375 1.00 0.00 O ATOM 1858 CB LYS B 59 5.557 10.327 -8.852 1.00 0.00 C ATOM 1859 CG LYS B 59 5.888 11.412 -9.864 1.00 0.00 C ATOM 1860 CD LYS B 59 5.281 11.113 -11.225 1.00 0.00 C ATOM 1861 CE LYS B 59 5.826 12.044 -12.294 1.00 0.00 C ATOM 1862 NZ LYS B 59 5.402 13.452 -12.080 1.00 0.00 N ATOM 0 H LYS B 59 3.834 8.683 -9.505 1.00 0.00 H new ATOM 0 HA LYS B 59 6.548 8.998 -10.217 1.00 0.00 H new ATOM 0 HB2 LYS B 59 4.493 10.368 -8.620 1.00 0.00 H new ATOM 0 HB3 LYS B 59 6.093 10.529 -7.925 1.00 0.00 H new ATOM 0 HG2 LYS B 59 5.518 12.372 -9.503 1.00 0.00 H new ATOM 0 HG3 LYS B 59 6.970 11.503 -9.960 1.00 0.00 H new ATOM 0 HD2 LYS B 59 5.492 10.079 -11.499 1.00 0.00 H new ATOM 0 HD3 LYS B 59 4.197 11.214 -11.171 1.00 0.00 H new ATOM 0 HE2 LYS B 59 6.915 11.991 -12.299 1.00 0.00 H new ATOM 0 HE3 LYS B 59 5.486 11.709 -13.274 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 5.797 14.052 -12.833 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 4.364 13.509 -12.101 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 5.748 13.782 -11.157 1.00 0.00 H new ATOM 1876 N LEU B 60 5.979 7.702 -7.242 1.00 0.00 N ATOM 1877 CA LEU B 60 6.616 7.000 -6.136 1.00 0.00 C ATOM 1878 C LEU B 60 7.233 5.683 -6.598 1.00 0.00 C ATOM 1879 O LEU B 60 8.332 5.326 -6.180 1.00 0.00 O ATOM 1880 CB LEU B 60 5.609 6.749 -5.013 1.00 0.00 C ATOM 1881 CG LEU B 60 5.003 8.010 -4.392 1.00 0.00 C ATOM 1882 CD1 LEU B 60 3.993 7.643 -3.321 1.00 0.00 C ATOM 1883 CD2 LEU B 60 6.091 8.903 -3.811 1.00 0.00 C ATOM 0 H LEU B 60 4.967 7.799 -7.155 1.00 0.00 H new ATOM 0 HA LEU B 60 7.418 7.633 -5.756 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.801 6.130 -5.402 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.100 6.175 -4.227 1.00 0.00 H new ATOM 0 HG LEU B 60 4.490 8.563 -5.179 1.00 0.00 H new ATOM 0 HD11 LEU B 60 3.573 8.552 -2.891 1.00 0.00 H new ATOM 0 HD12 LEU B 60 3.194 7.048 -3.763 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.486 7.065 -2.539 1.00 0.00 H new ATOM 0 HD21 LEU B 60 5.637 9.793 -3.375 1.00 0.00 H new ATOM 0 HD22 LEU B 60 6.635 8.358 -3.039 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.781 9.198 -4.602 1.00 0.00 H new ATOM 1895 N SER B 61 6.528 4.975 -7.472 1.00 0.00 N ATOM 1896 CA SER B 61 7.004 3.702 -7.994 1.00 0.00 C ATOM 1897 C SER B 61 8.295 3.899 -8.786 1.00 0.00 C ATOM 1898 O SER B 61 9.239 3.119 -8.659 1.00 0.00 O ATOM 1899 CB SER B 61 5.927 3.060 -8.881 1.00 0.00 C ATOM 1900 OG SER B 61 6.296 1.754 -9.293 1.00 0.00 O ATOM 0 H SER B 61 5.620 5.264 -7.835 1.00 0.00 H new ATOM 0 HA SER B 61 7.212 3.037 -7.156 1.00 0.00 H new ATOM 0 HB2 SER B 61 4.985 3.017 -8.335 1.00 0.00 H new ATOM 0 HB3 SER B 61 5.759 3.684 -9.758 1.00 0.00 H new ATOM 0 HG SER B 61 5.727 1.096 -8.842 1.00 0.00 H new ATOM 1906 N GLU B 62 8.333 4.954 -9.590 1.00 0.00 N ATOM 1907 CA GLU B 62 9.504 5.251 -10.403 1.00 0.00 C ATOM 1908 C GLU B 62 10.683 5.654 -9.522 1.00 0.00 C ATOM 1909 O GLU B 62 11.808 5.194 -9.722 1.00 0.00 O ATOM 1910 CB GLU B 62 9.182 6.360 -11.408 1.00 0.00 C ATOM 1911 CG GLU B 62 10.328 6.679 -12.355 1.00 0.00 C ATOM 1912 CD GLU B 62 9.937 7.677 -13.423 1.00 0.00 C ATOM 1913 OE1 GLU B 62 9.349 7.257 -14.444 1.00 0.00 O ATOM 1914 OE2 GLU B 62 10.219 8.883 -13.256 1.00 0.00 O ATOM 0 H GLU B 62 7.566 5.618 -9.696 1.00 0.00 H new ATOM 0 HA GLU B 62 9.781 4.351 -10.952 1.00 0.00 H new ATOM 0 HB2 GLU B 62 8.310 6.066 -11.993 1.00 0.00 H new ATOM 0 HB3 GLU B 62 8.910 7.264 -10.863 1.00 0.00 H new ATOM 0 HG2 GLU B 62 11.168 7.074 -11.784 1.00 0.00 H new ATOM 0 HG3 GLU B 62 10.670 5.759 -12.830 1.00 0.00 H new ATOM 1921 N LEU B 63 10.418 6.500 -8.534 1.00 0.00 N ATOM 1922 CA LEU B 63 11.465 6.976 -7.641 1.00 0.00 C ATOM 1923 C LEU B 63 11.990 5.849 -6.755 1.00 0.00 C ATOM 1924 O LEU B 63 13.188 5.775 -6.482 1.00 0.00 O ATOM 1925 CB LEU B 63 10.953 8.131 -6.779 1.00 0.00 C ATOM 1926 CG LEU B 63 10.506 9.374 -7.553 1.00 0.00 C ATOM 1927 CD1 LEU B 63 10.046 10.458 -6.596 1.00 0.00 C ATOM 1928 CD2 LEU B 63 11.628 9.891 -8.444 1.00 0.00 C ATOM 0 H LEU B 63 9.489 6.869 -8.332 1.00 0.00 H new ATOM 0 HA LEU B 63 12.289 7.336 -8.257 1.00 0.00 H new ATOM 0 HB2 LEU B 63 10.114 7.773 -6.182 1.00 0.00 H new ATOM 0 HB3 LEU B 63 11.740 8.420 -6.082 1.00 0.00 H new ATOM 0 HG LEU B 63 9.667 9.094 -8.190 1.00 0.00 H new ATOM 0 HD11 LEU B 63 9.732 11.334 -7.163 1.00 0.00 H new ATOM 0 HD12 LEU B 63 9.208 10.089 -6.004 1.00 0.00 H new ATOM 0 HD13 LEU B 63 10.867 10.730 -5.933 1.00 0.00 H new ATOM 0 HD21 LEU B 63 11.286 10.774 -8.984 1.00 0.00 H new ATOM 0 HD22 LEU B 63 12.490 10.152 -7.830 1.00 0.00 H new ATOM 0 HD23 LEU B 63 11.912 9.117 -9.157 1.00 0.00 H new ATOM 1940 N ALA B 64 11.098 4.970 -6.313 1.00 0.00 N ATOM 1941 CA ALA B 64 11.494 3.824 -5.501 1.00 0.00 C ATOM 1942 C ALA B 64 12.373 2.875 -6.306 1.00 0.00 C ATOM 1943 O ALA B 64 13.335 2.307 -5.784 1.00 0.00 O ATOM 1944 CB ALA B 64 10.271 3.092 -4.970 1.00 0.00 C ATOM 0 H ALA B 64 10.097 5.028 -6.502 1.00 0.00 H new ATOM 0 HA ALA B 64 12.070 4.192 -4.652 1.00 0.00 H new ATOM 0 HB1 ALA B 64 10.589 2.241 -4.367 1.00 0.00 H new ATOM 0 HB2 ALA B 64 9.679 3.771 -4.356 1.00 0.00 H new ATOM 0 HB3 ALA B 64 9.667 2.739 -5.806 1.00 0.00 H new ATOM 1950 N ASP B 65 12.043 2.723 -7.584 1.00 0.00 N ATOM 1951 CA ASP B 65 12.811 1.867 -8.483 1.00 0.00 C ATOM 1952 C ASP B 65 14.188 2.471 -8.737 1.00 0.00 C ATOM 1953 O ASP B 65 15.181 1.756 -8.885 1.00 0.00 O ATOM 1954 CB ASP B 65 12.062 1.680 -9.805 1.00 0.00 C ATOM 1955 CG ASP B 65 12.686 0.617 -10.690 1.00 0.00 C ATOM 1956 OD1 ASP B 65 12.474 -0.583 -10.417 1.00 0.00 O ATOM 1957 OD2 ASP B 65 13.368 0.976 -11.676 1.00 0.00 O ATOM 0 H ASP B 65 11.245 3.183 -8.023 1.00 0.00 H new ATOM 0 HA ASP B 65 12.938 0.892 -8.013 1.00 0.00 H new ATOM 0 HB2 ASP B 65 11.027 1.410 -9.596 1.00 0.00 H new ATOM 0 HB3 ASP B 65 12.042 2.628 -10.343 1.00 0.00 H new ATOM 1962 N ALA B 66 14.244 3.797 -8.769 1.00 0.00 N ATOM 1963 CA ALA B 66 15.502 4.511 -8.944 1.00 0.00 C ATOM 1964 C ALA B 66 16.375 4.392 -7.697 1.00 0.00 C ATOM 1965 O ALA B 66 17.605 4.381 -7.783 1.00 0.00 O ATOM 1966 CB ALA B 66 15.242 5.974 -9.272 1.00 0.00 C ATOM 0 H ALA B 66 13.428 4.402 -8.675 1.00 0.00 H new ATOM 0 HA ALA B 66 16.037 4.056 -9.778 1.00 0.00 H new ATOM 0 HB1 ALA B 66 16.192 6.493 -9.399 1.00 0.00 H new ATOM 0 HB2 ALA B 66 14.664 6.043 -10.194 1.00 0.00 H new ATOM 0 HB3 ALA B 66 14.683 6.436 -8.458 1.00 0.00 H new ATOM 1972 N LYS B 67 15.734 4.311 -6.535 1.00 0.00 N ATOM 1973 CA LYS B 67 16.451 4.126 -5.275 1.00 0.00 C ATOM 1974 C LYS B 67 16.907 2.679 -5.125 1.00 0.00 C ATOM 1975 O LYS B 67 17.874 2.390 -4.420 1.00 0.00 O ATOM 1976 CB LYS B 67 15.573 4.521 -4.082 1.00 0.00 C ATOM 1977 CG LYS B 67 15.290 6.013 -3.986 1.00 0.00 C ATOM 1978 CD LYS B 67 16.571 6.814 -3.791 1.00 0.00 C ATOM 1979 CE LYS B 67 16.296 8.308 -3.663 1.00 0.00 C ATOM 1980 NZ LYS B 67 15.533 8.638 -2.430 1.00 0.00 N ATOM 0 H LYS B 67 14.720 4.370 -6.438 1.00 0.00 H new ATOM 0 HA LYS B 67 17.327 4.774 -5.292 1.00 0.00 H new ATOM 0 HB2 LYS B 67 14.626 3.986 -4.149 1.00 0.00 H new ATOM 0 HB3 LYS B 67 16.059 4.194 -3.163 1.00 0.00 H new ATOM 0 HG2 LYS B 67 14.785 6.347 -4.892 1.00 0.00 H new ATOM 0 HG3 LYS B 67 14.611 6.203 -3.155 1.00 0.00 H new ATOM 0 HD2 LYS B 67 17.086 6.462 -2.897 1.00 0.00 H new ATOM 0 HD3 LYS B 67 17.240 6.639 -4.634 1.00 0.00 H new ATOM 0 HE2 LYS B 67 17.242 8.850 -3.658 1.00 0.00 H new ATOM 0 HE3 LYS B 67 15.738 8.648 -4.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 15.971 9.456 -1.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 14.550 8.868 -2.681 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 15.544 7.821 -1.786 1.00 0.00 H new ATOM 1994 N GLY B 68 16.208 1.775 -5.794 1.00 0.00 N ATOM 1995 CA GLY B 68 16.553 0.371 -5.722 1.00 0.00 C ATOM 1996 C GLY B 68 15.799 -0.348 -4.624 1.00 0.00 C ATOM 1997 O GLY B 68 16.341 -1.242 -3.969 1.00 0.00 O ATOM 0 H GLY B 68 15.406 1.989 -6.387 1.00 0.00 H new ATOM 0 HA2 GLY B 68 16.338 -0.104 -6.679 1.00 0.00 H new ATOM 0 HA3 GLY B 68 17.625 0.270 -5.550 1.00 0.00 H new ATOM 2001 N GLY B 69 14.555 0.053 -4.409 1.00 0.00 N ATOM 2002 CA GLY B 69 13.724 -0.601 -3.420 1.00 0.00 C ATOM 2003 C GLY B 69 12.583 -1.360 -4.062 1.00 0.00 C ATOM 2004 O GLY B 69 12.284 -1.154 -5.237 1.00 0.00 O ATOM 0 H GLY B 69 14.105 0.823 -4.904 1.00 0.00 H new ATOM 0 HA2 GLY B 69 14.332 -1.287 -2.830 1.00 0.00 H new ATOM 0 HA3 GLY B 69 13.324 0.143 -2.731 1.00 0.00 H new ATOM 2008 N LYS B 70 11.946 -2.235 -3.300 1.00 0.00 N ATOM 2009 CA LYS B 70 10.837 -3.028 -3.821 1.00 0.00 C ATOM 2010 C LYS B 70 9.507 -2.428 -3.403 1.00 0.00 C ATOM 2011 O LYS B 70 8.628 -2.190 -4.230 1.00 0.00 O ATOM 2012 CB LYS B 70 10.901 -4.466 -3.311 1.00 0.00 C ATOM 2013 CG LYS B 70 12.064 -5.278 -3.843 1.00 0.00 C ATOM 2014 CD LYS B 70 12.021 -6.686 -3.281 1.00 0.00 C ATOM 2015 CE LYS B 70 13.151 -7.547 -3.809 1.00 0.00 C ATOM 2016 NZ LYS B 70 13.171 -8.876 -3.147 1.00 0.00 N ATOM 0 H LYS B 70 12.174 -2.416 -2.322 1.00 0.00 H new ATOM 0 HA LYS B 70 10.921 -3.025 -4.908 1.00 0.00 H new ATOM 0 HB2 LYS B 70 10.956 -4.448 -2.223 1.00 0.00 H new ATOM 0 HB3 LYS B 70 9.972 -4.972 -3.575 1.00 0.00 H new ATOM 0 HG2 LYS B 70 12.025 -5.312 -4.932 1.00 0.00 H new ATOM 0 HG3 LYS B 70 13.005 -4.799 -3.572 1.00 0.00 H new ATOM 0 HD2 LYS B 70 12.077 -6.643 -2.193 1.00 0.00 H new ATOM 0 HD3 LYS B 70 11.066 -7.147 -3.533 1.00 0.00 H new ATOM 0 HE2 LYS B 70 13.040 -7.676 -4.886 1.00 0.00 H new ATOM 0 HE3 LYS B 70 14.103 -7.042 -3.645 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 13.877 -9.484 -3.610 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 13.418 -8.760 -2.144 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 12.232 -9.316 -3.223 1.00 0.00 H new ATOM 2030 N TYR B 71 9.369 -2.188 -2.113 1.00 0.00 N ATOM 2031 CA TYR B 71 8.108 -1.744 -1.557 1.00 0.00 C ATOM 2032 C TYR B 71 8.263 -0.364 -0.950 1.00 0.00 C ATOM 2033 O TYR B 71 9.279 -0.065 -0.326 1.00 0.00 O ATOM 2034 CB TYR B 71 7.619 -2.730 -0.493 1.00 0.00 C ATOM 2035 CG TYR B 71 7.582 -4.167 -0.967 1.00 0.00 C ATOM 2036 CD1 TYR B 71 6.611 -4.601 -1.862 1.00 0.00 C ATOM 2037 CD2 TYR B 71 8.516 -5.091 -0.515 1.00 0.00 C ATOM 2038 CE1 TYR B 71 6.576 -5.912 -2.296 1.00 0.00 C ATOM 2039 CE2 TYR B 71 8.488 -6.403 -0.945 1.00 0.00 C ATOM 2040 CZ TYR B 71 7.515 -6.809 -1.834 1.00 0.00 C ATOM 2041 OH TYR B 71 7.483 -8.118 -2.263 1.00 0.00 O ATOM 0 H TYR B 71 10.119 -2.294 -1.429 1.00 0.00 H new ATOM 0 HA TYR B 71 7.371 -1.699 -2.359 1.00 0.00 H new ATOM 0 HB2 TYR B 71 8.269 -2.661 0.380 1.00 0.00 H new ATOM 0 HB3 TYR B 71 6.620 -2.437 -0.171 1.00 0.00 H new ATOM 0 HD1 TYR B 71 5.872 -3.902 -2.224 1.00 0.00 H new ATOM 0 HD2 TYR B 71 9.277 -4.778 0.185 1.00 0.00 H new ATOM 0 HE1 TYR B 71 5.817 -6.233 -2.994 1.00 0.00 H new ATOM 0 HE2 TYR B 71 9.224 -7.107 -0.587 1.00 0.00 H new ATOM 0 HH TYR B 71 8.214 -8.618 -1.843 1.00 0.00 H new ATOM 2051 N TYR B 72 7.267 0.476 -1.146 1.00 0.00 N ATOM 2052 CA TYR B 72 7.280 1.804 -0.568 1.00 0.00 C ATOM 2053 C TYR B 72 6.030 2.020 0.270 1.00 0.00 C ATOM 2054 O TYR B 72 4.976 1.443 -0.002 1.00 0.00 O ATOM 2055 CB TYR B 72 7.406 2.882 -1.656 1.00 0.00 C ATOM 2056 CG TYR B 72 6.346 2.822 -2.737 1.00 0.00 C ATOM 2057 CD1 TYR B 72 5.142 3.501 -2.594 1.00 0.00 C ATOM 2058 CD2 TYR B 72 6.554 2.094 -3.901 1.00 0.00 C ATOM 2059 CE1 TYR B 72 4.177 3.453 -3.581 1.00 0.00 C ATOM 2060 CE2 TYR B 72 5.593 2.043 -4.893 1.00 0.00 C ATOM 2061 CZ TYR B 72 4.406 2.723 -4.727 1.00 0.00 C ATOM 2062 OH TYR B 72 3.444 2.674 -5.709 1.00 0.00 O ATOM 0 H TYR B 72 6.438 0.262 -1.701 1.00 0.00 H new ATOM 0 HA TYR B 72 8.153 1.889 0.079 1.00 0.00 H new ATOM 0 HB2 TYR B 72 7.366 3.863 -1.182 1.00 0.00 H new ATOM 0 HB3 TYR B 72 8.387 2.793 -2.123 1.00 0.00 H new ATOM 0 HD1 TYR B 72 4.958 4.075 -1.698 1.00 0.00 H new ATOM 0 HD2 TYR B 72 7.483 1.559 -4.033 1.00 0.00 H new ATOM 0 HE1 TYR B 72 3.246 3.986 -3.455 1.00 0.00 H new ATOM 0 HE2 TYR B 72 5.771 1.473 -5.793 1.00 0.00 H new ATOM 0 HH TYR B 72 2.669 3.206 -5.434 1.00 0.00 H new ATOM 2072 N HIS B 73 6.160 2.825 1.306 1.00 0.00 N ATOM 2073 CA HIS B 73 5.041 3.123 2.180 1.00 0.00 C ATOM 2074 C HIS B 73 4.875 4.625 2.332 1.00 0.00 C ATOM 2075 O HIS B 73 5.747 5.298 2.880 1.00 0.00 O ATOM 2076 CB HIS B 73 5.241 2.470 3.553 1.00 0.00 C ATOM 2077 CG HIS B 73 4.186 2.832 4.558 1.00 0.00 C ATOM 2078 ND1 HIS B 73 2.921 2.286 4.556 1.00 0.00 N ATOM 2079 CD2 HIS B 73 4.212 3.710 5.589 1.00 0.00 C ATOM 2080 CE1 HIS B 73 2.216 2.810 5.545 1.00 0.00 C ATOM 2081 NE2 HIS B 73 2.978 3.674 6.183 1.00 0.00 N ATOM 0 H HIS B 73 7.032 3.286 1.564 1.00 0.00 H new ATOM 0 HA HIS B 73 4.136 2.714 1.731 1.00 0.00 H new ATOM 0 HB2 HIS B 73 5.256 1.387 3.431 1.00 0.00 H new ATOM 0 HB3 HIS B 73 6.216 2.760 3.944 1.00 0.00 H new ATOM 0 HD1 HIS B 73 2.581 1.587 3.895 1.00 0.00 H new ATOM 0 HD2 HIS B 73 5.049 4.324 5.887 1.00 0.00 H new ATOM 0 HE1 HIS B 73 1.191 2.570 5.788 1.00 0.00 H new ATOM 2090 N ILE B 74 3.763 5.143 1.835 1.00 0.00 N ATOM 2091 CA ILE B 74 3.447 6.553 1.986 1.00 0.00 C ATOM 2092 C ILE B 74 3.205 6.875 3.452 1.00 0.00 C ATOM 2093 O ILE B 74 2.346 6.270 4.094 1.00 0.00 O ATOM 2094 CB ILE B 74 2.197 6.952 1.174 1.00 0.00 C ATOM 2095 CG1 ILE B 74 2.373 6.587 -0.300 1.00 0.00 C ATOM 2096 CG2 ILE B 74 1.924 8.442 1.324 1.00 0.00 C ATOM 2097 CD1 ILE B 74 1.171 6.929 -1.154 1.00 0.00 C ATOM 0 H ILE B 74 3.063 4.606 1.323 1.00 0.00 H new ATOM 0 HA ILE B 74 4.298 7.119 1.608 1.00 0.00 H new ATOM 0 HB ILE B 74 1.342 6.400 1.563 1.00 0.00 H new ATOM 0 HG12 ILE B 74 3.247 7.106 -0.693 1.00 0.00 H new ATOM 0 HG13 ILE B 74 2.574 5.519 -0.380 1.00 0.00 H new ATOM 0 HG21 ILE B 74 1.040 8.710 0.746 1.00 0.00 H new ATOM 0 HG22 ILE B 74 1.756 8.677 2.375 1.00 0.00 H new ATOM 0 HG23 ILE B 74 2.781 9.008 0.959 1.00 0.00 H new ATOM 0 HD11 ILE B 74 1.366 6.643 -2.188 1.00 0.00 H new ATOM 0 HD12 ILE B 74 0.298 6.389 -0.786 1.00 0.00 H new ATOM 0 HD13 ILE B 74 0.982 8.001 -1.104 1.00 0.00 H new ATOM 2109 N ILE B 75 3.978 7.805 3.983 1.00 0.00 N ATOM 2110 CA ILE B 75 3.813 8.227 5.362 1.00 0.00 C ATOM 2111 C ILE B 75 3.110 9.571 5.424 1.00 0.00 C ATOM 2112 O ILE B 75 2.514 9.927 6.440 1.00 0.00 O ATOM 2113 CB ILE B 75 5.160 8.314 6.105 1.00 0.00 C ATOM 2114 CG1 ILE B 75 6.133 9.243 5.369 1.00 0.00 C ATOM 2115 CG2 ILE B 75 5.752 6.925 6.259 1.00 0.00 C ATOM 2116 CD1 ILE B 75 7.456 9.432 6.081 1.00 0.00 C ATOM 0 H ILE B 75 4.726 8.282 3.480 1.00 0.00 H new ATOM 0 HA ILE B 75 3.204 7.471 5.858 1.00 0.00 H new ATOM 0 HB ILE B 75 4.987 8.735 7.095 1.00 0.00 H new ATOM 0 HG12 ILE B 75 6.321 8.841 4.373 1.00 0.00 H new ATOM 0 HG13 ILE B 75 5.661 10.216 5.236 1.00 0.00 H new ATOM 0 HG21 ILE B 75 6.704 6.992 6.785 1.00 0.00 H new ATOM 0 HG22 ILE B 75 5.066 6.298 6.829 1.00 0.00 H new ATOM 0 HG23 ILE B 75 5.911 6.486 5.274 1.00 0.00 H new ATOM 0 HD11 ILE B 75 8.090 10.101 5.499 1.00 0.00 H new ATOM 0 HD12 ILE B 75 7.280 9.864 7.066 1.00 0.00 H new ATOM 0 HD13 ILE B 75 7.951 8.467 6.191 1.00 0.00 H new ATOM 2128 N ALA B 76 3.168 10.310 4.327 1.00 0.00 N ATOM 2129 CA ALA B 76 2.523 11.606 4.249 1.00 0.00 C ATOM 2130 C ALA B 76 1.964 11.852 2.855 1.00 0.00 C ATOM 2131 O ALA B 76 2.706 12.157 1.921 1.00 0.00 O ATOM 2132 CB ALA B 76 3.495 12.712 4.635 1.00 0.00 C ATOM 0 H ALA B 76 3.658 10.031 3.477 1.00 0.00 H new ATOM 0 HA ALA B 76 1.692 11.613 4.955 1.00 0.00 H new ATOM 0 HB1 ALA B 76 2.992 13.677 4.570 1.00 0.00 H new ATOM 0 HB2 ALA B 76 3.842 12.551 5.656 1.00 0.00 H new ATOM 0 HB3 ALA B 76 4.347 12.701 3.956 1.00 0.00 H new ATOM 2138 N ALA B 77 0.660 11.675 2.717 1.00 0.00 N ATOM 2139 CA ALA B 77 -0.039 12.023 1.491 1.00 0.00 C ATOM 2140 C ALA B 77 -0.909 13.239 1.753 1.00 0.00 C ATOM 2141 O ALA B 77 -2.085 13.118 2.106 1.00 0.00 O ATOM 2142 CB ALA B 77 -0.877 10.856 0.986 1.00 0.00 C ATOM 0 H ALA B 77 0.060 11.289 3.446 1.00 0.00 H new ATOM 0 HA ALA B 77 0.690 12.255 0.715 1.00 0.00 H new ATOM 0 HB1 ALA B 77 -1.388 11.146 0.068 1.00 0.00 H new ATOM 0 HB2 ALA B 77 -0.229 10.002 0.787 1.00 0.00 H new ATOM 0 HB3 ALA B 77 -1.614 10.584 1.741 1.00 0.00 H new ATOM 2148 N ARG B 78 -0.319 14.410 1.609 1.00 0.00 N ATOM 2149 CA ARG B 78 -0.963 15.635 2.041 1.00 0.00 C ATOM 2150 C ARG B 78 -0.892 16.713 0.975 1.00 0.00 C ATOM 2151 O ARG B 78 -0.062 16.663 0.069 1.00 0.00 O ATOM 2152 CB ARG B 78 -0.310 16.133 3.331 1.00 0.00 C ATOM 2153 CG ARG B 78 1.209 16.176 3.263 1.00 0.00 C ATOM 2154 CD ARG B 78 1.810 16.751 4.533 1.00 0.00 C ATOM 2155 NE ARG B 78 1.567 18.187 4.651 1.00 0.00 N ATOM 2156 CZ ARG B 78 0.849 18.741 5.626 1.00 0.00 C ATOM 2157 NH1 ARG B 78 0.320 17.981 6.577 1.00 0.00 N ATOM 2158 NH2 ARG B 78 0.666 20.055 5.661 1.00 0.00 N ATOM 0 H ARG B 78 0.605 14.539 1.196 1.00 0.00 H new ATOM 0 HA ARG B 78 -2.016 15.416 2.221 1.00 0.00 H new ATOM 0 HB2 ARG B 78 -0.684 17.132 3.557 1.00 0.00 H new ATOM 0 HB3 ARG B 78 -0.611 15.486 4.155 1.00 0.00 H new ATOM 0 HG2 ARG B 78 1.595 15.170 3.101 1.00 0.00 H new ATOM 0 HG3 ARG B 78 1.519 16.778 2.409 1.00 0.00 H new ATOM 0 HD2 ARG B 78 1.388 16.239 5.398 1.00 0.00 H new ATOM 0 HD3 ARG B 78 2.884 16.563 4.544 1.00 0.00 H new ATOM 0 HE ARG B 78 1.971 18.802 3.945 1.00 0.00 H new ATOM 0 HH11 ARG B 78 0.463 16.971 6.562 1.00 0.00 H new ATOM 0 HH12 ARG B 78 -0.230 18.407 7.323 1.00 0.00 H new ATOM 0 HH21 ARG B 78 1.076 20.646 4.938 1.00 0.00 H new ATOM 0 HH22 ARG B 78 0.115 20.473 6.410 1.00 0.00 H new ATOM 2172 N GLU B 79 -1.774 17.684 1.100 1.00 0.00 N ATOM 2173 CA GLU B 79 -1.805 18.823 0.206 1.00 0.00 C ATOM 2174 C GLU B 79 -1.426 20.071 0.986 1.00 0.00 C ATOM 2175 O GLU B 79 -2.002 20.354 2.036 1.00 0.00 O ATOM 2176 CB GLU B 79 -3.198 18.970 -0.410 1.00 0.00 C ATOM 2177 CG GLU B 79 -3.364 20.206 -1.273 1.00 0.00 C ATOM 2178 CD GLU B 79 -4.765 20.334 -1.827 1.00 0.00 C ATOM 2179 OE1 GLU B 79 -5.709 20.538 -1.035 1.00 0.00 O ATOM 2180 OE2 GLU B 79 -4.932 20.238 -3.059 1.00 0.00 O ATOM 0 H GLU B 79 -2.490 17.705 1.826 1.00 0.00 H new ATOM 0 HA GLU B 79 -1.092 18.677 -0.606 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -3.412 18.087 -1.013 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -3.937 18.997 0.391 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -3.126 21.092 -0.685 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -2.652 20.170 -2.097 1.00 0.00 H new ATOM 2187 N HIS B 80 -0.455 20.805 0.481 1.00 0.00 N ATOM 2188 CA HIS B 80 0.066 21.963 1.182 1.00 0.00 C ATOM 2189 C HIS B 80 -0.233 23.226 0.391 1.00 0.00 C ATOM 2190 O HIS B 80 0.644 23.772 -0.281 1.00 0.00 O ATOM 2191 CB HIS B 80 1.574 21.815 1.391 1.00 0.00 C ATOM 2192 CG HIS B 80 2.108 22.583 2.561 1.00 0.00 C ATOM 2193 ND1 HIS B 80 2.957 22.027 3.488 1.00 0.00 N ATOM 2194 CD2 HIS B 80 1.915 23.864 2.951 1.00 0.00 C ATOM 2195 CE1 HIS B 80 3.261 22.929 4.399 1.00 0.00 C ATOM 2196 NE2 HIS B 80 2.642 24.055 4.098 1.00 0.00 N ATOM 0 H HIS B 80 -0.008 20.619 -0.417 1.00 0.00 H new ATOM 0 HA HIS B 80 -0.417 22.035 2.156 1.00 0.00 H new ATOM 0 HB2 HIS B 80 1.809 20.759 1.525 1.00 0.00 H new ATOM 0 HB3 HIS B 80 2.089 22.144 0.488 1.00 0.00 H new ATOM 0 HD1 HIS B 80 3.298 21.066 3.473 1.00 0.00 H new ATOM 0 HD2 HIS B 80 1.302 24.600 2.452 1.00 0.00 H new ATOM 0 HE1 HIS B 80 3.908 22.773 5.249 1.00 0.00 H new ATOM 2205 N GLY B 81 -1.484 23.661 0.441 1.00 0.00 N ATOM 2206 CA GLY B 81 -1.874 24.855 -0.276 1.00 0.00 C ATOM 2207 C GLY B 81 -1.980 24.606 -1.765 1.00 0.00 C ATOM 2208 O GLY B 81 -2.778 23.779 -2.206 1.00 0.00 O ATOM 0 H GLY B 81 -2.234 23.209 0.964 1.00 0.00 H new ATOM 0 HA2 GLY B 81 -2.833 25.210 0.103 1.00 0.00 H new ATOM 0 HA3 GLY B 81 -1.146 25.645 -0.090 1.00 0.00 H new ATOM 2212 N PRO B 82 -1.166 25.302 -2.571 1.00 0.00 N ATOM 2213 CA PRO B 82 -1.142 25.122 -4.020 1.00 0.00 C ATOM 2214 C PRO B 82 -0.257 23.954 -4.444 1.00 0.00 C ATOM 2215 O PRO B 82 -0.137 23.648 -5.631 1.00 0.00 O ATOM 2216 CB PRO B 82 -0.554 26.441 -4.512 1.00 0.00 C ATOM 2217 CG PRO B 82 0.371 26.867 -3.421 1.00 0.00 C ATOM 2218 CD PRO B 82 -0.212 26.342 -2.133 1.00 0.00 C ATOM 0 HA PRO B 82 -2.127 24.891 -4.427 1.00 0.00 H new ATOM 0 HB2 PRO B 82 -0.023 26.312 -5.455 1.00 0.00 H new ATOM 0 HB3 PRO B 82 -1.333 27.183 -4.684 1.00 0.00 H new ATOM 0 HG2 PRO B 82 1.372 26.468 -3.584 1.00 0.00 H new ATOM 0 HG3 PRO B 82 0.461 27.953 -3.391 1.00 0.00 H new ATOM 0 HD2 PRO B 82 0.560 25.928 -1.485 1.00 0.00 H new ATOM 0 HD3 PRO B 82 -0.712 27.131 -1.570 1.00 0.00 H new ATOM 2226 N ASN B 83 0.355 23.301 -3.466 1.00 0.00 N ATOM 2227 CA ASN B 83 1.291 22.218 -3.732 1.00 0.00 C ATOM 2228 C ASN B 83 0.824 20.926 -3.078 1.00 0.00 C ATOM 2229 O ASN B 83 0.032 20.946 -2.138 1.00 0.00 O ATOM 2230 CB ASN B 83 2.687 22.584 -3.219 1.00 0.00 C ATOM 2231 CG ASN B 83 3.349 23.673 -4.043 1.00 0.00 C ATOM 2232 OD1 ASN B 83 3.173 23.745 -5.257 1.00 0.00 O ATOM 2233 ND2 ASN B 83 4.098 24.544 -3.385 1.00 0.00 N ATOM 0 H ASN B 83 0.219 23.504 -2.476 1.00 0.00 H new ATOM 0 HA ASN B 83 1.335 22.066 -4.810 1.00 0.00 H new ATOM 0 HB2 ASN B 83 2.614 22.913 -2.182 1.00 0.00 H new ATOM 0 HB3 ASN B 83 3.317 21.695 -3.227 1.00 0.00 H new ATOM 0 HD21 ASN B 83 4.552 25.307 -3.886 1.00 0.00 H new ATOM 0 HD22 ASN B 83 4.221 24.452 -2.377 1.00 0.00 H new ATOM 2240 N PHE B 84 1.318 19.811 -3.583 1.00 0.00 N ATOM 2241 CA PHE B 84 0.996 18.503 -3.038 1.00 0.00 C ATOM 2242 C PHE B 84 2.274 17.818 -2.572 1.00 0.00 C ATOM 2243 O PHE B 84 3.288 17.840 -3.275 1.00 0.00 O ATOM 2244 CB PHE B 84 0.284 17.653 -4.097 1.00 0.00 C ATOM 2245 CG PHE B 84 -0.167 16.306 -3.598 1.00 0.00 C ATOM 2246 CD1 PHE B 84 -1.370 16.170 -2.923 1.00 0.00 C ATOM 2247 CD2 PHE B 84 0.613 15.178 -3.806 1.00 0.00 C ATOM 2248 CE1 PHE B 84 -1.787 14.935 -2.464 1.00 0.00 C ATOM 2249 CE2 PHE B 84 0.201 13.941 -3.348 1.00 0.00 C ATOM 2250 CZ PHE B 84 -1.000 13.819 -2.676 1.00 0.00 C ATOM 0 H PHE B 84 1.953 19.785 -4.381 1.00 0.00 H new ATOM 0 HA PHE B 84 0.327 18.620 -2.185 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.583 18.201 -4.466 1.00 0.00 H new ATOM 0 HB3 PHE B 84 0.955 17.509 -4.944 1.00 0.00 H new ATOM 0 HD1 PHE B 84 -1.988 17.039 -2.754 1.00 0.00 H new ATOM 0 HD2 PHE B 84 1.552 15.267 -4.331 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -2.727 14.842 -1.940 1.00 0.00 H new ATOM 0 HE2 PHE B 84 0.817 13.070 -3.515 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.323 12.853 -2.317 1.00 0.00 H new ATOM 2260 N GLU B 85 2.226 17.216 -1.393 1.00 0.00 N ATOM 2261 CA GLU B 85 3.399 16.582 -0.814 1.00 0.00 C ATOM 2262 C GLU B 85 3.200 15.078 -0.718 1.00 0.00 C ATOM 2263 O GLU B 85 2.351 14.600 0.038 1.00 0.00 O ATOM 2264 CB GLU B 85 3.683 17.145 0.583 1.00 0.00 C ATOM 2265 CG GLU B 85 3.766 18.660 0.637 1.00 0.00 C ATOM 2266 CD GLU B 85 4.081 19.173 2.027 1.00 0.00 C ATOM 2267 OE1 GLU B 85 3.135 19.416 2.811 1.00 0.00 O ATOM 2268 OE2 GLU B 85 5.271 19.344 2.348 1.00 0.00 O ATOM 0 H GLU B 85 1.386 17.154 -0.818 1.00 0.00 H new ATOM 0 HA GLU B 85 4.248 16.792 -1.464 1.00 0.00 H new ATOM 0 HB2 GLU B 85 2.900 16.810 1.264 1.00 0.00 H new ATOM 0 HB3 GLU B 85 4.622 16.727 0.947 1.00 0.00 H new ATOM 0 HG2 GLU B 85 4.533 19.004 -0.057 1.00 0.00 H new ATOM 0 HG3 GLU B 85 2.820 19.085 0.302 1.00 0.00 H new ATOM 2275 N ALA B 86 3.972 14.338 -1.496 1.00 0.00 N ATOM 2276 CA ALA B 86 3.951 12.890 -1.425 1.00 0.00 C ATOM 2277 C ALA B 86 5.247 12.377 -0.818 1.00 0.00 C ATOM 2278 O ALA B 86 6.288 12.354 -1.477 1.00 0.00 O ATOM 2279 CB ALA B 86 3.734 12.290 -2.801 1.00 0.00 C ATOM 0 H ALA B 86 4.621 14.718 -2.184 1.00 0.00 H new ATOM 0 HA ALA B 86 3.121 12.586 -0.787 1.00 0.00 H new ATOM 0 HB1 ALA B 86 3.721 11.203 -2.726 1.00 0.00 H new ATOM 0 HB2 ALA B 86 2.782 12.637 -3.203 1.00 0.00 H new ATOM 0 HB3 ALA B 86 4.542 12.599 -3.464 1.00 0.00 H new ATOM 2285 N VAL B 87 5.184 11.988 0.444 1.00 0.00 N ATOM 2286 CA VAL B 87 6.354 11.488 1.146 1.00 0.00 C ATOM 2287 C VAL B 87 6.175 10.013 1.486 1.00 0.00 C ATOM 2288 O VAL B 87 5.242 9.635 2.201 1.00 0.00 O ATOM 2289 CB VAL B 87 6.626 12.284 2.441 1.00 0.00 C ATOM 2290 CG1 VAL B 87 7.918 11.826 3.099 1.00 0.00 C ATOM 2291 CG2 VAL B 87 6.674 13.779 2.153 1.00 0.00 C ATOM 0 H VAL B 87 4.332 12.009 1.005 1.00 0.00 H new ATOM 0 HA VAL B 87 7.210 11.612 0.483 1.00 0.00 H new ATOM 0 HB VAL B 87 5.806 12.092 3.133 1.00 0.00 H new ATOM 0 HG11 VAL B 87 8.087 12.402 4.009 1.00 0.00 H new ATOM 0 HG12 VAL B 87 7.844 10.767 3.348 1.00 0.00 H new ATOM 0 HG13 VAL B 87 8.750 11.980 2.412 1.00 0.00 H new ATOM 0 HG21 VAL B 87 6.867 14.322 3.078 1.00 0.00 H new ATOM 0 HG22 VAL B 87 7.470 13.986 1.438 1.00 0.00 H new ATOM 0 HG23 VAL B 87 5.719 14.100 1.736 1.00 0.00 H new ATOM 2301 N ALA B 88 7.063 9.185 0.961 1.00 0.00 N ATOM 2302 CA ALA B 88 6.997 7.751 1.184 1.00 0.00 C ATOM 2303 C ALA B 88 8.366 7.197 1.550 1.00 0.00 C ATOM 2304 O ALA B 88 9.395 7.763 1.178 1.00 0.00 O ATOM 2305 CB ALA B 88 6.453 7.051 -0.054 1.00 0.00 C ATOM 0 H ALA B 88 7.842 9.484 0.374 1.00 0.00 H new ATOM 0 HA ALA B 88 6.321 7.563 2.018 1.00 0.00 H new ATOM 0 HB1 ALA B 88 6.408 5.977 0.125 1.00 0.00 H new ATOM 0 HB2 ALA B 88 5.453 7.424 -0.273 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.108 7.250 -0.902 1.00 0.00 H new ATOM 2311 N GLU B 89 8.373 6.094 2.279 1.00 0.00 N ATOM 2312 CA GLU B 89 9.614 5.449 2.673 1.00 0.00 C ATOM 2313 C GLU B 89 9.865 4.235 1.784 1.00 0.00 C ATOM 2314 O GLU B 89 8.947 3.462 1.508 1.00 0.00 O ATOM 2315 CB GLU B 89 9.547 5.017 4.139 1.00 0.00 C ATOM 2316 CG GLU B 89 9.163 6.135 5.096 1.00 0.00 C ATOM 2317 CD GLU B 89 9.110 5.678 6.541 1.00 0.00 C ATOM 2318 OE1 GLU B 89 8.150 4.974 6.920 1.00 0.00 O ATOM 2319 OE2 GLU B 89 10.034 6.021 7.309 1.00 0.00 O ATOM 0 H GLU B 89 7.530 5.625 2.611 1.00 0.00 H new ATOM 0 HA GLU B 89 10.434 6.158 2.556 1.00 0.00 H new ATOM 0 HB2 GLU B 89 8.825 4.206 4.236 1.00 0.00 H new ATOM 0 HB3 GLU B 89 10.517 4.617 4.434 1.00 0.00 H new ATOM 0 HG2 GLU B 89 9.881 6.949 5.003 1.00 0.00 H new ATOM 0 HG3 GLU B 89 8.190 6.534 4.810 1.00 0.00 H new ATOM 2326 N VAL B 90 11.102 4.082 1.332 1.00 0.00 N ATOM 2327 CA VAL B 90 11.467 2.982 0.445 1.00 0.00 C ATOM 2328 C VAL B 90 12.069 1.831 1.244 1.00 0.00 C ATOM 2329 O VAL B 90 13.035 2.020 1.984 1.00 0.00 O ATOM 2330 CB VAL B 90 12.479 3.437 -0.629 1.00 0.00 C ATOM 2331 CG1 VAL B 90 12.789 2.305 -1.596 1.00 0.00 C ATOM 2332 CG2 VAL B 90 11.957 4.653 -1.377 1.00 0.00 C ATOM 0 H VAL B 90 11.873 4.707 1.565 1.00 0.00 H new ATOM 0 HA VAL B 90 10.556 2.648 -0.052 1.00 0.00 H new ATOM 0 HB VAL B 90 13.405 3.715 -0.125 1.00 0.00 H new ATOM 0 HG11 VAL B 90 13.504 2.650 -2.343 1.00 0.00 H new ATOM 0 HG12 VAL B 90 13.214 1.464 -1.048 1.00 0.00 H new ATOM 0 HG13 VAL B 90 11.871 1.988 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL B 90 12.685 4.958 -2.129 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.014 4.403 -1.864 1.00 0.00 H new ATOM 0 HG23 VAL B 90 11.797 5.471 -0.675 1.00 0.00 H new ATOM 2342 N TYR B 91 11.501 0.644 1.093 1.00 0.00 N ATOM 2343 CA TYR B 91 11.944 -0.512 1.854 1.00 0.00 C ATOM 2344 C TYR B 91 12.425 -1.645 0.954 1.00 0.00 C ATOM 2345 O TYR B 91 11.957 -1.816 -0.178 1.00 0.00 O ATOM 2346 CB TYR B 91 10.821 -1.014 2.763 1.00 0.00 C ATOM 2347 CG TYR B 91 10.520 -0.090 3.920 1.00 0.00 C ATOM 2348 CD1 TYR B 91 11.204 -0.213 5.123 1.00 0.00 C ATOM 2349 CD2 TYR B 91 9.560 0.907 3.810 1.00 0.00 C ATOM 2350 CE1 TYR B 91 10.939 0.631 6.183 1.00 0.00 C ATOM 2351 CE2 TYR B 91 9.293 1.756 4.865 1.00 0.00 C ATOM 2352 CZ TYR B 91 9.985 1.614 6.049 1.00 0.00 C ATOM 2353 OH TYR B 91 9.722 2.459 7.101 1.00 0.00 O ATOM 0 H TYR B 91 10.732 0.457 0.450 1.00 0.00 H new ATOM 0 HA TYR B 91 12.790 -0.190 2.461 1.00 0.00 H new ATOM 0 HB2 TYR B 91 9.916 -1.146 2.170 1.00 0.00 H new ATOM 0 HB3 TYR B 91 11.092 -1.995 3.153 1.00 0.00 H new ATOM 0 HD1 TYR B 91 11.955 -0.981 5.231 1.00 0.00 H new ATOM 0 HD2 TYR B 91 9.014 1.020 2.885 1.00 0.00 H new ATOM 0 HE1 TYR B 91 11.478 0.520 7.113 1.00 0.00 H new ATOM 0 HE2 TYR B 91 8.545 2.528 4.763 1.00 0.00 H new ATOM 0 HH TYR B 91 9.035 3.106 6.837 1.00 0.00 H new ATOM 2363 N ASN B 92 13.373 -2.404 1.475 1.00 0.00 N ATOM 2364 CA ASN B 92 13.881 -3.599 0.816 1.00 0.00 C ATOM 2365 C ASN B 92 13.894 -4.739 1.828 1.00 0.00 C ATOM 2366 O ASN B 92 13.791 -4.487 3.030 1.00 0.00 O ATOM 2367 CB ASN B 92 15.297 -3.344 0.275 1.00 0.00 C ATOM 2368 CG ASN B 92 15.843 -4.493 -0.557 1.00 0.00 C ATOM 2369 OD1 ASN B 92 16.458 -5.422 -0.035 1.00 0.00 O ATOM 2370 ND2 ASN B 92 15.638 -4.429 -1.865 1.00 0.00 N ATOM 0 H ASN B 92 13.816 -2.209 2.373 1.00 0.00 H new ATOM 0 HA ASN B 92 13.241 -3.862 -0.026 1.00 0.00 H new ATOM 0 HB2 ASN B 92 15.288 -2.438 -0.332 1.00 0.00 H new ATOM 0 HB3 ASN B 92 15.970 -3.160 1.113 1.00 0.00 H new ATOM 0 HD21 ASN B 92 15.995 -5.166 -2.474 1.00 0.00 H new ATOM 0 HD22 ASN B 92 15.123 -3.643 -2.263 1.00 0.00 H new ATOM 2377 N ASP B 93 13.992 -5.976 1.349 1.00 0.00 N ATOM 2378 CA ASP B 93 14.085 -7.142 2.228 1.00 0.00 C ATOM 2379 C ASP B 93 15.207 -6.941 3.233 1.00 0.00 C ATOM 2380 O ASP B 93 15.026 -7.113 4.440 1.00 0.00 O ATOM 2381 CB ASP B 93 14.373 -8.407 1.414 1.00 0.00 C ATOM 2382 CG ASP B 93 13.443 -8.574 0.233 1.00 0.00 C ATOM 2383 OD1 ASP B 93 13.606 -7.835 -0.760 1.00 0.00 O ATOM 2384 OD2 ASP B 93 12.564 -9.457 0.278 1.00 0.00 O ATOM 0 H ASP B 93 14.009 -6.199 0.354 1.00 0.00 H new ATOM 0 HA ASP B 93 13.133 -7.256 2.747 1.00 0.00 H new ATOM 0 HB2 ASP B 93 15.403 -8.376 1.057 1.00 0.00 H new ATOM 0 HB3 ASP B 93 14.287 -9.278 2.064 1.00 0.00 H new ATOM 2389 N ALA B 94 16.362 -6.555 2.706 1.00 0.00 N ATOM 2390 CA ALA B 94 17.538 -6.275 3.510 1.00 0.00 C ATOM 2391 C ALA B 94 18.548 -5.504 2.675 1.00 0.00 C ATOM 2392 O ALA B 94 18.716 -4.296 2.838 1.00 0.00 O ATOM 2393 CB ALA B 94 18.152 -7.564 4.041 1.00 0.00 C ATOM 0 H ALA B 94 16.507 -6.428 1.704 1.00 0.00 H new ATOM 0 HA ALA B 94 17.245 -5.670 4.368 1.00 0.00 H new ATOM 0 HB1 ALA B 94 19.031 -7.328 4.640 1.00 0.00 H new ATOM 0 HB2 ALA B 94 17.422 -8.087 4.658 1.00 0.00 H new ATOM 0 HB3 ALA B 94 18.443 -8.200 3.205 1.00 0.00 H new ATOM 2399 N THR B 95 19.204 -6.213 1.766 1.00 0.00 N ATOM 2400 CA THR B 95 20.159 -5.616 0.845 1.00 0.00 C ATOM 2401 C THR B 95 20.372 -6.547 -0.345 1.00 0.00 C ATOM 2402 O THR B 95 20.717 -7.718 -0.172 1.00 0.00 O ATOM 2403 CB THR B 95 21.522 -5.337 1.526 1.00 0.00 C ATOM 2404 OG1 THR B 95 21.350 -4.447 2.638 1.00 0.00 O ATOM 2405 CG2 THR B 95 22.510 -4.726 0.542 1.00 0.00 C ATOM 0 H THR B 95 19.088 -7.219 1.647 1.00 0.00 H new ATOM 0 HA THR B 95 19.747 -4.663 0.513 1.00 0.00 H new ATOM 0 HB THR B 95 21.919 -6.289 1.878 1.00 0.00 H new ATOM 0 HG1 THR B 95 20.466 -4.027 2.587 1.00 0.00 H new ATOM 0 HG21 THR B 95 23.458 -4.540 1.046 1.00 0.00 H new ATOM 0 HG22 THR B 95 22.669 -5.414 -0.288 1.00 0.00 H new ATOM 0 HG23 THR B 95 22.111 -3.785 0.162 1.00 0.00 H new ATOM 2413 N LYS B 96 20.141 -6.038 -1.547 1.00 0.00 N ATOM 2414 CA LYS B 96 20.342 -6.826 -2.752 1.00 0.00 C ATOM 2415 C LYS B 96 21.777 -6.683 -3.243 1.00 0.00 C ATOM 2416 O LYS B 96 22.202 -5.604 -3.661 1.00 0.00 O ATOM 2417 CB LYS B 96 19.349 -6.411 -3.842 1.00 0.00 C ATOM 2418 CG LYS B 96 19.536 -7.161 -5.153 1.00 0.00 C ATOM 2419 CD LYS B 96 18.334 -7.006 -6.072 1.00 0.00 C ATOM 2420 CE LYS B 96 17.099 -7.693 -5.501 1.00 0.00 C ATOM 2421 NZ LYS B 96 17.319 -9.148 -5.278 1.00 0.00 N ATOM 0 H LYS B 96 19.815 -5.086 -1.712 1.00 0.00 H new ATOM 0 HA LYS B 96 20.162 -7.875 -2.515 1.00 0.00 H new ATOM 0 HB2 LYS B 96 18.334 -6.577 -3.480 1.00 0.00 H new ATOM 0 HB3 LYS B 96 19.451 -5.342 -4.027 1.00 0.00 H new ATOM 0 HG2 LYS B 96 20.429 -6.792 -5.658 1.00 0.00 H new ATOM 0 HG3 LYS B 96 19.701 -8.218 -4.946 1.00 0.00 H new ATOM 0 HD2 LYS B 96 18.125 -5.947 -6.223 1.00 0.00 H new ATOM 0 HD3 LYS B 96 18.566 -7.428 -7.050 1.00 0.00 H new ATOM 0 HE2 LYS B 96 16.825 -7.220 -4.558 1.00 0.00 H new ATOM 0 HE3 LYS B 96 16.260 -7.554 -6.183 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 16.429 -9.662 -5.439 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 18.044 -9.495 -5.939 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 17.638 -9.305 -4.301 1.00 0.00 H new ATOM 2435 N LEU B 97 22.522 -7.778 -3.174 1.00 0.00 N ATOM 2436 CA LEU B 97 23.929 -7.783 -3.561 1.00 0.00 C ATOM 2437 C LEU B 97 24.082 -8.093 -5.045 1.00 0.00 C ATOM 2438 O LEU B 97 25.184 -8.034 -5.593 1.00 0.00 O ATOM 2439 CB LEU B 97 24.693 -8.824 -2.738 1.00 0.00 C ATOM 2440 CG LEU B 97 24.548 -8.690 -1.221 1.00 0.00 C ATOM 2441 CD1 LEU B 97 25.316 -9.794 -0.515 1.00 0.00 C ATOM 2442 CD2 LEU B 97 25.027 -7.324 -0.756 1.00 0.00 C ATOM 0 H LEU B 97 22.174 -8.681 -2.851 1.00 0.00 H new ATOM 0 HA LEU B 97 24.340 -6.792 -3.368 1.00 0.00 H new ATOM 0 HB2 LEU B 97 24.354 -9.817 -3.033 1.00 0.00 H new ATOM 0 HB3 LEU B 97 25.751 -8.760 -2.993 1.00 0.00 H new ATOM 0 HG LEU B 97 23.493 -8.787 -0.966 1.00 0.00 H new ATOM 0 HD11 LEU B 97 25.202 -9.684 0.563 1.00 0.00 H new ATOM 0 HD12 LEU B 97 24.926 -10.764 -0.824 1.00 0.00 H new ATOM 0 HD13 LEU B 97 26.372 -9.728 -0.777 1.00 0.00 H new ATOM 0 HD21 LEU B 97 24.916 -7.248 0.326 1.00 0.00 H new ATOM 0 HD22 LEU B 97 26.076 -7.196 -1.023 1.00 0.00 H new ATOM 0 HD23 LEU B 97 24.433 -6.547 -1.237 1.00 0.00 H new ATOM 2454 N GLU B 98 22.969 -8.424 -5.687 1.00 0.00 N ATOM 2455 CA GLU B 98 22.978 -8.803 -7.093 1.00 0.00 C ATOM 2456 C GLU B 98 23.357 -7.627 -7.978 1.00 0.00 C ATOM 2457 O GLU B 98 22.584 -6.682 -8.127 1.00 0.00 O ATOM 2458 CB GLU B 98 21.604 -9.306 -7.525 1.00 0.00 C ATOM 2459 CG GLU B 98 21.019 -10.375 -6.627 1.00 0.00 C ATOM 2460 CD GLU B 98 19.731 -10.926 -7.190 1.00 0.00 C ATOM 2461 OE1 GLU B 98 18.736 -10.173 -7.257 1.00 0.00 O ATOM 2462 OE2 GLU B 98 19.711 -12.107 -7.590 1.00 0.00 O ATOM 0 H GLU B 98 22.046 -8.437 -5.254 1.00 0.00 H new ATOM 0 HA GLU B 98 23.718 -9.596 -7.206 1.00 0.00 H new ATOM 0 HB2 GLU B 98 20.916 -8.461 -7.560 1.00 0.00 H new ATOM 0 HB3 GLU B 98 21.677 -9.700 -8.539 1.00 0.00 H new ATOM 0 HG2 GLU B 98 21.740 -11.184 -6.505 1.00 0.00 H new ATOM 0 HG3 GLU B 98 20.836 -9.959 -5.636 1.00 0.00 H new ATOM 2469 N HIS B 99 24.535 -7.690 -8.572 1.00 0.00 N ATOM 2470 CA HIS B 99 24.955 -6.676 -9.528 1.00 0.00 C ATOM 2471 C HIS B 99 24.555 -7.095 -10.934 1.00 0.00 C ATOM 2472 O HIS B 99 24.367 -6.257 -11.812 1.00 0.00 O ATOM 2473 CB HIS B 99 26.465 -6.443 -9.454 1.00 0.00 C ATOM 2474 CG HIS B 99 26.906 -5.809 -8.173 1.00 0.00 C ATOM 2475 ND1 HIS B 99 27.406 -6.526 -7.108 1.00 0.00 N ATOM 2476 CD2 HIS B 99 26.920 -4.513 -7.789 1.00 0.00 C ATOM 2477 CE1 HIS B 99 27.709 -5.699 -6.125 1.00 0.00 C ATOM 2478 NE2 HIS B 99 27.425 -4.473 -6.516 1.00 0.00 N ATOM 0 H HIS B 99 25.218 -8.430 -8.411 1.00 0.00 H new ATOM 0 HA HIS B 99 24.457 -5.739 -9.277 1.00 0.00 H new ATOM 0 HB2 HIS B 99 26.979 -7.397 -9.574 1.00 0.00 H new ATOM 0 HB3 HIS B 99 26.769 -5.810 -10.288 1.00 0.00 H new ATOM 0 HD2 HIS B 99 26.594 -3.667 -8.376 1.00 0.00 H new ATOM 0 HE1 HIS B 99 28.119 -5.979 -5.166 1.00 0.00 H new ATOM 0 HE2 HIS B 99 27.560 -3.629 -5.960 1.00 0.00 H new ATOM 2487 N HIS B 100 24.386 -8.399 -11.127 1.00 0.00 N ATOM 2488 CA HIS B 100 24.015 -8.939 -12.430 1.00 0.00 C ATOM 2489 C HIS B 100 22.542 -8.661 -12.719 1.00 0.00 C ATOM 2490 O HIS B 100 22.069 -8.845 -13.839 1.00 0.00 O ATOM 2491 CB HIS B 100 24.295 -10.447 -12.480 1.00 0.00 C ATOM 2492 CG HIS B 100 24.239 -11.032 -13.859 1.00 0.00 C ATOM 2493 ND1 HIS B 100 25.308 -11.007 -14.725 1.00 0.00 N ATOM 2494 CD2 HIS B 100 23.237 -11.657 -14.523 1.00 0.00 C ATOM 2495 CE1 HIS B 100 24.969 -11.586 -15.859 1.00 0.00 C ATOM 2496 NE2 HIS B 100 23.719 -11.990 -15.761 1.00 0.00 N ATOM 0 H HIS B 100 24.500 -9.102 -10.397 1.00 0.00 H new ATOM 0 HA HIS B 100 24.617 -8.449 -13.195 1.00 0.00 H new ATOM 0 HB2 HIS B 100 25.281 -10.637 -12.055 1.00 0.00 H new ATOM 0 HB3 HIS B 100 23.571 -10.962 -11.848 1.00 0.00 H new ATOM 0 HD2 HIS B 100 22.244 -11.855 -14.147 1.00 0.00 H new ATOM 0 HE1 HIS B 100 25.607 -11.708 -16.722 1.00 0.00 H new ATOM 0 HE2 HIS B 100 23.194 -12.473 -16.490 1.00 0.00 H new ATOM 2505 N HIS B 101 21.820 -8.210 -11.699 1.00 0.00 N ATOM 2506 CA HIS B 101 20.416 -7.850 -11.858 1.00 0.00 C ATOM 2507 C HIS B 101 20.290 -6.373 -12.223 1.00 0.00 C ATOM 2508 O HIS B 101 19.191 -5.822 -12.263 1.00 0.00 O ATOM 2509 CB HIS B 101 19.629 -8.149 -10.576 1.00 0.00 C ATOM 2510 CG HIS B 101 18.478 -9.090 -10.786 1.00 0.00 C ATOM 2511 ND1 HIS B 101 18.002 -9.938 -9.805 1.00 0.00 N ATOM 2512 CD2 HIS B 101 17.706 -9.314 -11.876 1.00 0.00 C ATOM 2513 CE1 HIS B 101 16.992 -10.640 -10.284 1.00 0.00 C ATOM 2514 NE2 HIS B 101 16.792 -10.280 -11.537 1.00 0.00 N ATOM 0 H HIS B 101 22.183 -8.085 -10.754 1.00 0.00 H new ATOM 0 HA HIS B 101 19.996 -8.451 -12.665 1.00 0.00 H new ATOM 0 HB2 HIS B 101 20.305 -8.575 -9.835 1.00 0.00 H new ATOM 0 HB3 HIS B 101 19.252 -7.213 -10.164 1.00 0.00 H new ATOM 0 HD1 HIS B 101 18.373 -10.010 -8.858 1.00 0.00 H new ATOM 0 HD2 HIS B 101 17.793 -8.823 -12.834 1.00 0.00 H new ATOM 0 HE1 HIS B 101 16.426 -11.383 -9.742 1.00 0.00 H new ATOM 2523 N HIS B 102 21.430 -5.741 -12.479 1.00 0.00 N ATOM 2524 CA HIS B 102 21.469 -4.350 -12.908 1.00 0.00 C ATOM 2525 C HIS B 102 22.012 -4.269 -14.327 1.00 0.00 C ATOM 2526 O HIS B 102 22.483 -5.268 -14.872 1.00 0.00 O ATOM 2527 CB HIS B 102 22.360 -3.508 -11.986 1.00 0.00 C ATOM 2528 CG HIS B 102 21.842 -3.355 -10.590 1.00 0.00 C ATOM 2529 ND1 HIS B 102 21.130 -2.255 -10.167 1.00 0.00 N ATOM 2530 CD2 HIS B 102 21.952 -4.163 -9.514 1.00 0.00 C ATOM 2531 CE1 HIS B 102 20.828 -2.394 -8.891 1.00 0.00 C ATOM 2532 NE2 HIS B 102 21.315 -3.544 -8.467 1.00 0.00 N ATOM 0 H HIS B 102 22.348 -6.177 -12.395 1.00 0.00 H new ATOM 0 HA HIS B 102 20.453 -3.956 -12.867 1.00 0.00 H new ATOM 0 HB2 HIS B 102 23.350 -3.962 -11.945 1.00 0.00 H new ATOM 0 HB3 HIS B 102 22.482 -2.518 -12.425 1.00 0.00 H new ATOM 0 HD2 HIS B 102 22.450 -5.121 -9.483 1.00 0.00 H new ATOM 0 HE1 HIS B 102 20.275 -1.685 -8.293 1.00 0.00 H new ATOM 0 HE2 HIS B 102 21.232 -3.912 -7.519 1.00 0.00 H new ATOM 2541 N HIS B 103 21.955 -3.086 -14.918 1.00 0.00 N ATOM 2542 CA HIS B 103 22.536 -2.880 -16.237 1.00 0.00 C ATOM 2543 C HIS B 103 24.030 -2.604 -16.111 1.00 0.00 C ATOM 2544 O HIS B 103 24.568 -2.540 -15.003 1.00 0.00 O ATOM 2545 CB HIS B 103 21.839 -1.733 -16.992 1.00 0.00 C ATOM 2546 CG HIS B 103 21.955 -0.375 -16.353 1.00 0.00 C ATOM 2547 ND1 HIS B 103 23.133 0.345 -16.295 1.00 0.00 N ATOM 2548 CD2 HIS B 103 21.016 0.408 -15.773 1.00 0.00 C ATOM 2549 CE1 HIS B 103 22.908 1.506 -15.710 1.00 0.00 C ATOM 2550 NE2 HIS B 103 21.632 1.571 -15.384 1.00 0.00 N ATOM 0 H HIS B 103 21.517 -2.260 -14.511 1.00 0.00 H new ATOM 0 HA HIS B 103 22.387 -3.791 -16.816 1.00 0.00 H new ATOM 0 HB2 HIS B 103 22.253 -1.679 -17.999 1.00 0.00 H new ATOM 0 HB3 HIS B 103 20.782 -1.978 -17.095 1.00 0.00 H new ATOM 0 HD1 HIS B 103 24.036 0.028 -16.649 1.00 0.00 H new ATOM 0 HD2 HIS B 103 19.973 0.163 -15.640 1.00 0.00 H new ATOM 0 HE1 HIS B 103 23.645 2.274 -15.529 1.00 0.00 H new ATOM 2559 N HIS B 104 24.698 -2.443 -17.240 1.00 0.00 N ATOM 2560 CA HIS B 104 26.116 -2.123 -17.238 1.00 0.00 C ATOM 2561 C HIS B 104 26.294 -0.632 -17.469 1.00 0.00 C ATOM 2562 O HIS B 104 26.796 -0.244 -18.538 1.00 0.00 O ATOM 2563 CB HIS B 104 26.863 -2.921 -18.314 1.00 0.00 C ATOM 2564 CG HIS B 104 26.860 -4.403 -18.083 1.00 0.00 C ATOM 2565 ND1 HIS B 104 27.806 -5.047 -17.314 1.00 0.00 N ATOM 2566 CD2 HIS B 104 26.026 -5.370 -18.537 1.00 0.00 C ATOM 2567 CE1 HIS B 104 27.551 -6.343 -17.302 1.00 0.00 C ATOM 2568 NE2 HIS B 104 26.479 -6.564 -18.036 1.00 0.00 N ATOM 2569 OXT HIS B 104 25.879 0.151 -16.590 1.00 0.00 O ATOM 0 H HIS B 104 24.283 -2.528 -18.168 1.00 0.00 H new ATOM 0 HA HIS B 104 26.536 -2.396 -16.270 1.00 0.00 H new ATOM 0 HB2 HIS B 104 26.413 -2.714 -19.285 1.00 0.00 H new ATOM 0 HB3 HIS B 104 27.895 -2.572 -18.360 1.00 0.00 H new ATOM 0 HD2 HIS B 104 25.166 -5.227 -19.174 1.00 0.00 H new ATOM 0 HE1 HIS B 104 28.124 -7.094 -16.779 1.00 0.00 H new ATOM 0 HE2 HIS B 104 26.054 -7.476 -18.204 1.00 0.00 H new TER 2578 HIS B 104