USER MOD reduce.3.24.130724 H: found=0, std=0, add=1266, rem=0, adj=33 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 -58:sc= 1.23 USER MOD Set 1.2: B 83 ASN : amide:sc= 1.21 K(o=2.4,f=0.44) USER MOD Set 2.1: B 52 SER OG : rot 180:sc= -1.37 USER MOD Set 2.2: B 54 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 45 GLN : amide:sc= -0.869 K(o=-2.2,f=-0.73) USER MOD Set 3.2: B 49 GLN : amide:sc= -1.32! K(o=-2.2!,f=-0.73) USER MOD Set 4.1: B 37 LYS NZ :NH3+ -165:sc= -0.0121 (180deg=-0.187) USER MOD Set 4.2: B 40 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 24 GLN : amide:sc= 2.02 K(o=3.1,f=-5.1!) USER MOD Set 5.2: A 73 HIS : no HD1:sc= 0 X(o=3.1,f=2.9) USER MOD Set 5.3: B 26 SER OG : rot 128:sc= 1.09 USER MOD Set 6.1: A 45 GLN : amide:sc= 0.475 K(o=0.87,f=-0.25) USER MOD Set 6.2: A 49 GLN : amide:sc= 0.394 K(o=0.87,f=-0.066) USER MOD Set 7.1: A 42 ASN : amide:sc= 0.259 K(o=0.97,f=-0.25) USER MOD Set 7.2: A 44 SER OG : rot -94:sc= 0.708 USER MOD Set 8.1: A 37 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0645) USER MOD Set 8.2: A 40 THR OG1 : rot 180:sc= 0 USER MOD Set 9.1: A 27 LYS NZ :NH3+ 172:sc= 1.08 (180deg=-0.31) USER MOD Set 9.2: A 31 SER OG : rot -100:sc= 1.02 USER MOD Set10.1: A 26 SER OG : rot 180:sc= 0 USER MOD Set10.2: B 24 GLN : amide:sc= 1.14 K(o=1.1,f=-1.1) USER MOD Single : A 28 GLN : amide:sc= -1.47! C(o=-1.5!,f=-2.9!) USER MOD Single : A 32 HIS : no HD1:sc= 1.09 K(o=1.1,f=-5.2!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 27:sc= 0.731 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= -0.589 USER MOD Single : A 54 SER OG : rot -52:sc= 1.24 USER MOD Single : A 59 LYS NZ :NH3+ 170:sc= 1.27 (180deg=1.06) USER MOD Single : A 61 SER OG : rot 69:sc= 1.12 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 TYR OH : rot -151:sc= 1.16 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HE2:sc= 0.672 K(o=0.67,f=-3.4!) USER MOD Single : A 83 ASN : amide:sc=-0.00148 X(o=-0.0015,f=-0.28) USER MOD Single : A 91 TYR OH : rot 57:sc= 1.26 USER MOD Single : A 92 ASN : amide:sc= 1.06 K(o=1.1,f=-7.3!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0458 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 HIS : no HD1:sc= -0.204 X(o=-0.2,f=0) USER MOD Single : A 100 HIS : no HD1:sc= 0.58 K(o=0.58,f=-6.8!) USER MOD Single : A 101 HIS : no HD1:sc= -0.0547 X(o=-0.055,f=0) 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) USER MOD Single : A 104 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 GLN : amide:sc= 0.305 K(o=0.3,f=-7.9!) USER MOD Single : B 31 SER OG : rot 79:sc= 1.22 USER MOD Single : B 32 HIS : no HD1:sc= 1.14 K(o=1.1,f=-5.2!) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 ASN : amide:sc= -0.0362 X(o=-0.036,f=-0.052) USER MOD Single : B 44 SER OG : rot 36:sc= 1.25 USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 174:sc= 2.4 (180deg=2.25) USER MOD Single : B 61 SER OG : rot -83:sc= 1.17 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 TYR OH : rot 180:sc= 0 USER MOD Single : B 73 HIS : no HD1:sc= 0 X(o=0,f=-0.0061) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : B 91 TYR OH : rot -27:sc= 0.262 USER MOD Single : B 92 ASN : amide:sc= 0.106 K(o=0.11,f=-6.6!) USER MOD Single : B 95 THR OG1 : rot -99:sc= 1.26 USER MOD Single : B 96 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0375) USER MOD Single : B 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 100 HIS : no HD1:sc= -2.07! K(o=-2.1!,f=-0.0046) USER MOD Single : B 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 102 HIS : no HD1:sc= 0 X(o=0,f=-0.00068) USER MOD Single : B 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 104 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 22 -6.391 -5.850 -7.983 1.00 0.00 N ATOM 2 CA ALA A 22 -6.595 -4.673 -7.112 1.00 0.00 C ATOM 3 C ALA A 22 -5.269 -4.213 -6.520 1.00 0.00 C ATOM 4 O ALA A 22 -4.362 -5.019 -6.311 1.00 0.00 O ATOM 5 CB ALA A 22 -7.584 -5.000 -6.005 1.00 0.00 C ATOM 0 HA ALA A 22 -7.004 -3.862 -7.715 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.724 -4.124 -5.372 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -8.540 -5.287 -6.444 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.199 -5.824 -5.404 1.00 0.00 H new ATOM 13 N GLU A 23 -5.162 -2.921 -6.245 1.00 0.00 N ATOM 14 CA GLU A 23 -3.934 -2.356 -5.708 1.00 0.00 C ATOM 15 C GLU A 23 -4.156 -1.851 -4.289 1.00 0.00 C ATOM 16 O GLU A 23 -5.287 -1.563 -3.890 1.00 0.00 O ATOM 17 CB GLU A 23 -3.433 -1.225 -6.610 1.00 0.00 C ATOM 18 CG GLU A 23 -2.071 -1.501 -7.230 1.00 0.00 C ATOM 19 CD GLU A 23 -0.938 -1.394 -6.227 1.00 0.00 C ATOM 20 OE1 GLU A 23 -0.926 -2.171 -5.248 1.00 0.00 O ATOM 21 OE2 GLU A 23 -0.055 -0.529 -6.418 1.00 0.00 O ATOM 0 H GLU A 23 -5.912 -2.244 -6.385 1.00 0.00 H new ATOM 0 HA GLU A 23 -3.175 -3.137 -5.678 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -4.158 -1.057 -7.406 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -3.379 -0.304 -6.029 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -2.071 -2.500 -7.667 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.898 -0.797 -8.044 1.00 0.00 H new ATOM 28 N GLN A 24 -3.079 -1.747 -3.525 1.00 0.00 N ATOM 29 CA GLN A 24 -3.179 -1.349 -2.131 1.00 0.00 C ATOM 30 C GLN A 24 -2.842 0.125 -1.943 1.00 0.00 C ATOM 31 O GLN A 24 -1.774 0.591 -2.342 1.00 0.00 O ATOM 32 CB GLN A 24 -2.266 -2.206 -1.251 1.00 0.00 C ATOM 33 CG GLN A 24 -2.349 -1.837 0.221 1.00 0.00 C ATOM 34 CD GLN A 24 -1.498 -2.716 1.114 1.00 0.00 C ATOM 35 OE1 GLN A 24 -1.840 -2.942 2.274 1.00 0.00 O ATOM 36 NE2 GLN A 24 -0.386 -3.205 0.591 1.00 0.00 N ATOM 0 H GLN A 24 -2.129 -1.932 -3.846 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.214 -1.505 -1.826 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -2.533 -3.256 -1.373 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -1.236 -2.097 -1.590 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -2.040 -0.799 0.345 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -3.388 -1.901 0.545 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -0.141 -2.992 -0.376 1.00 0.00 H new ATOM 0 HE22 GLN A 24 0.226 -3.795 1.155 1.00 0.00 H new ATOM 45 N VAL A 25 -3.762 0.847 -1.324 1.00 0.00 N ATOM 46 CA VAL A 25 -3.558 2.251 -1.005 1.00 0.00 C ATOM 47 C VAL A 25 -3.645 2.455 0.503 1.00 0.00 C ATOM 48 O VAL A 25 -4.273 1.660 1.204 1.00 0.00 O ATOM 49 CB VAL A 25 -4.597 3.155 -1.709 1.00 0.00 C ATOM 50 CG1 VAL A 25 -4.399 3.128 -3.218 1.00 0.00 C ATOM 51 CG2 VAL A 25 -6.014 2.727 -1.353 1.00 0.00 C ATOM 0 H VAL A 25 -4.667 0.479 -1.030 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.568 2.533 -1.364 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.448 4.177 -1.359 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.140 3.770 -3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.399 3.487 -3.460 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -4.516 2.107 -3.582 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -6.728 3.376 -1.859 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -6.173 1.696 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -6.157 2.801 -0.275 1.00 0.00 H new ATOM 61 N SER A 26 -3.010 3.498 1.004 1.00 0.00 N ATOM 62 CA SER A 26 -3.049 3.796 2.423 1.00 0.00 C ATOM 63 C SER A 26 -4.179 4.780 2.706 1.00 0.00 C ATOM 64 O SER A 26 -4.777 5.322 1.774 1.00 0.00 O ATOM 65 CB SER A 26 -1.708 4.375 2.871 1.00 0.00 C ATOM 66 OG SER A 26 -0.629 3.623 2.339 1.00 0.00 O ATOM 0 H SER A 26 -2.460 4.154 0.448 1.00 0.00 H new ATOM 0 HA SER A 26 -3.232 2.879 2.983 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.629 5.412 2.546 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.654 4.377 3.960 1.00 0.00 H new ATOM 0 HG SER A 26 0.219 4.012 2.637 1.00 0.00 H new ATOM 72 N LYS A 27 -4.475 5.015 3.983 1.00 0.00 N ATOM 73 CA LYS A 27 -5.562 5.916 4.354 1.00 0.00 C ATOM 74 C LYS A 27 -5.321 7.316 3.798 1.00 0.00 C ATOM 75 O LYS A 27 -6.267 8.059 3.531 1.00 0.00 O ATOM 76 CB LYS A 27 -5.733 5.971 5.876 1.00 0.00 C ATOM 77 CG LYS A 27 -6.817 6.940 6.323 1.00 0.00 C ATOM 78 CD LYS A 27 -7.064 6.868 7.820 1.00 0.00 C ATOM 79 CE LYS A 27 -8.082 7.912 8.259 1.00 0.00 C ATOM 80 NZ LYS A 27 -9.329 7.844 7.452 1.00 0.00 N ATOM 0 H LYS A 27 -3.981 4.597 4.772 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.482 5.525 3.919 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -5.972 4.973 6.244 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -4.786 6.260 6.331 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -6.529 7.956 6.052 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -7.743 6.718 5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.422 5.873 8.085 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -6.127 7.023 8.354 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -8.322 7.764 9.312 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -7.645 8.906 8.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -10.045 8.474 7.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -9.128 8.142 6.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -9.688 6.868 7.449 1.00 0.00 H new ATOM 94 N GLN A 28 -4.049 7.656 3.612 1.00 0.00 N ATOM 95 CA GLN A 28 -3.672 8.935 3.028 1.00 0.00 C ATOM 96 C GLN A 28 -4.328 9.102 1.661 1.00 0.00 C ATOM 97 O GLN A 28 -4.919 10.142 1.373 1.00 0.00 O ATOM 98 CB GLN A 28 -2.147 9.051 2.893 1.00 0.00 C ATOM 99 CG GLN A 28 -1.385 8.976 4.213 1.00 0.00 C ATOM 100 CD GLN A 28 -1.219 7.558 4.726 1.00 0.00 C ATOM 101 OE1 GLN A 28 -2.054 7.048 5.470 1.00 0.00 O ATOM 102 NE2 GLN A 28 -0.135 6.913 4.332 1.00 0.00 N ATOM 0 H GLN A 28 -3.260 7.059 3.859 1.00 0.00 H new ATOM 0 HA GLN A 28 -4.019 9.726 3.693 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -1.792 8.256 2.238 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -1.909 9.996 2.405 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -0.401 9.426 4.083 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -1.910 9.568 4.963 1.00 0.00 H new ATOM 0 HE21 GLN A 28 0.535 7.371 3.714 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.032 5.957 4.646 1.00 0.00 H new ATOM 111 N GLU A 29 -4.235 8.067 0.831 1.00 0.00 N ATOM 112 CA GLU A 29 -4.867 8.082 -0.480 1.00 0.00 C ATOM 113 C GLU A 29 -6.381 7.929 -0.341 1.00 0.00 C ATOM 114 O GLU A 29 -7.149 8.660 -0.967 1.00 0.00 O ATOM 115 CB GLU A 29 -4.320 6.961 -1.378 1.00 0.00 C ATOM 116 CG GLU A 29 -2.803 6.945 -1.523 1.00 0.00 C ATOM 117 CD GLU A 29 -2.128 6.020 -0.528 1.00 0.00 C ATOM 118 OE1 GLU A 29 -2.046 6.377 0.663 1.00 0.00 O ATOM 119 OE2 GLU A 29 -1.684 4.920 -0.934 1.00 0.00 O ATOM 0 H GLU A 29 -3.728 7.208 1.045 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.638 9.041 -0.945 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -4.643 6.001 -0.975 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -4.765 7.057 -2.368 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.542 6.635 -2.535 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.419 7.956 -1.390 1.00 0.00 H new ATOM 126 N ILE A 30 -6.791 6.984 0.502 1.00 0.00 N ATOM 127 CA ILE A 30 -8.206 6.658 0.694 1.00 0.00 C ATOM 128 C ILE A 30 -9.039 7.891 1.050 1.00 0.00 C ATOM 129 O ILE A 30 -10.023 8.200 0.376 1.00 0.00 O ATOM 130 CB ILE A 30 -8.381 5.595 1.803 1.00 0.00 C ATOM 131 CG1 ILE A 30 -7.632 4.314 1.431 1.00 0.00 C ATOM 132 CG2 ILE A 30 -9.858 5.298 2.040 1.00 0.00 C ATOM 133 CD1 ILE A 30 -7.568 3.298 2.550 1.00 0.00 C ATOM 0 H ILE A 30 -6.156 6.423 1.070 1.00 0.00 H new ATOM 0 HA ILE A 30 -8.564 6.262 -0.256 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.961 5.991 2.728 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -8.116 3.859 0.567 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.617 4.572 1.129 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -9.957 4.547 2.824 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.368 6.211 2.345 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.306 4.923 1.120 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.022 2.418 2.211 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -7.057 3.734 3.408 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -8.579 3.010 2.838 1.00 0.00 H new ATOM 145 N SER A 31 -8.635 8.600 2.095 1.00 0.00 N ATOM 146 CA SER A 31 -9.412 9.726 2.591 1.00 0.00 C ATOM 147 C SER A 31 -9.195 10.981 1.743 1.00 0.00 C ATOM 148 O SER A 31 -9.988 11.923 1.803 1.00 0.00 O ATOM 149 CB SER A 31 -9.063 9.994 4.056 1.00 0.00 C ATOM 150 OG SER A 31 -9.370 8.860 4.858 1.00 0.00 O ATOM 0 H SER A 31 -7.776 8.416 2.614 1.00 0.00 H new ATOM 0 HA SER A 31 -10.468 9.467 2.518 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.003 10.234 4.145 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.617 10.861 4.415 1.00 0.00 H new ATOM 0 HG SER A 31 -10.225 9.004 5.314 1.00 0.00 H new ATOM 156 N HIS A 32 -8.134 10.991 0.944 1.00 0.00 N ATOM 157 CA HIS A 32 -7.858 12.124 0.070 1.00 0.00 C ATOM 158 C HIS A 32 -8.682 12.023 -1.207 1.00 0.00 C ATOM 159 O HIS A 32 -9.310 12.991 -1.630 1.00 0.00 O ATOM 160 CB HIS A 32 -6.365 12.199 -0.271 1.00 0.00 C ATOM 161 CG HIS A 32 -5.995 13.374 -1.127 1.00 0.00 C ATOM 162 ND1 HIS A 32 -5.763 13.274 -2.482 1.00 0.00 N ATOM 163 CD2 HIS A 32 -5.815 14.680 -0.815 1.00 0.00 C ATOM 164 CE1 HIS A 32 -5.458 14.465 -2.963 1.00 0.00 C ATOM 165 NE2 HIS A 32 -5.484 15.336 -1.977 1.00 0.00 N ATOM 0 H HIS A 32 -7.455 10.232 0.884 1.00 0.00 H new ATOM 0 HA HIS A 32 -8.137 13.035 0.599 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -5.793 12.242 0.656 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -6.073 11.282 -0.783 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -5.913 15.124 0.165 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -5.226 14.687 -3.994 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -5.290 16.334 -2.061 1.00 0.00 H new ATOM 174 N PHE A 33 -8.686 10.842 -1.813 1.00 0.00 N ATOM 175 CA PHE A 33 -9.418 10.632 -3.055 1.00 0.00 C ATOM 176 C PHE A 33 -10.872 10.279 -2.770 1.00 0.00 C ATOM 177 O PHE A 33 -11.683 10.166 -3.690 1.00 0.00 O ATOM 178 CB PHE A 33 -8.756 9.535 -3.894 1.00 0.00 C ATOM 179 CG PHE A 33 -7.338 9.854 -4.282 1.00 0.00 C ATOM 180 CD1 PHE A 33 -7.049 10.969 -5.052 1.00 0.00 C ATOM 181 CD2 PHE A 33 -6.294 9.045 -3.867 1.00 0.00 C ATOM 182 CE1 PHE A 33 -5.746 11.269 -5.401 1.00 0.00 C ATOM 183 CE2 PHE A 33 -4.989 9.340 -4.211 1.00 0.00 C ATOM 184 CZ PHE A 33 -4.715 10.453 -4.979 1.00 0.00 C ATOM 0 H PHE A 33 -8.193 10.019 -1.466 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.395 11.562 -3.624 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.770 8.601 -3.333 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -9.345 9.374 -4.797 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -7.852 11.611 -5.383 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.503 8.172 -3.266 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -5.534 12.140 -6.003 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.184 8.700 -3.879 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.696 10.686 -5.250 1.00 0.00 H new ATOM 194 N LYS A 34 -11.183 10.106 -1.484 1.00 0.00 N ATOM 195 CA LYS A 34 -12.545 9.844 -1.022 1.00 0.00 C ATOM 196 C LYS A 34 -13.044 8.502 -1.555 1.00 0.00 C ATOM 197 O LYS A 34 -13.953 8.442 -2.384 1.00 0.00 O ATOM 198 CB LYS A 34 -13.489 10.980 -1.443 1.00 0.00 C ATOM 199 CG LYS A 34 -14.771 11.057 -0.626 1.00 0.00 C ATOM 200 CD LYS A 34 -14.495 11.472 0.811 1.00 0.00 C ATOM 201 CE LYS A 34 -13.829 12.841 0.880 1.00 0.00 C ATOM 202 NZ LYS A 34 -13.568 13.264 2.281 1.00 0.00 N ATOM 0 H LYS A 34 -10.494 10.144 -0.732 1.00 0.00 H new ATOM 0 HA LYS A 34 -12.534 9.797 0.067 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.959 11.929 -1.358 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -13.748 10.852 -2.494 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -15.454 11.771 -1.087 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -15.268 10.087 -0.636 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -15.430 11.493 1.371 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -13.854 10.730 1.288 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.889 12.815 0.328 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -14.465 13.579 0.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.115 14.200 2.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -14.467 13.314 2.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.940 12.574 2.741 1.00 0.00 H new ATOM 216 N LEU A 35 -12.422 7.430 -1.090 1.00 0.00 N ATOM 217 CA LEU A 35 -12.781 6.091 -1.528 1.00 0.00 C ATOM 218 C LEU A 35 -13.928 5.537 -0.695 1.00 0.00 C ATOM 219 O LEU A 35 -14.126 5.934 0.454 1.00 0.00 O ATOM 220 CB LEU A 35 -11.574 5.156 -1.439 1.00 0.00 C ATOM 221 CG LEU A 35 -10.379 5.549 -2.311 1.00 0.00 C ATOM 222 CD1 LEU A 35 -9.247 4.549 -2.146 1.00 0.00 C ATOM 223 CD2 LEU A 35 -10.796 5.648 -3.771 1.00 0.00 C ATOM 0 H LEU A 35 -11.664 7.462 -0.408 1.00 0.00 H new ATOM 0 HA LEU A 35 -13.105 6.153 -2.567 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.246 5.110 -0.401 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.892 4.151 -1.718 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.023 6.527 -1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -8.406 4.845 -2.773 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.931 4.526 -1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.591 3.558 -2.443 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -9.935 5.928 -4.377 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.178 4.684 -4.107 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -11.575 6.403 -3.876 1.00 0.00 H new ATOM 235 N VAL A 36 -14.681 4.625 -1.288 1.00 0.00 N ATOM 236 CA VAL A 36 -15.801 3.993 -0.611 1.00 0.00 C ATOM 237 C VAL A 36 -15.442 2.561 -0.229 1.00 0.00 C ATOM 238 O VAL A 36 -14.796 1.850 -1.000 1.00 0.00 O ATOM 239 CB VAL A 36 -17.070 3.985 -1.492 1.00 0.00 C ATOM 240 CG1 VAL A 36 -18.243 3.370 -0.746 1.00 0.00 C ATOM 241 CG2 VAL A 36 -17.410 5.394 -1.958 1.00 0.00 C ATOM 0 H VAL A 36 -14.535 4.304 -2.245 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.012 4.575 0.286 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.868 3.373 -2.371 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.125 3.376 -1.387 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.001 2.344 -0.470 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.445 3.949 0.155 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -18.307 5.366 -2.577 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -17.587 6.031 -1.091 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -16.580 5.795 -2.540 1.00 0.00 H new ATOM 251 N LYS A 37 -15.853 2.154 0.961 1.00 0.00 N ATOM 252 CA LYS A 37 -15.581 0.814 1.457 1.00 0.00 C ATOM 253 C LYS A 37 -16.550 -0.198 0.847 1.00 0.00 C ATOM 254 O LYS A 37 -17.765 -0.109 1.037 1.00 0.00 O ATOM 255 CB LYS A 37 -15.673 0.806 2.986 1.00 0.00 C ATOM 256 CG LYS A 37 -15.473 -0.560 3.620 1.00 0.00 C ATOM 257 CD LYS A 37 -15.343 -0.444 5.131 1.00 0.00 C ATOM 258 CE LYS A 37 -15.339 -1.806 5.803 1.00 0.00 C ATOM 259 NZ LYS A 37 -16.682 -2.441 5.778 1.00 0.00 N ATOM 0 H LYS A 37 -16.382 2.739 1.608 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.573 0.524 1.162 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.926 1.492 3.386 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.649 1.191 3.281 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.314 -1.207 3.372 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.579 -1.029 3.209 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -14.422 0.085 5.377 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.168 0.152 5.522 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.621 -2.456 5.302 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -15.007 -1.700 6.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -16.679 -3.283 6.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -17.392 -1.765 6.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.916 -2.720 4.804 1.00 0.00 H new ATOM 273 N VAL A 38 -16.000 -1.149 0.107 1.00 0.00 N ATOM 274 CA VAL A 38 -16.796 -2.177 -0.548 1.00 0.00 C ATOM 275 C VAL A 38 -17.091 -3.318 0.420 1.00 0.00 C ATOM 276 O VAL A 38 -18.162 -3.925 0.382 1.00 0.00 O ATOM 277 CB VAL A 38 -16.070 -2.737 -1.792 1.00 0.00 C ATOM 278 CG1 VAL A 38 -16.921 -3.776 -2.506 1.00 0.00 C ATOM 279 CG2 VAL A 38 -15.697 -1.613 -2.744 1.00 0.00 C ATOM 0 H VAL A 38 -14.996 -1.230 -0.056 1.00 0.00 H new ATOM 0 HA VAL A 38 -17.732 -1.717 -0.866 1.00 0.00 H new ATOM 0 HB VAL A 38 -15.156 -3.225 -1.453 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -16.383 -4.151 -3.377 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -17.133 -4.602 -1.827 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -17.858 -3.321 -2.827 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.187 -2.027 -3.614 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -16.600 -1.094 -3.066 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.036 -0.910 -2.236 1.00 0.00 H new ATOM 289 N GLY A 39 -16.134 -3.598 1.292 1.00 0.00 N ATOM 290 CA GLY A 39 -16.294 -4.662 2.260 1.00 0.00 C ATOM 291 C GLY A 39 -14.982 -5.009 2.922 1.00 0.00 C ATOM 292 O GLY A 39 -13.941 -4.465 2.558 1.00 0.00 O ATOM 0 H GLY A 39 -15.244 -3.103 1.346 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -17.017 -4.360 3.018 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -16.699 -5.546 1.767 1.00 0.00 H new ATOM 296 N THR A 40 -15.026 -5.901 3.893 1.00 0.00 N ATOM 297 CA THR A 40 -13.827 -6.327 4.592 1.00 0.00 C ATOM 298 C THR A 40 -13.532 -7.794 4.291 1.00 0.00 C ATOM 299 O THR A 40 -14.419 -8.646 4.388 1.00 0.00 O ATOM 300 CB THR A 40 -13.982 -6.128 6.110 1.00 0.00 C ATOM 301 OG1 THR A 40 -14.488 -4.811 6.374 1.00 0.00 O ATOM 302 CG2 THR A 40 -12.649 -6.311 6.821 1.00 0.00 C ATOM 0 H THR A 40 -15.884 -6.347 4.218 1.00 0.00 H new ATOM 0 HA THR A 40 -12.995 -5.716 4.243 1.00 0.00 H new ATOM 0 HB THR A 40 -14.681 -6.876 6.485 1.00 0.00 H new ATOM 0 HG1 THR A 40 -14.588 -4.687 7.341 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.785 -6.165 7.893 1.00 0.00 H new ATOM 0 HG22 THR A 40 -12.273 -7.317 6.637 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.932 -5.582 6.444 1.00 0.00 H new ATOM 310 N ILE A 41 -12.297 -8.089 3.914 1.00 0.00 N ATOM 311 CA ILE A 41 -11.912 -9.449 3.578 1.00 0.00 C ATOM 312 C ILE A 41 -10.935 -10.016 4.602 1.00 0.00 C ATOM 313 O ILE A 41 -9.994 -9.342 5.026 1.00 0.00 O ATOM 314 CB ILE A 41 -11.296 -9.549 2.162 1.00 0.00 C ATOM 315 CG1 ILE A 41 -10.109 -8.590 2.013 1.00 0.00 C ATOM 316 CG2 ILE A 41 -12.355 -9.264 1.107 1.00 0.00 C ATOM 317 CD1 ILE A 41 -9.415 -8.675 0.670 1.00 0.00 C ATOM 0 H ILE A 41 -11.545 -7.404 3.833 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.828 -10.040 3.592 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.926 -10.564 2.018 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.458 -7.569 2.166 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.384 -8.800 2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -11.909 -9.337 0.115 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -13.163 -9.991 1.197 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.753 -8.260 1.253 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.587 -7.967 0.643 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -9.033 -9.685 0.521 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.124 -8.435 -0.122 1.00 0.00 H new ATOM 329 N ASN A 42 -11.181 -11.250 5.005 1.00 0.00 N ATOM 330 CA ASN A 42 -10.321 -11.937 5.955 1.00 0.00 C ATOM 331 C ASN A 42 -9.644 -13.123 5.282 1.00 0.00 C ATOM 332 O ASN A 42 -10.309 -14.080 4.875 1.00 0.00 O ATOM 333 CB ASN A 42 -11.136 -12.426 7.160 1.00 0.00 C ATOM 334 CG ASN A 42 -10.301 -13.195 8.174 1.00 0.00 C ATOM 335 OD1 ASN A 42 -10.083 -14.401 8.034 1.00 0.00 O ATOM 336 ND2 ASN A 42 -9.856 -12.513 9.219 1.00 0.00 N ATOM 0 H ASN A 42 -11.977 -11.802 4.686 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.562 -11.237 6.303 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.595 -11.569 7.652 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -11.947 -13.064 6.808 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -9.313 -12.985 9.942 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.056 -11.516 9.300 1.00 0.00 H new ATOM 343 N VAL A 43 -8.331 -13.063 5.155 1.00 0.00 N ATOM 344 CA VAL A 43 -7.576 -14.168 4.599 1.00 0.00 C ATOM 345 C VAL A 43 -6.928 -14.960 5.719 1.00 0.00 C ATOM 346 O VAL A 43 -5.911 -14.551 6.272 1.00 0.00 O ATOM 347 CB VAL A 43 -6.488 -13.695 3.608 1.00 0.00 C ATOM 348 CG1 VAL A 43 -5.664 -14.871 3.109 1.00 0.00 C ATOM 349 CG2 VAL A 43 -7.105 -12.947 2.435 1.00 0.00 C ATOM 0 H VAL A 43 -7.766 -12.260 5.430 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.276 -14.795 4.047 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.828 -13.011 4.141 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.905 -14.514 2.413 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.180 -15.361 3.954 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.315 -15.583 2.602 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.317 -12.626 1.754 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.796 -13.604 1.907 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.645 -12.074 2.803 1.00 0.00 H new ATOM 359 N SER A 44 -7.536 -16.074 6.071 1.00 0.00 N ATOM 360 CA SER A 44 -6.983 -16.953 7.076 1.00 0.00 C ATOM 361 C SER A 44 -6.619 -18.294 6.453 1.00 0.00 C ATOM 362 O SER A 44 -7.489 -19.092 6.101 1.00 0.00 O ATOM 363 CB SER A 44 -7.973 -17.121 8.232 1.00 0.00 C ATOM 364 OG SER A 44 -9.311 -17.182 7.760 1.00 0.00 O ATOM 0 H SER A 44 -8.419 -16.392 5.672 1.00 0.00 H new ATOM 0 HA SER A 44 -6.071 -16.512 7.479 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.738 -18.030 8.785 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.868 -16.288 8.928 1.00 0.00 H new ATOM 0 HG SER A 44 -9.707 -16.286 7.782 1.00 0.00 H new ATOM 370 N GLN A 45 -5.328 -18.508 6.273 1.00 0.00 N ATOM 371 CA GLN A 45 -4.831 -19.727 5.657 1.00 0.00 C ATOM 372 C GLN A 45 -3.973 -20.502 6.641 1.00 0.00 C ATOM 373 O GLN A 45 -3.109 -19.930 7.302 1.00 0.00 O ATOM 374 CB GLN A 45 -4.004 -19.402 4.416 1.00 0.00 C ATOM 375 CG GLN A 45 -4.796 -18.796 3.269 1.00 0.00 C ATOM 376 CD GLN A 45 -5.829 -19.744 2.689 1.00 0.00 C ATOM 377 OE1 GLN A 45 -5.530 -20.531 1.791 1.00 0.00 O ATOM 378 NE2 GLN A 45 -7.055 -19.667 3.185 1.00 0.00 N ATOM 0 H GLN A 45 -4.599 -17.849 6.547 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.689 -20.334 5.367 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -3.209 -18.711 4.696 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -3.524 -20.316 4.066 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -5.297 -17.893 3.619 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.107 -18.493 2.480 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.263 -19.001 3.929 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.791 -20.273 2.823 1.00 0.00 H new ATOM 387 N SER A 46 -4.208 -21.796 6.738 1.00 0.00 N ATOM 388 CA SER A 46 -3.430 -22.630 7.633 1.00 0.00 C ATOM 389 C SER A 46 -2.133 -23.062 6.958 1.00 0.00 C ATOM 390 O SER A 46 -2.143 -23.578 5.840 1.00 0.00 O ATOM 391 CB SER A 46 -4.241 -23.856 8.067 1.00 0.00 C ATOM 392 OG SER A 46 -3.565 -24.578 9.086 1.00 0.00 O ATOM 0 H SER A 46 -4.928 -22.291 6.211 1.00 0.00 H new ATOM 0 HA SER A 46 -3.184 -22.049 8.522 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.220 -23.540 8.428 1.00 0.00 H new ATOM 0 HB3 SER A 46 -4.413 -24.506 7.209 1.00 0.00 H new ATOM 0 HG SER A 46 -2.990 -23.968 9.593 1.00 0.00 H new ATOM 398 N GLY A 47 -1.021 -22.818 7.636 1.00 0.00 N ATOM 399 CA GLY A 47 0.266 -23.255 7.143 1.00 0.00 C ATOM 400 C GLY A 47 0.840 -22.346 6.076 1.00 0.00 C ATOM 401 O GLY A 47 0.572 -21.140 6.060 1.00 0.00 O ATOM 0 H GLY A 47 -0.989 -22.321 8.526 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.966 -23.312 7.977 1.00 0.00 H new ATOM 0 HA3 GLY A 47 0.169 -24.262 6.738 1.00 0.00 H new ATOM 405 N GLY A 48 1.616 -22.931 5.173 1.00 0.00 N ATOM 406 CA GLY A 48 2.344 -22.155 4.190 1.00 0.00 C ATOM 407 C GLY A 48 1.574 -21.916 2.908 1.00 0.00 C ATOM 408 O GLY A 48 2.142 -21.997 1.816 1.00 0.00 O ATOM 0 H GLY A 48 1.754 -23.939 5.105 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.612 -21.193 4.626 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.276 -22.668 3.953 1.00 0.00 H new ATOM 412 N GLN A 49 0.283 -21.628 3.030 1.00 0.00 N ATOM 413 CA GLN A 49 -0.509 -21.202 1.884 1.00 0.00 C ATOM 414 C GLN A 49 0.038 -19.877 1.375 1.00 0.00 C ATOM 415 O GLN A 49 0.228 -19.679 0.178 1.00 0.00 O ATOM 416 CB GLN A 49 -1.975 -21.046 2.274 1.00 0.00 C ATOM 417 CG GLN A 49 -2.694 -22.358 2.534 1.00 0.00 C ATOM 418 CD GLN A 49 -2.923 -23.151 1.265 1.00 0.00 C ATOM 419 OE1 GLN A 49 -2.107 -23.992 0.880 1.00 0.00 O ATOM 420 NE2 GLN A 49 -4.035 -22.877 0.597 1.00 0.00 N ATOM 0 H GLN A 49 -0.235 -21.682 3.907 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.445 -21.956 1.100 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.037 -20.427 3.169 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.495 -20.511 1.480 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.110 -22.957 3.233 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -3.653 -22.156 3.011 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.683 -22.173 0.952 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.243 -23.370 -0.272 1.00 0.00 H new ATOM 429 N ILE A 50 0.284 -18.976 2.314 1.00 0.00 N ATOM 430 CA ILE A 50 0.954 -17.724 2.022 1.00 0.00 C ATOM 431 C ILE A 50 2.368 -17.780 2.585 1.00 0.00 C ATOM 432 O ILE A 50 2.559 -17.829 3.803 1.00 0.00 O ATOM 433 CB ILE A 50 0.204 -16.495 2.610 1.00 0.00 C ATOM 434 CG1 ILE A 50 -1.034 -16.143 1.773 1.00 0.00 C ATOM 435 CG2 ILE A 50 1.124 -15.284 2.702 1.00 0.00 C ATOM 436 CD1 ILE A 50 -2.151 -17.157 1.845 1.00 0.00 C ATOM 0 H ILE A 50 0.025 -19.094 3.294 1.00 0.00 H new ATOM 0 HA ILE A 50 0.972 -17.598 0.939 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.121 -16.767 3.614 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.416 -15.177 2.102 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.732 -16.028 0.732 1.00 0.00 H new ATOM 0 HG21 ILE A 50 0.573 -14.439 3.116 1.00 0.00 H new ATOM 0 HG22 ILE A 50 1.970 -15.518 3.348 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.488 -15.027 1.707 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.983 -16.826 1.224 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.791 -18.121 1.486 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.486 -17.257 2.877 1.00 0.00 H new ATOM 448 N SER A 51 3.349 -17.815 1.699 1.00 0.00 N ATOM 449 CA SER A 51 4.744 -17.853 2.107 1.00 0.00 C ATOM 450 C SER A 51 5.511 -16.717 1.443 1.00 0.00 C ATOM 451 O SER A 51 6.381 -16.093 2.049 1.00 0.00 O ATOM 452 CB SER A 51 5.359 -19.209 1.749 1.00 0.00 C ATOM 453 OG SER A 51 5.105 -19.545 0.392 1.00 0.00 O ATOM 0 H SER A 51 3.205 -17.818 0.689 1.00 0.00 H new ATOM 0 HA SER A 51 4.806 -17.724 3.188 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.434 -19.182 1.925 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.949 -19.981 2.401 1.00 0.00 H new ATOM 0 HG SER A 51 5.510 -20.414 0.189 1.00 0.00 H new ATOM 459 N SER A 52 5.169 -16.451 0.194 1.00 0.00 N ATOM 460 CA SER A 52 5.755 -15.356 -0.552 1.00 0.00 C ATOM 461 C SER A 52 4.797 -14.167 -0.542 1.00 0.00 C ATOM 462 O SER A 52 3.582 -14.349 -0.403 1.00 0.00 O ATOM 463 CB SER A 52 6.033 -15.817 -1.990 1.00 0.00 C ATOM 464 OG SER A 52 6.591 -14.780 -2.780 1.00 0.00 O ATOM 0 H SER A 52 4.478 -16.989 -0.329 1.00 0.00 H new ATOM 0 HA SER A 52 6.695 -15.050 -0.093 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.715 -16.667 -1.973 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.105 -16.162 -2.446 1.00 0.00 H new ATOM 0 HG SER A 52 6.755 -15.112 -3.687 1.00 0.00 H new ATOM 470 N PRO A 53 5.323 -12.929 -0.657 1.00 0.00 N ATOM 471 CA PRO A 53 4.491 -11.730 -0.810 1.00 0.00 C ATOM 472 C PRO A 53 3.461 -11.900 -1.921 1.00 0.00 C ATOM 473 O PRO A 53 2.364 -11.337 -1.863 1.00 0.00 O ATOM 474 CB PRO A 53 5.500 -10.642 -1.183 1.00 0.00 C ATOM 475 CG PRO A 53 6.786 -11.093 -0.585 1.00 0.00 C ATOM 476 CD PRO A 53 6.762 -12.600 -0.616 1.00 0.00 C ATOM 0 HA PRO A 53 3.920 -11.504 0.090 1.00 0.00 H new ATOM 0 HB2 PRO A 53 5.583 -10.534 -2.264 1.00 0.00 H new ATOM 0 HB3 PRO A 53 5.199 -9.672 -0.788 1.00 0.00 H new ATOM 0 HG2 PRO A 53 7.634 -10.706 -1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 53 6.889 -10.727 0.436 1.00 0.00 H new ATOM 0 HD2 PRO A 53 7.287 -12.991 -1.488 1.00 0.00 H new ATOM 0 HD3 PRO A 53 7.245 -13.026 0.264 1.00 0.00 H new ATOM 484 N SER A 54 3.825 -12.697 -2.923 1.00 0.00 N ATOM 485 CA SER A 54 2.943 -13.001 -4.036 1.00 0.00 C ATOM 486 C SER A 54 1.669 -13.672 -3.526 1.00 0.00 C ATOM 487 O SER A 54 0.567 -13.199 -3.798 1.00 0.00 O ATOM 488 CB SER A 54 3.662 -13.915 -5.034 1.00 0.00 C ATOM 489 OG SER A 54 3.116 -13.799 -6.340 1.00 0.00 O ATOM 0 H SER A 54 4.738 -13.147 -2.982 1.00 0.00 H new ATOM 0 HA SER A 54 2.671 -12.074 -4.540 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.722 -13.664 -5.059 1.00 0.00 H new ATOM 0 HB3 SER A 54 3.588 -14.950 -4.699 1.00 0.00 H new ATOM 0 HG SER A 54 2.145 -13.927 -6.301 1.00 0.00 H new ATOM 495 N ASP A 55 1.836 -14.743 -2.745 1.00 0.00 N ATOM 496 CA ASP A 55 0.700 -15.504 -2.218 1.00 0.00 C ATOM 497 C ASP A 55 -0.237 -14.588 -1.450 1.00 0.00 C ATOM 498 O ASP A 55 -1.453 -14.604 -1.650 1.00 0.00 O ATOM 499 CB ASP A 55 1.160 -16.617 -1.266 1.00 0.00 C ATOM 500 CG ASP A 55 2.198 -17.545 -1.857 1.00 0.00 C ATOM 501 OD1 ASP A 55 1.977 -18.075 -2.963 1.00 0.00 O ATOM 502 OD2 ASP A 55 3.250 -17.747 -1.207 1.00 0.00 O ATOM 0 H ASP A 55 2.748 -15.103 -2.464 1.00 0.00 H new ATOM 0 HA ASP A 55 0.189 -15.947 -3.073 1.00 0.00 H new ATOM 0 HB2 ASP A 55 1.567 -16.163 -0.363 1.00 0.00 H new ATOM 0 HB3 ASP A 55 0.293 -17.204 -0.965 1.00 0.00 H new ATOM 507 N LEU A 56 0.354 -13.784 -0.576 1.00 0.00 N ATOM 508 CA LEU A 56 -0.401 -12.893 0.290 1.00 0.00 C ATOM 509 C LEU A 56 -1.250 -11.916 -0.513 1.00 0.00 C ATOM 510 O LEU A 56 -2.475 -11.890 -0.391 1.00 0.00 O ATOM 511 CB LEU A 56 0.557 -12.117 1.198 1.00 0.00 C ATOM 512 CG LEU A 56 -0.109 -11.131 2.160 1.00 0.00 C ATOM 513 CD1 LEU A 56 -1.038 -11.859 3.114 1.00 0.00 C ATOM 514 CD2 LEU A 56 0.941 -10.347 2.931 1.00 0.00 C ATOM 0 H LEU A 56 1.365 -13.732 -0.449 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.071 -13.504 0.895 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.138 -12.832 1.781 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.261 -11.569 0.572 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.702 -10.428 1.575 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.502 -11.140 3.790 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.812 -12.374 2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.468 -12.586 3.693 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.449 -9.651 3.610 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.561 -11.036 3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 56 1.566 -9.791 2.232 1.00 0.00 H new ATOM 526 N ARG A 57 -0.597 -11.129 -1.350 1.00 0.00 N ATOM 527 CA ARG A 57 -1.265 -10.026 -2.018 1.00 0.00 C ATOM 528 C ARG A 57 -2.138 -10.495 -3.175 1.00 0.00 C ATOM 529 O ARG A 57 -3.090 -9.808 -3.543 1.00 0.00 O ATOM 530 CB ARG A 57 -0.241 -8.993 -2.480 1.00 0.00 C ATOM 531 CG ARG A 57 0.501 -8.348 -1.318 1.00 0.00 C ATOM 532 CD ARG A 57 1.512 -7.323 -1.790 1.00 0.00 C ATOM 533 NE ARG A 57 0.890 -6.217 -2.514 1.00 0.00 N ATOM 534 CZ ARG A 57 1.134 -4.935 -2.255 1.00 0.00 C ATOM 535 NH1 ARG A 57 1.861 -4.595 -1.194 1.00 0.00 N ATOM 536 NH2 ARG A 57 0.610 -3.991 -3.029 1.00 0.00 N ATOM 0 H ARG A 57 0.391 -11.232 -1.583 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.934 -9.558 -1.296 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.478 -9.471 -3.145 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.746 -8.219 -3.059 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.216 -7.870 -0.651 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.010 -9.119 -0.740 1.00 0.00 H new ATOM 0 HD2 ARG A 57 2.055 -6.931 -0.930 1.00 0.00 H new ATOM 0 HD3 ARG A 57 2.244 -7.809 -2.435 1.00 0.00 H new ATOM 0 HE ARG A 57 0.231 -6.440 -3.260 1.00 0.00 H new ATOM 0 HH11 ARG A 57 2.232 -5.318 -0.577 1.00 0.00 H new ATOM 0 HH12 ARG A 57 2.047 -3.612 -0.997 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.021 -4.249 -3.821 1.00 0.00 H new ATOM 0 HH22 ARG A 57 0.796 -3.008 -2.831 1.00 0.00 H new ATOM 550 N GLU A 58 -1.844 -11.663 -3.739 1.00 0.00 N ATOM 551 CA GLU A 58 -2.676 -12.196 -4.811 1.00 0.00 C ATOM 552 C GLU A 58 -4.012 -12.692 -4.271 1.00 0.00 C ATOM 553 O GLU A 58 -5.036 -12.548 -4.931 1.00 0.00 O ATOM 554 CB GLU A 58 -1.968 -13.308 -5.587 1.00 0.00 C ATOM 555 CG GLU A 58 -0.883 -12.793 -6.522 1.00 0.00 C ATOM 556 CD GLU A 58 -0.353 -13.862 -7.453 1.00 0.00 C ATOM 557 OE1 GLU A 58 -0.983 -14.102 -8.508 1.00 0.00 O ATOM 558 OE2 GLU A 58 0.695 -14.466 -7.141 1.00 0.00 O ATOM 0 H GLU A 58 -1.051 -12.249 -3.477 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.863 -11.377 -5.505 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.526 -14.010 -4.880 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.705 -13.862 -6.168 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.281 -11.968 -7.113 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.060 -12.393 -5.930 1.00 0.00 H new ATOM 565 N LYS A 59 -4.010 -13.251 -3.064 1.00 0.00 N ATOM 566 CA LYS A 59 -5.253 -13.679 -2.434 1.00 0.00 C ATOM 567 C LYS A 59 -6.065 -12.459 -2.010 1.00 0.00 C ATOM 568 O LYS A 59 -7.289 -12.434 -2.142 1.00 0.00 O ATOM 569 CB LYS A 59 -4.962 -14.590 -1.233 1.00 0.00 C ATOM 570 CG LYS A 59 -6.191 -14.943 -0.403 1.00 0.00 C ATOM 571 CD LYS A 59 -7.267 -15.645 -1.223 1.00 0.00 C ATOM 572 CE LYS A 59 -6.852 -17.049 -1.633 1.00 0.00 C ATOM 573 NZ LYS A 59 -7.928 -17.734 -2.399 1.00 0.00 N ATOM 0 H LYS A 59 -3.171 -13.416 -2.508 1.00 0.00 H new ATOM 0 HA LYS A 59 -5.838 -14.252 -3.154 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -4.504 -15.511 -1.593 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -4.231 -14.101 -0.589 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -5.893 -15.585 0.426 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -6.606 -14.033 0.032 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -8.189 -15.695 -0.643 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -7.483 -15.057 -2.115 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.947 -17.000 -2.239 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.609 -17.632 -0.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -7.556 -18.616 -2.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -8.721 -17.954 -1.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -8.260 -17.112 -3.163 1.00 0.00 H new ATOM 587 N LEU A 60 -5.368 -11.441 -1.517 1.00 0.00 N ATOM 588 CA LEU A 60 -6.006 -10.180 -1.161 1.00 0.00 C ATOM 589 C LEU A 60 -6.645 -9.543 -2.390 1.00 0.00 C ATOM 590 O LEU A 60 -7.802 -9.127 -2.357 1.00 0.00 O ATOM 591 CB LEU A 60 -4.983 -9.220 -0.554 1.00 0.00 C ATOM 592 CG LEU A 60 -4.368 -9.674 0.770 1.00 0.00 C ATOM 593 CD1 LEU A 60 -3.224 -8.758 1.163 1.00 0.00 C ATOM 594 CD2 LEU A 60 -5.423 -9.696 1.865 1.00 0.00 C ATOM 0 H LEU A 60 -4.361 -11.465 -1.355 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.782 -10.384 -0.424 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.180 -9.067 -1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.463 -8.253 -0.401 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.978 -10.684 0.641 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.797 -9.094 2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.457 -8.781 0.389 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -3.596 -7.739 1.275 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.969 -10.021 2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.837 -8.696 1.991 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.220 -10.387 1.589 1.00 0.00 H new ATOM 606 N SER A 61 -5.885 -9.487 -3.477 1.00 0.00 N ATOM 607 CA SER A 61 -6.372 -8.924 -4.726 1.00 0.00 C ATOM 608 C SER A 61 -7.514 -9.771 -5.283 1.00 0.00 C ATOM 609 O SER A 61 -8.499 -9.240 -5.799 1.00 0.00 O ATOM 610 CB SER A 61 -5.228 -8.841 -5.742 1.00 0.00 C ATOM 611 OG SER A 61 -5.644 -8.208 -6.939 1.00 0.00 O ATOM 0 H SER A 61 -4.924 -9.827 -3.516 1.00 0.00 H new ATOM 0 HA SER A 61 -6.750 -7.919 -4.535 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.394 -8.290 -5.308 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.865 -9.844 -5.966 1.00 0.00 H new ATOM 0 HG SER A 61 -5.807 -7.257 -6.767 1.00 0.00 H new ATOM 617 N GLU A 62 -7.375 -11.087 -5.161 1.00 0.00 N ATOM 618 CA GLU A 62 -8.389 -12.024 -5.624 1.00 0.00 C ATOM 619 C GLU A 62 -9.738 -11.710 -4.990 1.00 0.00 C ATOM 620 O GLU A 62 -10.737 -11.534 -5.690 1.00 0.00 O ATOM 621 CB GLU A 62 -7.968 -13.455 -5.282 1.00 0.00 C ATOM 622 CG GLU A 62 -8.891 -14.527 -5.833 1.00 0.00 C ATOM 623 CD GLU A 62 -8.470 -15.915 -5.398 1.00 0.00 C ATOM 624 OE1 GLU A 62 -7.546 -16.484 -6.015 1.00 0.00 O ATOM 625 OE2 GLU A 62 -9.044 -16.433 -4.421 1.00 0.00 O ATOM 0 H GLU A 62 -6.559 -11.531 -4.740 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.486 -11.927 -6.705 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.962 -13.627 -5.665 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.918 -13.557 -4.198 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.910 -14.335 -5.498 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.898 -14.475 -6.922 1.00 0.00 H new ATOM 632 N LEU A 63 -9.752 -11.612 -3.667 1.00 0.00 N ATOM 633 CA LEU A 63 -10.978 -11.331 -2.934 1.00 0.00 C ATOM 634 C LEU A 63 -11.474 -9.915 -3.209 1.00 0.00 C ATOM 635 O LEU A 63 -12.676 -9.686 -3.315 1.00 0.00 O ATOM 636 CB LEU A 63 -10.766 -11.527 -1.432 1.00 0.00 C ATOM 637 CG LEU A 63 -10.403 -12.949 -1.002 1.00 0.00 C ATOM 638 CD1 LEU A 63 -10.246 -13.022 0.509 1.00 0.00 C ATOM 639 CD2 LEU A 63 -11.459 -13.937 -1.472 1.00 0.00 C ATOM 0 H LEU A 63 -8.926 -11.723 -3.079 1.00 0.00 H new ATOM 0 HA LEU A 63 -11.737 -12.034 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -9.975 -10.853 -1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.676 -11.229 -0.912 1.00 0.00 H new ATOM 0 HG LEU A 63 -9.453 -13.215 -1.465 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.988 -14.040 0.799 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -9.455 -12.343 0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -11.183 -12.735 0.986 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -11.182 -14.943 -1.156 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -12.423 -13.673 -1.038 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -11.529 -13.905 -2.559 1.00 0.00 H new ATOM 651 N ALA A 64 -10.547 -8.972 -3.333 1.00 0.00 N ATOM 652 CA ALA A 64 -10.901 -7.577 -3.577 1.00 0.00 C ATOM 653 C ALA A 64 -11.654 -7.416 -4.896 1.00 0.00 C ATOM 654 O ALA A 64 -12.707 -6.772 -4.950 1.00 0.00 O ATOM 655 CB ALA A 64 -9.656 -6.705 -3.568 1.00 0.00 C ATOM 0 H ALA A 64 -9.544 -9.147 -3.269 1.00 0.00 H new ATOM 0 HA ALA A 64 -11.563 -7.255 -2.773 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.937 -5.668 -3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.165 -6.782 -2.598 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.972 -7.039 -4.348 1.00 0.00 H new ATOM 661 N ASP A 65 -11.119 -8.012 -5.954 1.00 0.00 N ATOM 662 CA ASP A 65 -11.765 -7.964 -7.262 1.00 0.00 C ATOM 663 C ASP A 65 -13.041 -8.797 -7.268 1.00 0.00 C ATOM 664 O ASP A 65 -13.984 -8.498 -8.002 1.00 0.00 O ATOM 665 CB ASP A 65 -10.816 -8.444 -8.364 1.00 0.00 C ATOM 666 CG ASP A 65 -9.838 -7.370 -8.805 1.00 0.00 C ATOM 667 OD1 ASP A 65 -10.212 -6.538 -9.659 1.00 0.00 O ATOM 668 OD2 ASP A 65 -8.690 -7.359 -8.314 1.00 0.00 O ATOM 0 H ASP A 65 -10.242 -8.533 -5.934 1.00 0.00 H new ATOM 0 HA ASP A 65 -12.027 -6.925 -7.463 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.260 -9.311 -8.007 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -11.401 -8.772 -9.223 1.00 0.00 H new ATOM 673 N ALA A 66 -13.072 -9.839 -6.444 1.00 0.00 N ATOM 674 CA ALA A 66 -14.262 -10.674 -6.310 1.00 0.00 C ATOM 675 C ALA A 66 -15.391 -9.898 -5.638 1.00 0.00 C ATOM 676 O ALA A 66 -16.556 -10.021 -6.018 1.00 0.00 O ATOM 677 CB ALA A 66 -13.944 -11.939 -5.524 1.00 0.00 C ATOM 0 H ALA A 66 -12.287 -10.126 -5.859 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.590 -10.963 -7.309 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.844 -12.548 -5.435 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -13.172 -12.506 -6.044 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.588 -11.670 -4.529 1.00 0.00 H new ATOM 683 N LYS A 67 -15.038 -9.095 -4.639 1.00 0.00 N ATOM 684 CA LYS A 67 -16.008 -8.250 -3.951 1.00 0.00 C ATOM 685 C LYS A 67 -16.539 -7.176 -4.893 1.00 0.00 C ATOM 686 O LYS A 67 -17.741 -6.914 -4.941 1.00 0.00 O ATOM 687 CB LYS A 67 -15.377 -7.585 -2.724 1.00 0.00 C ATOM 688 CG LYS A 67 -15.004 -8.553 -1.614 1.00 0.00 C ATOM 689 CD LYS A 67 -16.226 -9.253 -1.046 1.00 0.00 C ATOM 690 CE LYS A 67 -15.866 -10.076 0.178 1.00 0.00 C ATOM 691 NZ LYS A 67 -17.052 -10.744 0.773 1.00 0.00 N ATOM 0 H LYS A 67 -14.084 -9.012 -4.287 1.00 0.00 H new ATOM 0 HA LYS A 67 -16.833 -8.884 -3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -14.483 -7.046 -3.036 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -16.073 -6.845 -2.327 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -14.305 -9.296 -1.998 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.491 -8.014 -0.818 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -16.982 -8.514 -0.781 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.665 -9.899 -1.806 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -15.127 -10.829 -0.097 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -15.402 -9.431 0.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -16.759 -11.294 1.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -17.747 -10.026 1.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -17.481 -11.380 0.071 1.00 0.00 H new ATOM 705 N GLY A 68 -15.634 -6.561 -5.637 1.00 0.00 N ATOM 706 CA GLY A 68 -16.022 -5.520 -6.566 1.00 0.00 C ATOM 707 C GLY A 68 -15.379 -4.190 -6.235 1.00 0.00 C ATOM 708 O GLY A 68 -16.019 -3.141 -6.320 1.00 0.00 O ATOM 0 H GLY A 68 -14.635 -6.764 -5.614 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.742 -5.815 -7.577 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.106 -5.410 -6.554 1.00 0.00 H new ATOM 712 N GLY A 69 -14.113 -4.236 -5.842 1.00 0.00 N ATOM 713 CA GLY A 69 -13.383 -3.024 -5.538 1.00 0.00 C ATOM 714 C GLY A 69 -12.078 -2.957 -6.298 1.00 0.00 C ATOM 715 O GLY A 69 -11.549 -3.984 -6.718 1.00 0.00 O ATOM 0 H GLY A 69 -13.577 -5.097 -5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -13.995 -2.157 -5.787 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -13.184 -2.977 -4.467 1.00 0.00 H new ATOM 719 N LYS A 70 -11.558 -1.755 -6.480 1.00 0.00 N ATOM 720 CA LYS A 70 -10.323 -1.566 -7.230 1.00 0.00 C ATOM 721 C LYS A 70 -9.135 -1.437 -6.284 1.00 0.00 C ATOM 722 O LYS A 70 -7.989 -1.694 -6.658 1.00 0.00 O ATOM 723 CB LYS A 70 -10.417 -0.315 -8.105 1.00 0.00 C ATOM 724 CG LYS A 70 -11.562 -0.342 -9.104 1.00 0.00 C ATOM 725 CD LYS A 70 -11.590 0.929 -9.938 1.00 0.00 C ATOM 726 CE LYS A 70 -12.681 0.884 -10.992 1.00 0.00 C ATOM 727 NZ LYS A 70 -12.625 2.062 -11.897 1.00 0.00 N ATOM 0 H LYS A 70 -11.970 -0.894 -6.120 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.177 -2.439 -7.866 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.531 0.558 -7.462 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.479 -0.192 -8.647 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.458 -1.208 -9.758 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -12.508 -0.454 -8.575 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.748 1.788 -9.287 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.623 1.069 -10.421 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -12.582 -0.030 -11.578 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.655 0.846 -10.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -13.386 1.994 -12.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -12.745 2.933 -11.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -11.705 2.084 -12.381 1.00 0.00 H new ATOM 741 N TYR A 71 -9.421 -1.050 -5.052 1.00 0.00 N ATOM 742 CA TYR A 71 -8.382 -0.776 -4.077 1.00 0.00 C ATOM 743 C TYR A 71 -8.584 -1.649 -2.849 1.00 0.00 C ATOM 744 O TYR A 71 -9.686 -2.142 -2.611 1.00 0.00 O ATOM 745 CB TYR A 71 -8.419 0.701 -3.664 1.00 0.00 C ATOM 746 CG TYR A 71 -8.657 1.662 -4.812 1.00 0.00 C ATOM 747 CD1 TYR A 71 -7.603 2.166 -5.561 1.00 0.00 C ATOM 748 CD2 TYR A 71 -9.948 2.060 -5.147 1.00 0.00 C ATOM 749 CE1 TYR A 71 -7.827 3.040 -6.611 1.00 0.00 C ATOM 750 CE2 TYR A 71 -10.180 2.929 -6.195 1.00 0.00 C ATOM 751 CZ TYR A 71 -9.117 3.417 -6.923 1.00 0.00 C ATOM 752 OH TYR A 71 -9.345 4.283 -7.969 1.00 0.00 O ATOM 0 H TYR A 71 -10.370 -0.918 -4.703 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.414 -0.997 -4.526 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -9.204 0.839 -2.921 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -7.475 0.955 -3.182 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -6.592 1.872 -5.321 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -10.784 1.682 -4.577 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -6.996 3.425 -7.183 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -11.189 3.224 -6.442 1.00 0.00 H new ATOM 0 HH TYR A 71 -10.160 4.798 -7.795 1.00 0.00 H new ATOM 762 N TYR A 72 -7.526 -1.850 -2.086 1.00 0.00 N ATOM 763 CA TYR A 72 -7.630 -2.524 -0.802 1.00 0.00 C ATOM 764 C TYR A 72 -6.512 -2.051 0.112 1.00 0.00 C ATOM 765 O TYR A 72 -5.569 -1.403 -0.344 1.00 0.00 O ATOM 766 CB TYR A 72 -7.590 -4.055 -0.961 1.00 0.00 C ATOM 767 CG TYR A 72 -6.234 -4.626 -1.329 1.00 0.00 C ATOM 768 CD1 TYR A 72 -5.851 -4.768 -2.657 1.00 0.00 C ATOM 769 CD2 TYR A 72 -5.344 -5.037 -0.343 1.00 0.00 C ATOM 770 CE1 TYR A 72 -4.621 -5.301 -2.990 1.00 0.00 C ATOM 771 CE2 TYR A 72 -4.112 -5.567 -0.670 1.00 0.00 C ATOM 772 CZ TYR A 72 -3.755 -5.697 -1.993 1.00 0.00 C ATOM 773 OH TYR A 72 -2.530 -6.228 -2.319 1.00 0.00 O ATOM 0 H TYR A 72 -6.581 -1.556 -2.333 1.00 0.00 H new ATOM 0 HA TYR A 72 -8.592 -2.271 -0.357 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -7.918 -4.511 -0.027 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -8.309 -4.345 -1.727 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.525 -4.457 -3.441 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -5.621 -4.940 0.696 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -4.339 -5.407 -4.027 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -3.431 -5.878 0.109 1.00 0.00 H new ATOM 0 HH TYR A 72 -2.043 -6.454 -1.499 1.00 0.00 H new ATOM 783 N HIS A 73 -6.622 -2.350 1.394 1.00 0.00 N ATOM 784 CA HIS A 73 -5.579 -1.990 2.340 1.00 0.00 C ATOM 785 C HIS A 73 -5.540 -2.971 3.502 1.00 0.00 C ATOM 786 O HIS A 73 -6.563 -3.229 4.137 1.00 0.00 O ATOM 787 CB HIS A 73 -5.793 -0.569 2.868 1.00 0.00 C ATOM 788 CG HIS A 73 -4.719 -0.122 3.813 1.00 0.00 C ATOM 789 ND1 HIS A 73 -4.977 0.336 5.085 1.00 0.00 N ATOM 790 CD2 HIS A 73 -3.375 -0.080 3.667 1.00 0.00 C ATOM 791 CE1 HIS A 73 -3.840 0.637 5.680 1.00 0.00 C ATOM 792 NE2 HIS A 73 -2.848 0.393 4.842 1.00 0.00 N ATOM 0 H HIS A 73 -7.418 -2.839 1.803 1.00 0.00 H new ATOM 0 HA HIS A 73 -4.625 -2.031 1.815 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.837 0.122 2.026 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -6.757 -0.518 3.374 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -2.819 -0.366 2.787 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -3.736 1.019 6.685 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -1.856 0.533 5.036 1.00 0.00 H new ATOM 801 N ILE A 74 -4.358 -3.513 3.770 1.00 0.00 N ATOM 802 CA ILE A 74 -4.165 -4.411 4.897 1.00 0.00 C ATOM 803 C ILE A 74 -4.233 -3.632 6.206 1.00 0.00 C ATOM 804 O ILE A 74 -3.478 -2.676 6.409 1.00 0.00 O ATOM 805 CB ILE A 74 -2.805 -5.136 4.817 1.00 0.00 C ATOM 806 CG1 ILE A 74 -2.673 -5.886 3.488 1.00 0.00 C ATOM 807 CG2 ILE A 74 -2.639 -6.096 5.990 1.00 0.00 C ATOM 808 CD1 ILE A 74 -1.313 -6.520 3.281 1.00 0.00 C ATOM 0 H ILE A 74 -3.517 -3.344 3.218 1.00 0.00 H new ATOM 0 HA ILE A 74 -4.960 -5.155 4.861 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.014 -4.388 4.871 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.437 -6.662 3.441 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -2.870 -5.194 2.669 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -1.674 -6.598 5.916 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -2.688 -5.539 6.926 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -3.437 -6.839 5.968 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.293 -7.033 2.320 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.545 -5.747 3.295 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.121 -7.237 4.079 1.00 0.00 H new ATOM 820 N ILE A 75 -5.145 -4.028 7.080 1.00 0.00 N ATOM 821 CA ILE A 75 -5.274 -3.390 8.382 1.00 0.00 C ATOM 822 C ILE A 75 -4.639 -4.257 9.462 1.00 0.00 C ATOM 823 O ILE A 75 -4.273 -3.770 10.532 1.00 0.00 O ATOM 824 CB ILE A 75 -6.750 -3.098 8.740 1.00 0.00 C ATOM 825 CG1 ILE A 75 -7.566 -4.394 8.795 1.00 0.00 C ATOM 826 CG2 ILE A 75 -7.352 -2.126 7.733 1.00 0.00 C ATOM 827 CD1 ILE A 75 -9.006 -4.189 9.212 1.00 0.00 C ATOM 0 H ILE A 75 -5.806 -4.787 6.913 1.00 0.00 H new ATOM 0 HA ILE A 75 -4.750 -2.435 8.329 1.00 0.00 H new ATOM 0 HB ILE A 75 -6.781 -2.640 9.729 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -7.545 -4.868 7.814 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.090 -5.083 9.492 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -8.391 -1.928 7.995 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -6.790 -1.192 7.748 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -7.306 -2.561 6.735 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -9.520 -5.150 9.228 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -9.037 -3.744 10.207 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.499 -3.525 8.502 1.00 0.00 H new ATOM 839 N ALA A 76 -4.488 -5.542 9.162 1.00 0.00 N ATOM 840 CA ALA A 76 -3.856 -6.477 10.078 1.00 0.00 C ATOM 841 C ALA A 76 -3.306 -7.675 9.318 1.00 0.00 C ATOM 842 O ALA A 76 -3.999 -8.262 8.492 1.00 0.00 O ATOM 843 CB ALA A 76 -4.842 -6.933 11.145 1.00 0.00 C ATOM 0 H ALA A 76 -4.798 -5.960 8.285 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.028 -5.968 10.571 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.349 -7.632 11.821 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.193 -6.069 11.710 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.691 -7.425 10.670 1.00 0.00 H new ATOM 849 N ALA A 77 -2.063 -8.025 9.592 1.00 0.00 N ATOM 850 CA ALA A 77 -1.430 -9.171 8.958 1.00 0.00 C ATOM 851 C ALA A 77 -0.569 -9.895 9.976 1.00 0.00 C ATOM 852 O ALA A 77 0.518 -9.435 10.322 1.00 0.00 O ATOM 853 CB ALA A 77 -0.598 -8.741 7.759 1.00 0.00 C ATOM 0 H ALA A 77 -1.466 -7.529 10.254 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.204 -9.847 8.595 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.136 -9.617 7.304 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.240 -8.248 7.029 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.179 -8.049 8.084 1.00 0.00 H new ATOM 859 N ARG A 78 -1.064 -11.014 10.472 1.00 0.00 N ATOM 860 CA ARG A 78 -0.417 -11.689 11.582 1.00 0.00 C ATOM 861 C ARG A 78 -0.378 -13.195 11.395 1.00 0.00 C ATOM 862 O ARG A 78 -1.211 -13.779 10.703 1.00 0.00 O ATOM 863 CB ARG A 78 -1.153 -11.381 12.889 1.00 0.00 C ATOM 864 CG ARG A 78 -2.610 -11.823 12.877 1.00 0.00 C ATOM 865 CD ARG A 78 -3.133 -12.086 14.281 1.00 0.00 C ATOM 866 NE ARG A 78 -3.077 -10.899 15.132 1.00 0.00 N ATOM 867 CZ ARG A 78 -2.386 -10.831 16.270 1.00 0.00 C ATOM 868 NH1 ARG A 78 -1.627 -11.853 16.654 1.00 0.00 N ATOM 869 NH2 ARG A 78 -2.443 -9.730 17.006 1.00 0.00 N ATOM 0 H ARG A 78 -1.907 -11.473 10.126 1.00 0.00 H new ATOM 0 HA ARG A 78 0.607 -11.318 11.621 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -0.638 -11.874 13.713 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.107 -10.309 13.080 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.219 -11.055 12.401 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -2.710 -12.727 12.277 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.163 -12.438 14.221 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.549 -12.885 14.739 1.00 0.00 H new ATOM 0 HE ARG A 78 -3.598 -10.073 14.837 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -1.572 -12.692 16.077 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -1.100 -11.797 17.525 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -3.013 -8.941 16.701 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -1.917 -9.672 17.878 1.00 0.00 H new ATOM 883 N GLU A 79 0.605 -13.811 12.025 1.00 0.00 N ATOM 884 CA GLU A 79 0.628 -15.250 12.188 1.00 0.00 C ATOM 885 C GLU A 79 -0.070 -15.586 13.491 1.00 0.00 C ATOM 886 O GLU A 79 0.270 -15.041 14.543 1.00 0.00 O ATOM 887 CB GLU A 79 2.065 -15.774 12.197 1.00 0.00 C ATOM 888 CG GLU A 79 2.729 -15.738 10.834 1.00 0.00 C ATOM 889 CD GLU A 79 4.225 -15.953 10.907 1.00 0.00 C ATOM 890 OE1 GLU A 79 4.666 -16.934 11.539 1.00 0.00 O ATOM 891 OE2 GLU A 79 4.974 -15.141 10.325 1.00 0.00 O ATOM 0 H GLU A 79 1.405 -13.330 12.436 1.00 0.00 H new ATOM 0 HA GLU A 79 0.114 -15.726 11.353 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.655 -15.182 12.896 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.067 -16.799 12.567 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.286 -16.505 10.199 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.527 -14.777 10.361 1.00 0.00 H new ATOM 898 N HIS A 80 -1.061 -16.449 13.428 1.00 0.00 N ATOM 899 CA HIS A 80 -1.874 -16.745 14.591 1.00 0.00 C ATOM 900 C HIS A 80 -2.009 -18.250 14.757 1.00 0.00 C ATOM 901 O HIS A 80 -2.922 -18.868 14.212 1.00 0.00 O ATOM 902 CB HIS A 80 -3.246 -16.088 14.436 1.00 0.00 C ATOM 903 CG HIS A 80 -3.967 -15.845 15.725 1.00 0.00 C ATOM 904 ND1 HIS A 80 -5.313 -15.578 15.783 1.00 0.00 N ATOM 905 CD2 HIS A 80 -3.520 -15.784 17.001 1.00 0.00 C ATOM 906 CE1 HIS A 80 -5.666 -15.364 17.033 1.00 0.00 C ATOM 907 NE2 HIS A 80 -4.596 -15.481 17.797 1.00 0.00 N ATOM 0 H HIS A 80 -1.324 -16.959 12.585 1.00 0.00 H new ATOM 0 HA HIS A 80 -1.396 -16.344 15.485 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -3.123 -15.137 13.918 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -3.867 -16.719 13.800 1.00 0.00 H new ATOM 0 HD1 HIS A 80 -5.942 -15.550 14.981 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.504 -15.944 17.332 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -6.663 -15.132 17.376 1.00 0.00 H new ATOM 916 N GLY A 81 -1.061 -18.839 15.469 1.00 0.00 N ATOM 917 CA GLY A 81 -1.070 -20.270 15.661 1.00 0.00 C ATOM 918 C GLY A 81 -0.652 -20.990 14.400 1.00 0.00 C ATOM 919 O GLY A 81 0.380 -20.664 13.812 1.00 0.00 O ATOM 0 H GLY A 81 -0.286 -18.350 15.917 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -0.396 -20.535 16.475 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -2.068 -20.594 15.955 1.00 0.00 H new ATOM 923 N PRO A 82 -1.441 -21.971 13.948 1.00 0.00 N ATOM 924 CA PRO A 82 -1.190 -22.672 12.699 1.00 0.00 C ATOM 925 C PRO A 82 -1.851 -21.984 11.503 1.00 0.00 C ATOM 926 O PRO A 82 -1.956 -22.566 10.422 1.00 0.00 O ATOM 927 CB PRO A 82 -1.828 -24.032 12.953 1.00 0.00 C ATOM 928 CG PRO A 82 -2.978 -23.749 13.863 1.00 0.00 C ATOM 929 CD PRO A 82 -2.634 -22.499 14.638 1.00 0.00 C ATOM 0 HA PRO A 82 -0.130 -22.713 12.446 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.163 -24.492 12.023 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.120 -24.722 13.413 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.896 -23.608 13.292 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.149 -24.587 14.539 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.454 -21.781 14.623 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.424 -22.722 15.684 1.00 0.00 H new ATOM 937 N ASN A 83 -2.300 -20.750 11.702 1.00 0.00 N ATOM 938 CA ASN A 83 -2.973 -20.004 10.647 1.00 0.00 C ATOM 939 C ASN A 83 -2.325 -18.646 10.435 1.00 0.00 C ATOM 940 O ASN A 83 -1.856 -18.010 11.378 1.00 0.00 O ATOM 941 CB ASN A 83 -4.458 -19.799 10.967 1.00 0.00 C ATOM 942 CG ASN A 83 -5.285 -21.058 10.800 1.00 0.00 C ATOM 943 OD1 ASN A 83 -5.730 -21.378 9.697 1.00 0.00 O ATOM 944 ND2 ASN A 83 -5.526 -21.761 11.893 1.00 0.00 N ATOM 0 H ASN A 83 -2.210 -20.246 12.584 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.881 -20.596 9.736 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -4.556 -19.441 11.992 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -4.859 -19.020 10.318 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -6.100 -22.603 11.842 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.138 -21.462 12.788 1.00 0.00 H new ATOM 951 N PHE A 84 -2.295 -18.218 9.187 1.00 0.00 N ATOM 952 CA PHE A 84 -1.841 -16.887 8.831 1.00 0.00 C ATOM 953 C PHE A 84 -3.060 -16.031 8.499 1.00 0.00 C ATOM 954 O PHE A 84 -3.841 -16.384 7.612 1.00 0.00 O ATOM 955 CB PHE A 84 -0.886 -16.956 7.632 1.00 0.00 C ATOM 956 CG PHE A 84 -0.232 -15.640 7.288 1.00 0.00 C ATOM 957 CD1 PHE A 84 -0.889 -14.705 6.500 1.00 0.00 C ATOM 958 CD2 PHE A 84 1.039 -15.340 7.755 1.00 0.00 C ATOM 959 CE1 PHE A 84 -0.290 -13.499 6.187 1.00 0.00 C ATOM 960 CE2 PHE A 84 1.641 -14.136 7.445 1.00 0.00 C ATOM 961 CZ PHE A 84 0.975 -13.214 6.660 1.00 0.00 C ATOM 0 H PHE A 84 -2.585 -18.785 8.390 1.00 0.00 H new ATOM 0 HA PHE A 84 -1.299 -16.442 9.666 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -0.109 -17.691 7.842 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -1.437 -17.314 6.762 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.879 -14.922 6.127 1.00 0.00 H new ATOM 0 HD2 PHE A 84 1.565 -16.057 8.369 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -0.812 -12.780 5.573 1.00 0.00 H new ATOM 0 HE2 PHE A 84 2.631 -13.915 7.816 1.00 0.00 H new ATOM 0 HZ PHE A 84 1.444 -12.272 6.417 1.00 0.00 H new ATOM 971 N GLU A 85 -3.233 -14.928 9.215 1.00 0.00 N ATOM 972 CA GLU A 85 -4.414 -14.090 9.044 1.00 0.00 C ATOM 973 C GLU A 85 -4.056 -12.731 8.458 1.00 0.00 C ATOM 974 O GLU A 85 -3.307 -11.957 9.058 1.00 0.00 O ATOM 975 CB GLU A 85 -5.145 -13.894 10.374 1.00 0.00 C ATOM 976 CG GLU A 85 -5.746 -15.169 10.941 1.00 0.00 C ATOM 977 CD GLU A 85 -6.526 -14.924 12.215 1.00 0.00 C ATOM 978 OE1 GLU A 85 -5.905 -14.834 13.291 1.00 0.00 O ATOM 979 OE2 GLU A 85 -7.767 -14.808 12.152 1.00 0.00 O ATOM 0 H GLU A 85 -2.574 -14.593 9.917 1.00 0.00 H new ATOM 0 HA GLU A 85 -5.072 -14.607 8.346 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -4.449 -13.477 11.102 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -5.939 -13.160 10.236 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -6.403 -15.619 10.197 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -4.949 -15.886 11.139 1.00 0.00 H new ATOM 986 N ALA A 86 -4.597 -12.456 7.284 1.00 0.00 N ATOM 987 CA ALA A 86 -4.438 -11.165 6.640 1.00 0.00 C ATOM 988 C ALA A 86 -5.795 -10.497 6.470 1.00 0.00 C ATOM 989 O ALA A 86 -6.636 -10.964 5.702 1.00 0.00 O ATOM 990 CB ALA A 86 -3.752 -11.323 5.295 1.00 0.00 C ATOM 0 H ALA A 86 -5.158 -13.121 6.751 1.00 0.00 H new ATOM 0 HA ALA A 86 -3.813 -10.533 7.271 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.641 -10.345 4.826 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -2.768 -11.770 5.439 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.353 -11.967 4.653 1.00 0.00 H new ATOM 996 N VAL A 87 -6.010 -9.421 7.202 1.00 0.00 N ATOM 997 CA VAL A 87 -7.275 -8.706 7.162 1.00 0.00 C ATOM 998 C VAL A 87 -7.119 -7.405 6.385 1.00 0.00 C ATOM 999 O VAL A 87 -6.281 -6.563 6.722 1.00 0.00 O ATOM 1000 CB VAL A 87 -7.795 -8.392 8.581 1.00 0.00 C ATOM 1001 CG1 VAL A 87 -9.192 -7.790 8.525 1.00 0.00 C ATOM 1002 CG2 VAL A 87 -7.776 -9.641 9.452 1.00 0.00 C ATOM 0 H VAL A 87 -5.320 -9.019 7.837 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.000 -9.351 6.664 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.129 -7.656 9.031 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -9.537 -7.577 9.537 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -9.167 -6.866 7.948 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -9.874 -8.496 8.050 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.147 -9.396 10.447 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -8.412 -10.405 9.006 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.756 -10.017 9.527 1.00 0.00 H new ATOM 1012 N ALA A 88 -7.919 -7.246 5.344 1.00 0.00 N ATOM 1013 CA ALA A 88 -7.852 -6.063 4.505 1.00 0.00 C ATOM 1014 C ALA A 88 -9.249 -5.559 4.174 1.00 0.00 C ATOM 1015 O ALA A 88 -10.207 -6.328 4.162 1.00 0.00 O ATOM 1016 CB ALA A 88 -7.085 -6.370 3.227 1.00 0.00 C ATOM 0 H ALA A 88 -8.625 -7.925 5.059 1.00 0.00 H new ATOM 0 HA ALA A 88 -7.326 -5.281 5.052 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.041 -5.476 2.605 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.073 -6.688 3.478 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.591 -7.167 2.681 1.00 0.00 H new ATOM 1022 N GLU A 89 -9.367 -4.266 3.923 1.00 0.00 N ATOM 1023 CA GLU A 89 -10.635 -3.698 3.501 1.00 0.00 C ATOM 1024 C GLU A 89 -10.587 -3.369 2.018 1.00 0.00 C ATOM 1025 O GLU A 89 -9.566 -2.900 1.513 1.00 0.00 O ATOM 1026 CB GLU A 89 -10.971 -2.443 4.305 1.00 0.00 C ATOM 1027 CG GLU A 89 -11.044 -2.678 5.804 1.00 0.00 C ATOM 1028 CD GLU A 89 -11.556 -1.468 6.556 1.00 0.00 C ATOM 1029 OE1 GLU A 89 -11.052 -0.352 6.311 1.00 0.00 O ATOM 1030 OE2 GLU A 89 -12.458 -1.626 7.402 1.00 0.00 O ATOM 0 H GLU A 89 -8.604 -3.593 4.004 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.416 -4.436 3.682 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -10.219 -1.680 4.102 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -11.927 -2.047 3.961 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.696 -3.529 6.004 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.054 -2.941 6.176 1.00 0.00 H new ATOM 1037 N VAL A 90 -11.682 -3.631 1.327 1.00 0.00 N ATOM 1038 CA VAL A 90 -11.769 -3.371 -0.100 1.00 0.00 C ATOM 1039 C VAL A 90 -12.383 -1.997 -0.337 1.00 0.00 C ATOM 1040 O VAL A 90 -13.361 -1.628 0.315 1.00 0.00 O ATOM 1041 CB VAL A 90 -12.622 -4.445 -0.815 1.00 0.00 C ATOM 1042 CG1 VAL A 90 -12.606 -4.240 -2.323 1.00 0.00 C ATOM 1043 CG2 VAL A 90 -12.140 -5.843 -0.455 1.00 0.00 C ATOM 0 H VAL A 90 -12.529 -4.027 1.734 1.00 0.00 H new ATOM 0 HA VAL A 90 -10.760 -3.403 -0.511 1.00 0.00 H new ATOM 0 HB VAL A 90 -13.652 -4.340 -0.473 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -13.213 -5.009 -2.801 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -13.012 -3.257 -2.561 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -11.581 -4.308 -2.689 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -12.754 -6.583 -0.969 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -11.100 -5.959 -0.760 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -12.221 -5.990 0.622 1.00 0.00 H new ATOM 1053 N TYR A 91 -11.807 -1.242 -1.259 1.00 0.00 N ATOM 1054 CA TYR A 91 -12.275 0.104 -1.549 1.00 0.00 C ATOM 1055 C TYR A 91 -12.534 0.281 -3.040 1.00 0.00 C ATOM 1056 O TYR A 91 -11.982 -0.444 -3.871 1.00 0.00 O ATOM 1057 CB TYR A 91 -11.249 1.143 -1.097 1.00 0.00 C ATOM 1058 CG TYR A 91 -10.859 1.041 0.356 1.00 0.00 C ATOM 1059 CD1 TYR A 91 -11.691 1.524 1.359 1.00 0.00 C ATOM 1060 CD2 TYR A 91 -9.649 0.470 0.723 1.00 0.00 C ATOM 1061 CE1 TYR A 91 -11.322 1.442 2.690 1.00 0.00 C ATOM 1062 CE2 TYR A 91 -9.276 0.381 2.048 1.00 0.00 C ATOM 1063 CZ TYR A 91 -10.113 0.867 3.028 1.00 0.00 C ATOM 1064 OH TYR A 91 -9.729 0.792 4.348 1.00 0.00 O ATOM 0 H TYR A 91 -11.011 -1.541 -1.822 1.00 0.00 H new ATOM 0 HA TYR A 91 -13.206 0.251 -1.002 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -10.353 1.041 -1.709 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -11.651 2.139 -1.284 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -12.639 1.970 1.096 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -8.988 0.089 -0.041 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -11.975 1.825 3.460 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -8.331 -0.068 2.316 1.00 0.00 H new ATOM 0 HH TYR A 91 -10.412 0.311 4.860 1.00 0.00 H new ATOM 1074 N ASN A 92 -13.372 1.247 -3.367 1.00 0.00 N ATOM 1075 CA ASN A 92 -13.641 1.608 -4.751 1.00 0.00 C ATOM 1076 C ASN A 92 -13.873 3.115 -4.818 1.00 0.00 C ATOM 1077 O ASN A 92 -13.928 3.776 -3.779 1.00 0.00 O ATOM 1078 CB ASN A 92 -14.869 0.844 -5.273 1.00 0.00 C ATOM 1079 CG ASN A 92 -14.874 0.667 -6.786 1.00 0.00 C ATOM 1080 OD1 ASN A 92 -14.361 1.499 -7.533 1.00 0.00 O ATOM 1081 ND2 ASN A 92 -15.449 -0.434 -7.248 1.00 0.00 N ATOM 0 H ASN A 92 -13.886 1.804 -2.684 1.00 0.00 H new ATOM 0 HA ASN A 92 -12.792 1.339 -5.380 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -14.905 -0.137 -4.800 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -15.772 1.376 -4.974 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -15.476 -0.613 -8.252 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -15.865 -1.103 -6.600 1.00 0.00 H new ATOM 1088 N ASP A 93 -13.998 3.656 -6.019 1.00 0.00 N ATOM 1089 CA ASP A 93 -14.227 5.088 -6.189 1.00 0.00 C ATOM 1090 C ASP A 93 -15.652 5.439 -5.787 1.00 0.00 C ATOM 1091 O ASP A 93 -16.506 4.559 -5.666 1.00 0.00 O ATOM 1092 CB ASP A 93 -13.988 5.513 -7.640 1.00 0.00 C ATOM 1093 CG ASP A 93 -12.621 5.116 -8.160 1.00 0.00 C ATOM 1094 OD1 ASP A 93 -11.634 5.826 -7.873 1.00 0.00 O ATOM 1095 OD2 ASP A 93 -12.534 4.102 -8.885 1.00 0.00 O ATOM 0 H ASP A 93 -13.945 3.129 -6.891 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.524 5.621 -5.549 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -14.754 5.067 -8.274 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -14.100 6.594 -7.718 1.00 0.00 H new ATOM 1100 N ALA A 94 -15.916 6.723 -5.584 1.00 0.00 N ATOM 1101 CA ALA A 94 -17.248 7.168 -5.204 1.00 0.00 C ATOM 1102 C ALA A 94 -18.181 7.180 -6.412 1.00 0.00 C ATOM 1103 O ALA A 94 -18.446 8.230 -7.000 1.00 0.00 O ATOM 1104 CB ALA A 94 -17.192 8.542 -4.552 1.00 0.00 C ATOM 0 H ALA A 94 -15.228 7.471 -5.676 1.00 0.00 H new ATOM 0 HA ALA A 94 -17.646 6.462 -4.475 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -18.199 8.855 -4.276 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -16.569 8.496 -3.659 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -16.768 9.261 -5.253 1.00 0.00 H new ATOM 1110 N THR A 95 -18.648 6.003 -6.796 1.00 0.00 N ATOM 1111 CA THR A 95 -19.543 5.865 -7.930 1.00 0.00 C ATOM 1112 C THR A 95 -20.171 4.471 -7.919 1.00 0.00 C ATOM 1113 O THR A 95 -19.874 3.666 -7.036 1.00 0.00 O ATOM 1114 CB THR A 95 -18.795 6.113 -9.264 1.00 0.00 C ATOM 1115 OG1 THR A 95 -19.728 6.234 -10.347 1.00 0.00 O ATOM 1116 CG2 THR A 95 -17.804 4.992 -9.564 1.00 0.00 C ATOM 0 H THR A 95 -18.419 5.123 -6.333 1.00 0.00 H new ATOM 0 HA THR A 95 -20.330 6.615 -7.847 1.00 0.00 H new ATOM 0 HB THR A 95 -18.239 7.045 -9.160 1.00 0.00 H new ATOM 0 HG1 THR A 95 -19.241 6.392 -11.182 1.00 0.00 H new ATOM 0 HG21 THR A 95 -17.297 5.197 -10.507 1.00 0.00 H new ATOM 0 HG22 THR A 95 -17.069 4.932 -8.762 1.00 0.00 H new ATOM 0 HG23 THR A 95 -18.338 4.045 -9.638 1.00 0.00 H new ATOM 1124 N LYS A 96 -21.040 4.203 -8.896 1.00 0.00 N ATOM 1125 CA LYS A 96 -21.739 2.920 -9.004 1.00 0.00 C ATOM 1126 C LYS A 96 -22.599 2.663 -7.773 1.00 0.00 C ATOM 1127 O LYS A 96 -22.753 1.520 -7.330 1.00 0.00 O ATOM 1128 CB LYS A 96 -20.754 1.763 -9.211 1.00 0.00 C ATOM 1129 CG LYS A 96 -19.953 1.865 -10.497 1.00 0.00 C ATOM 1130 CD LYS A 96 -19.301 0.541 -10.857 1.00 0.00 C ATOM 1131 CE LYS A 96 -20.344 -0.535 -11.112 1.00 0.00 C ATOM 1132 NZ LYS A 96 -19.736 -1.817 -11.554 1.00 0.00 N ATOM 0 H LYS A 96 -21.279 4.867 -9.633 1.00 0.00 H new ATOM 0 HA LYS A 96 -22.388 2.975 -9.878 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -20.066 1.728 -8.367 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -21.306 0.823 -9.211 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -20.607 2.182 -11.309 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -19.186 2.631 -10.388 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.681 0.668 -11.745 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.640 0.226 -10.049 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -20.919 -0.703 -10.202 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -21.044 -0.187 -11.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -20.486 -2.519 -11.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -19.208 -1.665 -12.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -19.088 -2.165 -10.819 1.00 0.00 H new ATOM 1146 N LEU A 97 -23.164 3.731 -7.230 1.00 0.00 N ATOM 1147 CA LEU A 97 -24.044 3.630 -6.079 1.00 0.00 C ATOM 1148 C LEU A 97 -25.382 3.042 -6.497 1.00 0.00 C ATOM 1149 O LEU A 97 -25.916 3.385 -7.555 1.00 0.00 O ATOM 1150 CB LEU A 97 -24.247 5.004 -5.436 1.00 0.00 C ATOM 1151 CG LEU A 97 -22.971 5.667 -4.912 1.00 0.00 C ATOM 1152 CD1 LEU A 97 -23.285 7.034 -4.332 1.00 0.00 C ATOM 1153 CD2 LEU A 97 -22.298 4.786 -3.870 1.00 0.00 C ATOM 0 H LEU A 97 -23.027 4.682 -7.572 1.00 0.00 H new ATOM 0 HA LEU A 97 -23.582 2.971 -5.344 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -24.709 5.667 -6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -24.951 4.902 -4.610 1.00 0.00 H new ATOM 0 HG LEU A 97 -22.282 5.796 -5.747 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -22.367 7.492 -3.964 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -23.721 7.666 -5.106 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -23.992 6.927 -3.510 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -21.393 5.275 -3.510 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -22.980 4.624 -3.035 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -22.039 3.827 -4.318 1.00 0.00 H new ATOM 1165 N GLU A 98 -25.911 2.156 -5.671 1.00 0.00 N ATOM 1166 CA GLU A 98 -27.148 1.465 -5.987 1.00 0.00 C ATOM 1167 C GLU A 98 -28.308 2.456 -6.061 1.00 0.00 C ATOM 1168 O GLU A 98 -28.511 3.266 -5.155 1.00 0.00 O ATOM 1169 CB GLU A 98 -27.423 0.376 -4.949 1.00 0.00 C ATOM 1170 CG GLU A 98 -28.501 -0.604 -5.373 1.00 0.00 C ATOM 1171 CD GLU A 98 -28.601 -1.794 -4.446 1.00 0.00 C ATOM 1172 OE1 GLU A 98 -27.881 -2.787 -4.668 1.00 0.00 O ATOM 1173 OE2 GLU A 98 -29.413 -1.747 -3.502 1.00 0.00 O ATOM 0 H GLU A 98 -25.501 1.898 -4.773 1.00 0.00 H new ATOM 0 HA GLU A 98 -27.048 0.990 -6.963 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -26.501 -0.172 -4.755 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -27.718 0.845 -4.011 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -29.462 -0.090 -5.404 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -28.293 -0.952 -6.385 1.00 0.00 H new ATOM 1180 N HIS A 99 -29.062 2.383 -7.148 1.00 0.00 N ATOM 1181 CA HIS A 99 -30.117 3.349 -7.427 1.00 0.00 C ATOM 1182 C HIS A 99 -31.454 2.644 -7.645 1.00 0.00 C ATOM 1183 O HIS A 99 -31.581 1.787 -8.518 1.00 0.00 O ATOM 1184 CB HIS A 99 -29.746 4.216 -8.647 1.00 0.00 C ATOM 1185 CG HIS A 99 -29.270 3.442 -9.846 1.00 0.00 C ATOM 1186 ND1 HIS A 99 -30.018 3.282 -10.990 1.00 0.00 N ATOM 1187 CD2 HIS A 99 -28.106 2.782 -10.073 1.00 0.00 C ATOM 1188 CE1 HIS A 99 -29.343 2.558 -11.861 1.00 0.00 C ATOM 1189 NE2 HIS A 99 -28.177 2.241 -11.332 1.00 0.00 N ATOM 0 H HIS A 99 -28.962 1.658 -7.858 1.00 0.00 H new ATOM 0 HA HIS A 99 -30.221 4.004 -6.562 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -30.616 4.806 -8.934 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -28.967 4.919 -8.353 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -27.275 2.698 -9.388 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -29.687 2.272 -12.844 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -27.450 1.686 -11.783 1.00 0.00 H new ATOM 1198 N HIS A 100 -32.445 3.001 -6.834 1.00 0.00 N ATOM 1199 CA HIS A 100 -33.757 2.360 -6.896 1.00 0.00 C ATOM 1200 C HIS A 100 -34.874 3.372 -7.126 1.00 0.00 C ATOM 1201 O HIS A 100 -36.045 3.067 -6.899 1.00 0.00 O ATOM 1202 CB HIS A 100 -34.048 1.598 -5.602 1.00 0.00 C ATOM 1203 CG HIS A 100 -33.143 0.436 -5.347 1.00 0.00 C ATOM 1204 ND1 HIS A 100 -33.192 -0.732 -6.076 1.00 0.00 N ATOM 1205 CD2 HIS A 100 -32.177 0.257 -4.420 1.00 0.00 C ATOM 1206 CE1 HIS A 100 -32.298 -1.579 -5.605 1.00 0.00 C ATOM 1207 NE2 HIS A 100 -31.670 -1.002 -4.600 1.00 0.00 N ATOM 0 H HIS A 100 -32.366 3.731 -6.126 1.00 0.00 H new ATOM 0 HA HIS A 100 -33.728 1.670 -7.739 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -33.974 2.290 -4.764 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -35.077 1.241 -5.630 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -31.863 0.974 -3.675 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -32.112 -2.575 -5.979 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -30.926 -1.425 -4.046 1.00 0.00 H new ATOM 1216 N HIS A 101 -34.523 4.569 -7.576 1.00 0.00 N ATOM 1217 CA HIS A 101 -35.524 5.608 -7.808 1.00 0.00 C ATOM 1218 C HIS A 101 -36.385 5.271 -9.019 1.00 0.00 C ATOM 1219 O HIS A 101 -35.877 5.076 -10.122 1.00 0.00 O ATOM 1220 CB HIS A 101 -34.868 6.980 -7.973 1.00 0.00 C ATOM 1221 CG HIS A 101 -34.451 7.587 -6.669 1.00 0.00 C ATOM 1222 ND1 HIS A 101 -33.162 7.998 -6.395 1.00 0.00 N ATOM 1223 CD2 HIS A 101 -35.171 7.846 -5.551 1.00 0.00 C ATOM 1224 CE1 HIS A 101 -33.110 8.476 -5.165 1.00 0.00 C ATOM 1225 NE2 HIS A 101 -34.314 8.396 -4.636 1.00 0.00 N ATOM 0 H HIS A 101 -33.564 4.846 -7.787 1.00 0.00 H new ATOM 0 HA HIS A 101 -36.171 5.650 -6.931 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -33.995 6.885 -8.619 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -35.564 7.652 -8.475 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -36.224 7.654 -5.408 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -32.230 8.866 -4.676 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -34.567 8.696 -3.695 1.00 0.00 H new ATOM 1234 N HIS A 102 -37.690 5.197 -8.793 1.00 0.00 N ATOM 1235 CA HIS A 102 -38.632 4.767 -9.819 1.00 0.00 C ATOM 1236 C HIS A 102 -39.310 5.953 -10.492 1.00 0.00 C ATOM 1237 O HIS A 102 -39.444 5.988 -11.715 1.00 0.00 O ATOM 1238 CB HIS A 102 -39.713 3.868 -9.211 1.00 0.00 C ATOM 1239 CG HIS A 102 -39.184 2.660 -8.503 1.00 0.00 C ATOM 1240 ND1 HIS A 102 -39.299 2.475 -7.145 1.00 0.00 N ATOM 1241 CD2 HIS A 102 -38.552 1.564 -8.978 1.00 0.00 C ATOM 1242 CE1 HIS A 102 -38.756 1.319 -6.815 1.00 0.00 C ATOM 1243 NE2 HIS A 102 -38.295 0.743 -7.908 1.00 0.00 N ATOM 0 H HIS A 102 -38.124 5.431 -7.900 1.00 0.00 H new ATOM 0 HA HIS A 102 -38.060 4.215 -10.565 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -40.305 4.456 -8.509 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -40.387 3.544 -10.004 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -38.296 1.370 -10.009 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -38.699 0.912 -5.816 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -37.826 -0.162 -7.951 1.00 0.00 H new ATOM 1252 N HIS A 103 -39.729 6.926 -9.689 1.00 0.00 N ATOM 1253 CA HIS A 103 -40.577 8.010 -10.175 1.00 0.00 C ATOM 1254 C HIS A 103 -39.761 9.063 -10.923 1.00 0.00 C ATOM 1255 O HIS A 103 -39.519 10.158 -10.411 1.00 0.00 O ATOM 1256 CB HIS A 103 -41.344 8.648 -9.008 1.00 0.00 C ATOM 1257 CG HIS A 103 -42.460 9.561 -9.426 1.00 0.00 C ATOM 1258 ND1 HIS A 103 -43.761 9.135 -9.584 1.00 0.00 N ATOM 1259 CD2 HIS A 103 -42.469 10.888 -9.700 1.00 0.00 C ATOM 1260 CE1 HIS A 103 -44.518 10.154 -9.938 1.00 0.00 C ATOM 1261 NE2 HIS A 103 -43.761 11.231 -10.014 1.00 0.00 N ATOM 0 H HIS A 103 -39.495 6.986 -8.698 1.00 0.00 H new ATOM 0 HA HIS A 103 -41.295 7.588 -10.879 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -41.754 7.856 -8.382 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -40.642 9.210 -8.392 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -41.618 11.553 -9.676 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -45.579 10.114 -10.133 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -44.083 12.166 -10.265 1.00 0.00 H new ATOM 1270 N HIS A 104 -39.326 8.707 -12.126 1.00 0.00 N ATOM 1271 CA HIS A 104 -38.632 9.629 -13.013 1.00 0.00 C ATOM 1272 C HIS A 104 -38.371 8.950 -14.350 1.00 0.00 C ATOM 1273 O HIS A 104 -39.265 8.977 -15.219 1.00 0.00 O ATOM 1274 CB HIS A 104 -37.305 10.100 -12.405 1.00 0.00 C ATOM 1275 CG HIS A 104 -36.714 11.270 -13.127 1.00 0.00 C ATOM 1276 ND1 HIS A 104 -35.496 11.235 -13.773 1.00 0.00 N ATOM 1277 CD2 HIS A 104 -37.194 12.520 -13.306 1.00 0.00 C ATOM 1278 CE1 HIS A 104 -35.257 12.414 -14.318 1.00 0.00 C ATOM 1279 NE2 HIS A 104 -36.274 13.208 -14.048 1.00 0.00 N ATOM 1280 OXT HIS A 104 -37.280 8.382 -14.522 1.00 0.00 O ATOM 0 H HIS A 104 -39.445 7.771 -12.513 1.00 0.00 H new ATOM 0 HA HIS A 104 -39.266 10.504 -13.157 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -37.465 10.368 -11.361 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -36.593 9.275 -12.417 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -38.131 12.905 -12.932 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -34.379 12.682 -14.887 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -36.361 14.180 -14.345 1.00 0.00 H new TER 1289 HIS A 104 ATOM 1290 N ALA B 22 8.823 -0.537 -8.515 1.00 0.00 N ATOM 1291 CA ALA B 22 8.591 -0.093 -7.125 1.00 0.00 C ATOM 1292 C ALA B 22 7.206 -0.507 -6.653 1.00 0.00 C ATOM 1293 O ALA B 22 6.200 -0.190 -7.291 1.00 0.00 O ATOM 1294 CB ALA B 22 8.769 1.410 -7.007 1.00 0.00 C ATOM 0 HA ALA B 22 9.329 -0.577 -6.485 1.00 0.00 H new ATOM 0 HB1 ALA B 22 8.594 1.717 -5.976 1.00 0.00 H new ATOM 0 HB2 ALA B 22 9.784 1.680 -7.299 1.00 0.00 H new ATOM 0 HB3 ALA B 22 8.057 1.913 -7.661 1.00 0.00 H new ATOM 1302 N GLU B 23 7.166 -1.213 -5.532 1.00 0.00 N ATOM 1303 CA GLU B 23 5.924 -1.746 -4.995 1.00 0.00 C ATOM 1304 C GLU B 23 5.587 -1.073 -3.664 1.00 0.00 C ATOM 1305 O GLU B 23 6.469 -0.838 -2.834 1.00 0.00 O ATOM 1306 CB GLU B 23 6.026 -3.268 -4.803 1.00 0.00 C ATOM 1307 CG GLU B 23 6.207 -4.067 -6.096 1.00 0.00 C ATOM 1308 CD GLU B 23 7.596 -3.941 -6.703 1.00 0.00 C ATOM 1309 OE1 GLU B 23 8.555 -4.490 -6.125 1.00 0.00 O ATOM 1310 OE2 GLU B 23 7.732 -3.306 -7.775 1.00 0.00 O ATOM 0 H GLU B 23 7.990 -1.431 -4.972 1.00 0.00 H new ATOM 0 HA GLU B 23 5.127 -1.537 -5.708 1.00 0.00 H new ATOM 0 HB2 GLU B 23 6.865 -3.481 -4.140 1.00 0.00 H new ATOM 0 HB3 GLU B 23 5.125 -3.618 -4.299 1.00 0.00 H new ATOM 0 HG2 GLU B 23 6.002 -5.118 -5.895 1.00 0.00 H new ATOM 0 HG3 GLU B 23 5.470 -3.733 -6.826 1.00 0.00 H new ATOM 1317 N GLN B 24 4.313 -0.760 -3.466 1.00 0.00 N ATOM 1318 CA GLN B 24 3.869 -0.108 -2.239 1.00 0.00 C ATOM 1319 C GLN B 24 3.399 -1.139 -1.216 1.00 0.00 C ATOM 1320 O GLN B 24 2.454 -1.892 -1.462 1.00 0.00 O ATOM 1321 CB GLN B 24 2.749 0.895 -2.536 1.00 0.00 C ATOM 1322 CG GLN B 24 2.217 1.608 -1.299 1.00 0.00 C ATOM 1323 CD GLN B 24 1.286 2.757 -1.641 1.00 0.00 C ATOM 1324 OE1 GLN B 24 1.440 3.406 -2.672 1.00 0.00 O ATOM 1325 NE2 GLN B 24 0.308 3.011 -0.782 1.00 0.00 N ATOM 0 H GLN B 24 3.569 -0.947 -4.138 1.00 0.00 H new ATOM 0 HA GLN B 24 4.717 0.432 -1.818 1.00 0.00 H new ATOM 0 HB2 GLN B 24 3.118 1.639 -3.242 1.00 0.00 H new ATOM 0 HB3 GLN B 24 1.926 0.373 -3.025 1.00 0.00 H new ATOM 0 HG2 GLN B 24 1.688 0.891 -0.671 1.00 0.00 H new ATOM 0 HG3 GLN B 24 3.055 1.987 -0.714 1.00 0.00 H new ATOM 0 HE21 GLN B 24 0.213 2.449 0.064 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -0.350 3.768 -0.967 1.00 0.00 H new ATOM 1334 N VAL B 25 4.068 -1.165 -0.072 1.00 0.00 N ATOM 1335 CA VAL B 25 3.742 -2.105 0.994 1.00 0.00 C ATOM 1336 C VAL B 25 3.320 -1.365 2.262 1.00 0.00 C ATOM 1337 O VAL B 25 3.698 -0.210 2.472 1.00 0.00 O ATOM 1338 CB VAL B 25 4.936 -3.034 1.321 1.00 0.00 C ATOM 1339 CG1 VAL B 25 5.219 -3.979 0.163 1.00 0.00 C ATOM 1340 CG2 VAL B 25 6.178 -2.221 1.657 1.00 0.00 C ATOM 0 H VAL B 25 4.846 -0.541 0.144 1.00 0.00 H new ATOM 0 HA VAL B 25 2.913 -2.715 0.636 1.00 0.00 H new ATOM 0 HB VAL B 25 4.668 -3.630 2.194 1.00 0.00 H new ATOM 0 HG11 VAL B 25 6.062 -4.622 0.416 1.00 0.00 H new ATOM 0 HG12 VAL B 25 4.339 -4.593 -0.029 1.00 0.00 H new ATOM 0 HG13 VAL B 25 5.459 -3.400 -0.729 1.00 0.00 H new ATOM 0 HG21 VAL B 25 7.004 -2.895 1.883 1.00 0.00 H new ATOM 0 HG22 VAL B 25 6.444 -1.594 0.806 1.00 0.00 H new ATOM 0 HG23 VAL B 25 5.977 -1.590 2.523 1.00 0.00 H new ATOM 1350 N SER B 26 2.526 -2.022 3.093 1.00 0.00 N ATOM 1351 CA SER B 26 2.079 -1.433 4.346 1.00 0.00 C ATOM 1352 C SER B 26 3.020 -1.785 5.496 1.00 0.00 C ATOM 1353 O SER B 26 3.931 -2.603 5.348 1.00 0.00 O ATOM 1354 CB SER B 26 0.653 -1.881 4.669 1.00 0.00 C ATOM 1355 OG SER B 26 -0.278 -1.310 3.765 1.00 0.00 O ATOM 0 H SER B 26 2.177 -2.965 2.922 1.00 0.00 H new ATOM 0 HA SER B 26 2.090 -0.350 4.226 1.00 0.00 H new ATOM 0 HB2 SER B 26 0.591 -2.968 4.622 1.00 0.00 H new ATOM 0 HB3 SER B 26 0.399 -1.591 5.689 1.00 0.00 H new ATOM 0 HG SER B 26 -0.840 -2.017 3.384 1.00 0.00 H new ATOM 1361 N LYS B 27 2.774 -1.164 6.648 1.00 0.00 N ATOM 1362 CA LYS B 27 3.613 -1.332 7.834 1.00 0.00 C ATOM 1363 C LYS B 27 3.704 -2.797 8.262 1.00 0.00 C ATOM 1364 O LYS B 27 4.740 -3.243 8.758 1.00 0.00 O ATOM 1365 CB LYS B 27 3.063 -0.470 8.978 1.00 0.00 C ATOM 1366 CG LYS B 27 1.564 -0.635 9.196 1.00 0.00 C ATOM 1367 CD LYS B 27 1.012 0.341 10.227 1.00 0.00 C ATOM 1368 CE LYS B 27 1.509 0.035 11.630 1.00 0.00 C ATOM 1369 NZ LYS B 27 0.808 0.859 12.651 1.00 0.00 N ATOM 0 H LYS B 27 1.987 -0.530 6.786 1.00 0.00 H new ATOM 0 HA LYS B 27 4.623 -1.006 7.586 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.587 -0.726 9.899 1.00 0.00 H new ATOM 0 HB3 LYS B 27 3.279 0.578 8.769 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.045 -0.490 8.249 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.358 -1.655 9.520 1.00 0.00 H new ATOM 0 HD2 LYS B 27 1.300 1.356 9.955 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -0.077 0.304 10.213 1.00 0.00 H new ATOM 0 HE2 LYS B 27 1.357 -1.022 11.848 1.00 0.00 H new ATOM 0 HE3 LYS B 27 2.582 0.221 11.685 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 1.172 0.624 13.596 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 0.974 1.867 12.457 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -0.213 0.663 12.615 1.00 0.00 H new ATOM 1383 N GLN B 28 2.626 -3.541 8.058 1.00 0.00 N ATOM 1384 CA GLN B 28 2.595 -4.955 8.408 1.00 0.00 C ATOM 1385 C GLN B 28 3.520 -5.753 7.494 1.00 0.00 C ATOM 1386 O GLN B 28 4.222 -6.661 7.942 1.00 0.00 O ATOM 1387 CB GLN B 28 1.167 -5.513 8.319 1.00 0.00 C ATOM 1388 CG GLN B 28 0.162 -4.796 9.208 1.00 0.00 C ATOM 1389 CD GLN B 28 -0.503 -3.609 8.528 1.00 0.00 C ATOM 1390 OE1 GLN B 28 0.071 -2.972 7.642 1.00 0.00 O ATOM 1391 NE2 GLN B 28 -1.714 -3.293 8.949 1.00 0.00 N ATOM 0 H GLN B 28 1.760 -3.189 7.651 1.00 0.00 H new ATOM 0 HA GLN B 28 2.942 -5.051 9.437 1.00 0.00 H new ATOM 0 HB2 GLN B 28 0.829 -5.452 7.285 1.00 0.00 H new ATOM 0 HB3 GLN B 28 1.184 -6.569 8.587 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -0.606 -5.504 9.521 1.00 0.00 H new ATOM 0 HG3 GLN B 28 0.666 -4.453 10.111 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -2.158 -3.843 9.684 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -2.205 -2.499 8.539 1.00 0.00 H new ATOM 1400 N GLU B 29 3.532 -5.391 6.217 1.00 0.00 N ATOM 1401 CA GLU B 29 4.374 -6.063 5.238 1.00 0.00 C ATOM 1402 C GLU B 29 5.842 -5.773 5.526 1.00 0.00 C ATOM 1403 O GLU B 29 6.670 -6.683 5.570 1.00 0.00 O ATOM 1404 CB GLU B 29 4.005 -5.609 3.821 1.00 0.00 C ATOM 1405 CG GLU B 29 2.598 -6.007 3.397 1.00 0.00 C ATOM 1406 CD GLU B 29 2.209 -5.437 2.045 1.00 0.00 C ATOM 1407 OE1 GLU B 29 2.477 -6.089 1.012 1.00 0.00 O ATOM 1408 OE2 GLU B 29 1.634 -4.328 2.014 1.00 0.00 O ATOM 0 H GLU B 29 2.966 -4.633 5.835 1.00 0.00 H new ATOM 0 HA GLU B 29 4.210 -7.138 5.309 1.00 0.00 H new ATOM 0 HB2 GLU B 29 4.100 -4.525 3.760 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.721 -6.032 3.116 1.00 0.00 H new ATOM 0 HG2 GLU B 29 2.528 -7.094 3.362 1.00 0.00 H new ATOM 0 HG3 GLU B 29 1.886 -5.666 4.149 1.00 0.00 H new ATOM 1415 N ILE B 30 6.147 -4.500 5.758 1.00 0.00 N ATOM 1416 CA ILE B 30 7.508 -4.067 6.067 1.00 0.00 C ATOM 1417 C ILE B 30 8.073 -4.838 7.258 1.00 0.00 C ATOM 1418 O ILE B 30 9.195 -5.347 7.209 1.00 0.00 O ATOM 1419 CB ILE B 30 7.552 -2.557 6.383 1.00 0.00 C ATOM 1420 CG1 ILE B 30 7.003 -1.753 5.203 1.00 0.00 C ATOM 1421 CG2 ILE B 30 8.974 -2.120 6.713 1.00 0.00 C ATOM 1422 CD1 ILE B 30 6.854 -0.276 5.493 1.00 0.00 C ATOM 0 H ILE B 30 5.464 -3.743 5.738 1.00 0.00 H new ATOM 0 HA ILE B 30 8.116 -4.269 5.185 1.00 0.00 H new ATOM 0 HB ILE B 30 6.926 -2.366 7.255 1.00 0.00 H new ATOM 0 HG12 ILE B 30 7.666 -1.882 4.347 1.00 0.00 H new ATOM 0 HG13 ILE B 30 6.032 -2.159 4.918 1.00 0.00 H new ATOM 0 HG21 ILE B 30 8.985 -1.052 6.933 1.00 0.00 H new ATOM 0 HG22 ILE B 30 9.332 -2.673 7.581 1.00 0.00 H new ATOM 0 HG23 ILE B 30 9.623 -2.321 5.861 1.00 0.00 H new ATOM 0 HD11 ILE B 30 6.460 0.230 4.612 1.00 0.00 H new ATOM 0 HD12 ILE B 30 6.168 -0.137 6.328 1.00 0.00 H new ATOM 0 HD13 ILE B 30 7.827 0.145 5.748 1.00 0.00 H new ATOM 1434 N SER B 31 7.273 -4.940 8.311 1.00 0.00 N ATOM 1435 CA SER B 31 7.700 -5.582 9.546 1.00 0.00 C ATOM 1436 C SER B 31 7.903 -7.086 9.360 1.00 0.00 C ATOM 1437 O SER B 31 8.722 -7.699 10.049 1.00 0.00 O ATOM 1438 CB SER B 31 6.670 -5.323 10.646 1.00 0.00 C ATOM 1439 OG SER B 31 6.431 -3.932 10.798 1.00 0.00 O ATOM 0 H SER B 31 6.318 -4.583 8.333 1.00 0.00 H new ATOM 0 HA SER B 31 8.660 -5.153 9.834 1.00 0.00 H new ATOM 0 HB2 SER B 31 5.737 -5.832 10.404 1.00 0.00 H new ATOM 0 HB3 SER B 31 7.025 -5.740 11.588 1.00 0.00 H new ATOM 0 HG SER B 31 5.828 -3.624 10.089 1.00 0.00 H new ATOM 1445 N HIS B 32 7.170 -7.681 8.425 1.00 0.00 N ATOM 1446 CA HIS B 32 7.249 -9.120 8.215 1.00 0.00 C ATOM 1447 C HIS B 32 8.378 -9.464 7.251 1.00 0.00 C ATOM 1448 O HIS B 32 9.086 -10.450 7.443 1.00 0.00 O ATOM 1449 CB HIS B 32 5.924 -9.669 7.679 1.00 0.00 C ATOM 1450 CG HIS B 32 5.755 -11.147 7.891 1.00 0.00 C ATOM 1451 ND1 HIS B 32 6.176 -12.103 6.988 1.00 0.00 N ATOM 1452 CD2 HIS B 32 5.194 -11.830 8.918 1.00 0.00 C ATOM 1453 CE1 HIS B 32 5.876 -13.305 7.452 1.00 0.00 C ATOM 1454 NE2 HIS B 32 5.282 -13.167 8.621 1.00 0.00 N ATOM 0 H HIS B 32 6.521 -7.194 7.807 1.00 0.00 H new ATOM 0 HA HIS B 32 7.455 -9.584 9.179 1.00 0.00 H new ATOM 0 HB2 HIS B 32 5.101 -9.144 8.164 1.00 0.00 H new ATOM 0 HB3 HIS B 32 5.856 -9.453 6.613 1.00 0.00 H new ATOM 0 HD2 HIS B 32 4.757 -11.401 9.808 1.00 0.00 H new ATOM 0 HE1 HIS B 32 6.083 -14.242 6.956 1.00 0.00 H new ATOM 0 HE2 HIS B 32 4.943 -13.929 9.208 1.00 0.00 H new ATOM 1463 N PHE B 33 8.550 -8.643 6.220 1.00 0.00 N ATOM 1464 CA PHE B 33 9.573 -8.897 5.209 1.00 0.00 C ATOM 1465 C PHE B 33 10.930 -8.357 5.653 1.00 0.00 C ATOM 1466 O PHE B 33 11.936 -8.559 4.971 1.00 0.00 O ATOM 1467 CB PHE B 33 9.174 -8.279 3.862 1.00 0.00 C ATOM 1468 CG PHE B 33 7.847 -8.761 3.341 1.00 0.00 C ATOM 1469 CD1 PHE B 33 7.479 -10.091 3.460 1.00 0.00 C ATOM 1470 CD2 PHE B 33 6.968 -7.881 2.731 1.00 0.00 C ATOM 1471 CE1 PHE B 33 6.260 -10.534 2.984 1.00 0.00 C ATOM 1472 CE2 PHE B 33 5.748 -8.318 2.252 1.00 0.00 C ATOM 1473 CZ PHE B 33 5.393 -9.646 2.379 1.00 0.00 C ATOM 0 H PHE B 33 7.998 -7.800 6.062 1.00 0.00 H new ATOM 0 HA PHE B 33 9.656 -9.977 5.087 1.00 0.00 H new ATOM 0 HB2 PHE B 33 9.140 -7.195 3.966 1.00 0.00 H new ATOM 0 HB3 PHE B 33 9.946 -8.505 3.126 1.00 0.00 H new ATOM 0 HD1 PHE B 33 8.154 -10.791 3.931 1.00 0.00 H new ATOM 0 HD2 PHE B 33 7.240 -6.841 2.629 1.00 0.00 H new ATOM 0 HE1 PHE B 33 5.986 -11.574 3.085 1.00 0.00 H new ATOM 0 HE2 PHE B 33 5.072 -7.621 1.778 1.00 0.00 H new ATOM 0 HZ PHE B 33 4.439 -9.989 2.006 1.00 0.00 H new ATOM 1483 N LYS B 34 10.937 -7.658 6.793 1.00 0.00 N ATOM 1484 CA LYS B 34 12.169 -7.147 7.404 1.00 0.00 C ATOM 1485 C LYS B 34 12.872 -6.164 6.474 1.00 0.00 C ATOM 1486 O LYS B 34 14.102 -6.139 6.391 1.00 0.00 O ATOM 1487 CB LYS B 34 13.111 -8.304 7.759 1.00 0.00 C ATOM 1488 CG LYS B 34 12.485 -9.339 8.677 1.00 0.00 C ATOM 1489 CD LYS B 34 12.029 -8.723 9.988 1.00 0.00 C ATOM 1490 CE LYS B 34 11.364 -9.755 10.883 1.00 0.00 C ATOM 1491 NZ LYS B 34 10.925 -9.170 12.177 1.00 0.00 N ATOM 0 H LYS B 34 10.092 -7.431 7.317 1.00 0.00 H new ATOM 0 HA LYS B 34 11.898 -6.620 8.319 1.00 0.00 H new ATOM 0 HB2 LYS B 34 13.434 -8.794 6.840 1.00 0.00 H new ATOM 0 HB3 LYS B 34 14.004 -7.901 8.236 1.00 0.00 H new ATOM 0 HG2 LYS B 34 11.634 -9.802 8.177 1.00 0.00 H new ATOM 0 HG3 LYS B 34 13.206 -10.131 8.878 1.00 0.00 H new ATOM 0 HD2 LYS B 34 12.885 -8.288 10.505 1.00 0.00 H new ATOM 0 HD3 LYS B 34 11.331 -7.910 9.787 1.00 0.00 H new ATOM 0 HE2 LYS B 34 10.503 -10.181 10.367 1.00 0.00 H new ATOM 0 HE3 LYS B 34 12.059 -10.573 11.072 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 10.477 -9.908 12.757 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 11.749 -8.786 12.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 10.242 -8.407 11.999 1.00 0.00 H new ATOM 1505 N LEU B 35 12.081 -5.337 5.807 1.00 0.00 N ATOM 1506 CA LEU B 35 12.601 -4.402 4.818 1.00 0.00 C ATOM 1507 C LEU B 35 13.547 -3.381 5.448 1.00 0.00 C ATOM 1508 O LEU B 35 13.290 -2.860 6.534 1.00 0.00 O ATOM 1509 CB LEU B 35 11.450 -3.690 4.109 1.00 0.00 C ATOM 1510 CG LEU B 35 10.495 -4.609 3.348 1.00 0.00 C ATOM 1511 CD1 LEU B 35 9.369 -3.806 2.722 1.00 0.00 C ATOM 1512 CD2 LEU B 35 11.245 -5.395 2.283 1.00 0.00 C ATOM 0 H LEU B 35 11.070 -5.294 5.933 1.00 0.00 H new ATOM 0 HA LEU B 35 13.173 -4.975 4.088 1.00 0.00 H new ATOM 0 HB2 LEU B 35 10.879 -3.129 4.849 1.00 0.00 H new ATOM 0 HB3 LEU B 35 11.866 -2.964 3.410 1.00 0.00 H new ATOM 0 HG LEU B 35 10.062 -5.316 4.056 1.00 0.00 H new ATOM 0 HD11 LEU B 35 8.699 -4.477 2.184 1.00 0.00 H new ATOM 0 HD12 LEU B 35 8.813 -3.288 3.504 1.00 0.00 H new ATOM 0 HD13 LEU B 35 9.785 -3.076 2.028 1.00 0.00 H new ATOM 0 HD21 LEU B 35 10.549 -6.044 1.752 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.707 -4.704 1.578 1.00 0.00 H new ATOM 0 HD23 LEU B 35 12.018 -6.002 2.755 1.00 0.00 H new ATOM 1524 N VAL B 36 14.643 -3.116 4.752 1.00 0.00 N ATOM 1525 CA VAL B 36 15.662 -2.183 5.215 1.00 0.00 C ATOM 1526 C VAL B 36 15.385 -0.789 4.655 1.00 0.00 C ATOM 1527 O VAL B 36 15.203 -0.630 3.450 1.00 0.00 O ATOM 1528 CB VAL B 36 17.069 -2.650 4.772 1.00 0.00 C ATOM 1529 CG1 VAL B 36 18.153 -1.740 5.323 1.00 0.00 C ATOM 1530 CG2 VAL B 36 17.312 -4.093 5.194 1.00 0.00 C ATOM 0 H VAL B 36 14.852 -3.542 3.849 1.00 0.00 H new ATOM 0 HA VAL B 36 15.630 -2.150 6.304 1.00 0.00 H new ATOM 0 HB VAL B 36 17.111 -2.595 3.684 1.00 0.00 H new ATOM 0 HG11 VAL B 36 19.129 -2.096 4.993 1.00 0.00 H new ATOM 0 HG12 VAL B 36 17.995 -0.725 4.959 1.00 0.00 H new ATOM 0 HG13 VAL B 36 18.114 -1.746 6.412 1.00 0.00 H new ATOM 0 HG21 VAL B 36 18.307 -4.403 4.874 1.00 0.00 H new ATOM 0 HG22 VAL B 36 17.239 -4.172 6.279 1.00 0.00 H new ATOM 0 HG23 VAL B 36 16.564 -4.738 4.732 1.00 0.00 H new ATOM 1540 N LYS B 37 15.353 0.216 5.519 1.00 0.00 N ATOM 1541 CA LYS B 37 15.000 1.565 5.092 1.00 0.00 C ATOM 1542 C LYS B 37 16.192 2.268 4.446 1.00 0.00 C ATOM 1543 O LYS B 37 17.184 2.578 5.107 1.00 0.00 O ATOM 1544 CB LYS B 37 14.467 2.382 6.273 1.00 0.00 C ATOM 1545 CG LYS B 37 14.053 3.795 5.896 1.00 0.00 C ATOM 1546 CD LYS B 37 13.389 4.520 7.057 1.00 0.00 C ATOM 1547 CE LYS B 37 13.140 5.983 6.724 1.00 0.00 C ATOM 1548 NZ LYS B 37 14.411 6.750 6.629 1.00 0.00 N ATOM 0 H LYS B 37 15.565 0.126 6.513 1.00 0.00 H new ATOM 0 HA LYS B 37 14.212 1.485 4.343 1.00 0.00 H new ATOM 0 HB2 LYS B 37 13.611 1.864 6.705 1.00 0.00 H new ATOM 0 HB3 LYS B 37 15.234 2.431 7.046 1.00 0.00 H new ATOM 0 HG2 LYS B 37 14.929 4.356 5.571 1.00 0.00 H new ATOM 0 HG3 LYS B 37 13.366 3.759 5.050 1.00 0.00 H new ATOM 0 HD2 LYS B 37 12.444 4.034 7.300 1.00 0.00 H new ATOM 0 HD3 LYS B 37 14.021 4.449 7.942 1.00 0.00 H new ATOM 0 HE2 LYS B 37 12.600 6.054 5.780 1.00 0.00 H new ATOM 0 HE3 LYS B 37 12.503 6.427 7.489 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 14.204 7.769 6.655 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 15.027 6.501 7.429 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 14.891 6.517 5.736 1.00 0.00 H new ATOM 1562 N VAL B 38 16.079 2.520 3.149 1.00 0.00 N ATOM 1563 CA VAL B 38 17.147 3.159 2.389 1.00 0.00 C ATOM 1564 C VAL B 38 17.099 4.672 2.573 1.00 0.00 C ATOM 1565 O VAL B 38 18.132 5.341 2.613 1.00 0.00 O ATOM 1566 CB VAL B 38 17.040 2.825 0.884 1.00 0.00 C ATOM 1567 CG1 VAL B 38 18.218 3.398 0.109 1.00 0.00 C ATOM 1568 CG2 VAL B 38 16.946 1.321 0.676 1.00 0.00 C ATOM 0 H VAL B 38 15.253 2.290 2.597 1.00 0.00 H new ATOM 0 HA VAL B 38 18.095 2.775 2.767 1.00 0.00 H new ATOM 0 HB VAL B 38 16.129 3.287 0.502 1.00 0.00 H new ATOM 0 HG11 VAL B 38 18.116 3.147 -0.947 1.00 0.00 H new ATOM 0 HG12 VAL B 38 18.237 4.482 0.224 1.00 0.00 H new ATOM 0 HG13 VAL B 38 19.146 2.976 0.494 1.00 0.00 H new ATOM 0 HG21 VAL B 38 16.871 1.105 -0.390 1.00 0.00 H new ATOM 0 HG22 VAL B 38 17.837 0.841 1.082 1.00 0.00 H new ATOM 0 HG23 VAL B 38 16.063 0.938 1.187 1.00 0.00 H new ATOM 1578 N GLY B 39 15.892 5.202 2.696 1.00 0.00 N ATOM 1579 CA GLY B 39 15.723 6.628 2.868 1.00 0.00 C ATOM 1580 C GLY B 39 14.270 7.031 2.785 1.00 0.00 C ATOM 1581 O GLY B 39 13.386 6.175 2.806 1.00 0.00 O ATOM 0 H GLY B 39 15.024 4.667 2.680 1.00 0.00 H new ATOM 0 HA2 GLY B 39 16.130 6.929 3.833 1.00 0.00 H new ATOM 0 HA3 GLY B 39 16.292 7.157 2.103 1.00 0.00 H new ATOM 1585 N THR B 40 14.018 8.325 2.689 1.00 0.00 N ATOM 1586 CA THR B 40 12.664 8.835 2.595 1.00 0.00 C ATOM 1587 C THR B 40 12.544 9.806 1.424 1.00 0.00 C ATOM 1588 O THR B 40 13.267 10.804 1.352 1.00 0.00 O ATOM 1589 CB THR B 40 12.252 9.542 3.902 1.00 0.00 C ATOM 1590 OG1 THR B 40 12.444 8.660 5.017 1.00 0.00 O ATOM 1591 CG2 THR B 40 10.797 9.988 3.855 1.00 0.00 C ATOM 0 H THR B 40 14.740 9.045 2.674 1.00 0.00 H new ATOM 0 HA THR B 40 11.995 7.990 2.430 1.00 0.00 H new ATOM 0 HB THR B 40 12.880 10.426 4.017 1.00 0.00 H new ATOM 0 HG1 THR B 40 12.182 9.116 5.844 1.00 0.00 H new ATOM 0 HG21 THR B 40 10.538 10.483 4.791 1.00 0.00 H new ATOM 0 HG22 THR B 40 10.656 10.682 3.026 1.00 0.00 H new ATOM 0 HG23 THR B 40 10.154 9.119 3.714 1.00 0.00 H new ATOM 1599 N ILE B 41 11.639 9.505 0.504 1.00 0.00 N ATOM 1600 CA ILE B 41 11.428 10.346 -0.664 1.00 0.00 C ATOM 1601 C ILE B 41 10.241 11.269 -0.444 1.00 0.00 C ATOM 1602 O ILE B 41 9.331 10.956 0.326 1.00 0.00 O ATOM 1603 CB ILE B 41 11.188 9.517 -1.946 1.00 0.00 C ATOM 1604 CG1 ILE B 41 10.034 8.524 -1.743 1.00 0.00 C ATOM 1605 CG2 ILE B 41 12.460 8.792 -2.357 1.00 0.00 C ATOM 1606 CD1 ILE B 41 9.673 7.741 -2.986 1.00 0.00 C ATOM 0 H ILE B 41 11.038 8.682 0.545 1.00 0.00 H new ATOM 0 HA ILE B 41 12.339 10.930 -0.800 1.00 0.00 H new ATOM 0 HB ILE B 41 10.909 10.199 -2.749 1.00 0.00 H new ATOM 0 HG12 ILE B 41 10.304 7.825 -0.951 1.00 0.00 H new ATOM 0 HG13 ILE B 41 9.154 9.069 -1.401 1.00 0.00 H new ATOM 0 HG21 ILE B 41 12.273 8.213 -3.261 1.00 0.00 H new ATOM 0 HG22 ILE B 41 13.248 9.520 -2.549 1.00 0.00 H new ATOM 0 HG23 ILE B 41 12.772 8.122 -1.556 1.00 0.00 H new ATOM 0 HD11 ILE B 41 8.850 7.062 -2.762 1.00 0.00 H new ATOM 0 HD12 ILE B 41 9.370 8.430 -3.775 1.00 0.00 H new ATOM 0 HD13 ILE B 41 10.538 7.166 -3.318 1.00 0.00 H new ATOM 1618 N ASN B 42 10.257 12.407 -1.113 1.00 0.00 N ATOM 1619 CA ASN B 42 9.168 13.360 -1.001 1.00 0.00 C ATOM 1620 C ASN B 42 8.877 13.984 -2.355 1.00 0.00 C ATOM 1621 O ASN B 42 9.787 14.389 -3.077 1.00 0.00 O ATOM 1622 CB ASN B 42 9.492 14.446 0.038 1.00 0.00 C ATOM 1623 CG ASN B 42 10.602 15.390 -0.398 1.00 0.00 C ATOM 1624 OD1 ASN B 42 10.345 16.438 -0.991 1.00 0.00 O ATOM 1625 ND2 ASN B 42 11.841 15.028 -0.103 1.00 0.00 N ATOM 0 H ASN B 42 11.010 12.694 -1.738 1.00 0.00 H new ATOM 0 HA ASN B 42 8.279 12.828 -0.663 1.00 0.00 H new ATOM 0 HB2 ASN B 42 8.591 15.026 0.239 1.00 0.00 H new ATOM 0 HB3 ASN B 42 9.779 13.968 0.974 1.00 0.00 H new ATOM 0 HD21 ASN B 42 12.624 15.626 -0.368 1.00 0.00 H new ATOM 0 HD22 ASN B 42 12.013 14.151 0.390 1.00 0.00 H new ATOM 1632 N VAL B 43 7.609 14.017 -2.711 1.00 0.00 N ATOM 1633 CA VAL B 43 7.177 14.650 -3.939 1.00 0.00 C ATOM 1634 C VAL B 43 6.354 15.883 -3.608 1.00 0.00 C ATOM 1635 O VAL B 43 5.187 15.774 -3.235 1.00 0.00 O ATOM 1636 CB VAL B 43 6.334 13.696 -4.816 1.00 0.00 C ATOM 1637 CG1 VAL B 43 6.046 14.322 -6.171 1.00 0.00 C ATOM 1638 CG2 VAL B 43 7.031 12.354 -4.982 1.00 0.00 C ATOM 0 H VAL B 43 6.854 13.608 -2.161 1.00 0.00 H new ATOM 0 HA VAL B 43 8.068 14.924 -4.503 1.00 0.00 H new ATOM 0 HB VAL B 43 5.384 13.525 -4.310 1.00 0.00 H new ATOM 0 HG11 VAL B 43 5.452 13.633 -6.771 1.00 0.00 H new ATOM 0 HG12 VAL B 43 5.494 15.252 -6.032 1.00 0.00 H new ATOM 0 HG13 VAL B 43 6.986 14.531 -6.682 1.00 0.00 H new ATOM 0 HG21 VAL B 43 6.418 11.700 -5.603 1.00 0.00 H new ATOM 0 HG22 VAL B 43 8.000 12.504 -5.459 1.00 0.00 H new ATOM 0 HG23 VAL B 43 7.175 11.895 -4.004 1.00 0.00 H new ATOM 1648 N SER B 44 6.975 17.043 -3.706 1.00 0.00 N ATOM 1649 CA SER B 44 6.296 18.294 -3.424 1.00 0.00 C ATOM 1650 C SER B 44 5.928 18.980 -4.728 1.00 0.00 C ATOM 1651 O SER B 44 6.793 19.497 -5.436 1.00 0.00 O ATOM 1652 CB SER B 44 7.191 19.203 -2.575 1.00 0.00 C ATOM 1653 OG SER B 44 6.535 20.414 -2.236 1.00 0.00 O ATOM 0 H SER B 44 7.952 17.145 -3.980 1.00 0.00 H new ATOM 0 HA SER B 44 5.385 18.088 -2.862 1.00 0.00 H new ATOM 0 HB2 SER B 44 7.483 18.679 -1.664 1.00 0.00 H new ATOM 0 HB3 SER B 44 8.107 19.426 -3.122 1.00 0.00 H new ATOM 0 HG SER B 44 5.583 20.238 -2.081 1.00 0.00 H new ATOM 1659 N GLN B 45 4.649 18.956 -5.058 1.00 0.00 N ATOM 1660 CA GLN B 45 4.178 19.548 -6.298 1.00 0.00 C ATOM 1661 C GLN B 45 3.197 20.674 -6.011 1.00 0.00 C ATOM 1662 O GLN B 45 2.093 20.442 -5.519 1.00 0.00 O ATOM 1663 CB GLN B 45 3.531 18.483 -7.190 1.00 0.00 C ATOM 1664 CG GLN B 45 4.473 17.339 -7.552 1.00 0.00 C ATOM 1665 CD GLN B 45 5.724 17.812 -8.270 1.00 0.00 C ATOM 1666 OE1 GLN B 45 5.705 18.806 -8.993 1.00 0.00 O ATOM 1667 NE2 GLN B 45 6.827 17.105 -8.072 1.00 0.00 N ATOM 0 H GLN B 45 3.918 18.533 -4.485 1.00 0.00 H new ATOM 0 HA GLN B 45 5.034 19.965 -6.828 1.00 0.00 H new ATOM 0 HB2 GLN B 45 2.657 18.076 -6.681 1.00 0.00 H new ATOM 0 HB3 GLN B 45 3.176 18.955 -8.106 1.00 0.00 H new ATOM 0 HG2 GLN B 45 4.759 16.809 -6.644 1.00 0.00 H new ATOM 0 HG3 GLN B 45 3.945 16.625 -8.184 1.00 0.00 H new ATOM 0 HE21 GLN B 45 6.805 16.285 -7.465 1.00 0.00 H new ATOM 0 HE22 GLN B 45 7.698 17.380 -8.526 1.00 0.00 H new ATOM 1676 N SER B 46 3.617 21.895 -6.297 1.00 0.00 N ATOM 1677 CA SER B 46 2.770 23.057 -6.097 1.00 0.00 C ATOM 1678 C SER B 46 1.727 23.154 -7.205 1.00 0.00 C ATOM 1679 O SER B 46 2.042 23.500 -8.342 1.00 0.00 O ATOM 1680 CB SER B 46 3.627 24.323 -6.058 1.00 0.00 C ATOM 1681 OG SER B 46 4.624 24.222 -5.054 1.00 0.00 O ATOM 0 H SER B 46 4.543 22.107 -6.670 1.00 0.00 H new ATOM 0 HA SER B 46 2.248 22.954 -5.145 1.00 0.00 H new ATOM 0 HB2 SER B 46 4.096 24.481 -7.029 1.00 0.00 H new ATOM 0 HB3 SER B 46 2.995 25.190 -5.865 1.00 0.00 H new ATOM 0 HG SER B 46 4.198 24.078 -4.183 1.00 0.00 H new ATOM 1687 N GLY B 47 0.493 22.826 -6.873 1.00 0.00 N ATOM 1688 CA GLY B 47 -0.578 22.897 -7.837 1.00 0.00 C ATOM 1689 C GLY B 47 -0.950 21.539 -8.384 1.00 0.00 C ATOM 1690 O GLY B 47 -0.432 20.513 -7.933 1.00 0.00 O ATOM 0 H GLY B 47 0.212 22.509 -5.945 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -1.453 23.350 -7.371 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -0.281 23.548 -8.659 1.00 0.00 H new ATOM 1694 N GLY B 48 -1.831 21.532 -9.371 1.00 0.00 N ATOM 1695 CA GLY B 48 -2.319 20.291 -9.932 1.00 0.00 C ATOM 1696 C GLY B 48 -1.357 19.662 -10.921 1.00 0.00 C ATOM 1697 O GLY B 48 -1.756 19.277 -12.020 1.00 0.00 O ATOM 0 H GLY B 48 -2.220 22.373 -9.797 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -2.511 19.586 -9.124 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -3.272 20.474 -10.429 1.00 0.00 H new ATOM 1701 N GLN B 49 -0.089 19.560 -10.542 1.00 0.00 N ATOM 1702 CA GLN B 49 0.895 18.867 -11.363 1.00 0.00 C ATOM 1703 C GLN B 49 0.732 17.362 -11.175 1.00 0.00 C ATOM 1704 O GLN B 49 1.066 16.567 -12.054 1.00 0.00 O ATOM 1705 CB GLN B 49 2.313 19.315 -11.007 1.00 0.00 C ATOM 1706 CG GLN B 49 2.549 20.804 -11.235 1.00 0.00 C ATOM 1707 CD GLN B 49 3.999 21.215 -11.056 1.00 0.00 C ATOM 1708 OE1 GLN B 49 4.294 22.341 -10.652 1.00 0.00 O ATOM 1709 NE2 GLN B 49 4.917 20.320 -11.377 1.00 0.00 N ATOM 0 H GLN B 49 0.281 19.947 -9.674 1.00 0.00 H new ATOM 0 HA GLN B 49 0.730 19.115 -12.411 1.00 0.00 H new ATOM 0 HB2 GLN B 49 2.510 19.079 -9.961 1.00 0.00 H new ATOM 0 HB3 GLN B 49 3.027 18.746 -11.602 1.00 0.00 H new ATOM 0 HG2 GLN B 49 2.226 21.066 -12.242 1.00 0.00 H new ATOM 0 HG3 GLN B 49 1.929 21.374 -10.543 1.00 0.00 H new ATOM 0 HE21 GLN B 49 4.636 19.397 -11.708 1.00 0.00 H new ATOM 0 HE22 GLN B 49 5.907 20.552 -11.294 1.00 0.00 H new ATOM 1718 N ILE B 50 0.209 16.991 -10.014 1.00 0.00 N ATOM 1719 CA ILE B 50 -0.217 15.625 -9.750 1.00 0.00 C ATOM 1720 C ILE B 50 -1.738 15.603 -9.686 1.00 0.00 C ATOM 1721 O ILE B 50 -2.332 16.058 -8.710 1.00 0.00 O ATOM 1722 CB ILE B 50 0.362 15.084 -8.421 1.00 0.00 C ATOM 1723 CG1 ILE B 50 1.895 15.110 -8.446 1.00 0.00 C ATOM 1724 CG2 ILE B 50 -0.143 13.673 -8.146 1.00 0.00 C ATOM 1725 CD1 ILE B 50 2.511 14.276 -9.551 1.00 0.00 C ATOM 0 H ILE B 50 0.069 17.628 -9.230 1.00 0.00 H new ATOM 0 HA ILE B 50 0.153 14.985 -10.551 1.00 0.00 H new ATOM 0 HB ILE B 50 0.021 15.733 -7.615 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.228 16.142 -8.556 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.269 14.755 -7.486 1.00 0.00 H new ATOM 0 HG21 ILE B 50 0.277 13.313 -7.207 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -1.231 13.683 -8.077 1.00 0.00 H new ATOM 0 HG23 ILE B 50 0.163 13.012 -8.957 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.597 14.348 -9.499 1.00 0.00 H new ATOM 0 HD12 ILE B 50 2.210 13.235 -9.432 1.00 0.00 H new ATOM 0 HD13 ILE B 50 2.169 14.644 -10.518 1.00 0.00 H new ATOM 1737 N SER B 51 -2.366 15.115 -10.741 1.00 0.00 N ATOM 1738 CA SER B 51 -3.812 15.203 -10.861 1.00 0.00 C ATOM 1739 C SER B 51 -4.503 13.910 -10.440 1.00 0.00 C ATOM 1740 O SER B 51 -5.534 13.937 -9.761 1.00 0.00 O ATOM 1741 CB SER B 51 -4.179 15.564 -12.300 1.00 0.00 C ATOM 1742 OG SER B 51 -3.540 14.699 -13.227 1.00 0.00 O ATOM 0 H SER B 51 -1.901 14.656 -11.524 1.00 0.00 H new ATOM 0 HA SER B 51 -4.162 15.983 -10.185 1.00 0.00 H new ATOM 0 HB2 SER B 51 -5.260 15.504 -12.428 1.00 0.00 H new ATOM 0 HB3 SER B 51 -3.891 16.595 -12.503 1.00 0.00 H new ATOM 0 HG SER B 51 -3.794 14.952 -14.139 1.00 0.00 H new ATOM 1748 N SER B 52 -3.938 12.786 -10.840 1.00 0.00 N ATOM 1749 CA SER B 52 -4.537 11.493 -10.566 1.00 0.00 C ATOM 1750 C SER B 52 -3.641 10.688 -9.626 1.00 0.00 C ATOM 1751 O SER B 52 -2.436 10.943 -9.549 1.00 0.00 O ATOM 1752 CB SER B 52 -4.743 10.750 -11.894 1.00 0.00 C ATOM 1753 OG SER B 52 -5.525 9.579 -11.728 1.00 0.00 O ATOM 0 H SER B 52 -3.061 12.743 -11.358 1.00 0.00 H new ATOM 0 HA SER B 52 -5.502 11.626 -10.077 1.00 0.00 H new ATOM 0 HB2 SER B 52 -5.229 11.413 -12.609 1.00 0.00 H new ATOM 0 HB3 SER B 52 -3.774 10.483 -12.315 1.00 0.00 H new ATOM 0 HG SER B 52 -5.636 9.134 -12.594 1.00 0.00 H new ATOM 1759 N PRO B 53 -4.209 9.721 -8.874 1.00 0.00 N ATOM 1760 CA PRO B 53 -3.424 8.790 -8.059 1.00 0.00 C ATOM 1761 C PRO B 53 -2.358 8.074 -8.887 1.00 0.00 C ATOM 1762 O PRO B 53 -1.345 7.614 -8.354 1.00 0.00 O ATOM 1763 CB PRO B 53 -4.457 7.785 -7.526 1.00 0.00 C ATOM 1764 CG PRO B 53 -5.705 8.037 -8.308 1.00 0.00 C ATOM 1765 CD PRO B 53 -5.652 9.478 -8.727 1.00 0.00 C ATOM 0 HA PRO B 53 -2.884 9.305 -7.264 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -4.111 6.760 -7.659 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -4.628 7.927 -6.459 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -5.760 7.381 -9.177 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -6.590 7.840 -7.703 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -6.188 9.648 -9.661 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -6.099 10.133 -7.979 1.00 0.00 H new ATOM 1773 N SER B 54 -2.595 7.991 -10.192 1.00 0.00 N ATOM 1774 CA SER B 54 -1.624 7.439 -11.118 1.00 0.00 C ATOM 1775 C SER B 54 -0.332 8.251 -11.075 1.00 0.00 C ATOM 1776 O SER B 54 0.755 7.687 -10.996 1.00 0.00 O ATOM 1777 CB SER B 54 -2.202 7.438 -12.532 1.00 0.00 C ATOM 1778 OG SER B 54 -3.465 6.799 -12.559 1.00 0.00 O ATOM 0 H SER B 54 -3.461 8.303 -10.631 1.00 0.00 H new ATOM 0 HA SER B 54 -1.398 6.413 -10.826 1.00 0.00 H new ATOM 0 HB2 SER B 54 -2.300 8.463 -12.890 1.00 0.00 H new ATOM 0 HB3 SER B 54 -1.517 6.928 -13.209 1.00 0.00 H new ATOM 0 HG SER B 54 -3.818 6.811 -13.473 1.00 0.00 H new ATOM 1784 N ASP B 55 -0.465 9.577 -11.094 1.00 0.00 N ATOM 1785 CA ASP B 55 0.692 10.471 -11.051 1.00 0.00 C ATOM 1786 C ASP B 55 1.387 10.369 -9.704 1.00 0.00 C ATOM 1787 O ASP B 55 2.614 10.439 -9.613 1.00 0.00 O ATOM 1788 CB ASP B 55 0.272 11.923 -11.296 1.00 0.00 C ATOM 1789 CG ASP B 55 -0.426 12.122 -12.621 1.00 0.00 C ATOM 1790 OD1 ASP B 55 0.267 12.190 -13.660 1.00 0.00 O ATOM 1791 OD2 ASP B 55 -1.672 12.217 -12.629 1.00 0.00 O ATOM 0 H ASP B 55 -1.364 10.057 -11.139 1.00 0.00 H new ATOM 0 HA ASP B 55 1.380 10.166 -11.840 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -0.390 12.244 -10.492 1.00 0.00 H new ATOM 0 HB3 ASP B 55 1.154 12.562 -11.257 1.00 0.00 H new ATOM 1796 N LEU B 56 0.587 10.203 -8.659 1.00 0.00 N ATOM 1797 CA LEU B 56 1.101 10.032 -7.308 1.00 0.00 C ATOM 1798 C LEU B 56 2.017 8.815 -7.230 1.00 0.00 C ATOM 1799 O LEU B 56 3.195 8.931 -6.897 1.00 0.00 O ATOM 1800 CB LEU B 56 -0.069 9.878 -6.328 1.00 0.00 C ATOM 1801 CG LEU B 56 0.312 9.488 -4.898 1.00 0.00 C ATOM 1802 CD1 LEU B 56 1.190 10.550 -4.265 1.00 0.00 C ATOM 1803 CD2 LEU B 56 -0.935 9.267 -4.058 1.00 0.00 C ATOM 0 H LEU B 56 -0.431 10.183 -8.724 1.00 0.00 H new ATOM 0 HA LEU B 56 1.683 10.914 -7.039 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -0.618 10.819 -6.295 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.752 9.125 -6.721 1.00 0.00 H new ATOM 0 HG LEU B 56 0.876 8.556 -4.939 1.00 0.00 H new ATOM 0 HD11 LEU B 56 1.448 10.251 -3.249 1.00 0.00 H new ATOM 0 HD12 LEU B 56 2.101 10.666 -4.852 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.653 11.498 -4.239 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -0.646 8.990 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.522 10.185 -4.030 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.532 8.467 -4.496 1.00 0.00 H new ATOM 1815 N ARG B 57 1.472 7.653 -7.571 1.00 0.00 N ATOM 1816 CA ARG B 57 2.219 6.401 -7.491 1.00 0.00 C ATOM 1817 C ARG B 57 3.311 6.362 -8.557 1.00 0.00 C ATOM 1818 O ARG B 57 4.292 5.628 -8.429 1.00 0.00 O ATOM 1819 CB ARG B 57 1.261 5.214 -7.632 1.00 0.00 C ATOM 1820 CG ARG B 57 0.107 5.275 -6.642 1.00 0.00 C ATOM 1821 CD ARG B 57 -0.902 4.157 -6.850 1.00 0.00 C ATOM 1822 NE ARG B 57 -0.460 2.888 -6.277 1.00 0.00 N ATOM 1823 CZ ARG B 57 -0.678 2.531 -5.008 1.00 0.00 C ATOM 1824 NH1 ARG B 57 -1.209 3.395 -4.150 1.00 0.00 N ATOM 1825 NH2 ARG B 57 -0.356 1.318 -4.594 1.00 0.00 N ATOM 0 H ARG B 57 0.514 7.551 -7.906 1.00 0.00 H new ATOM 0 HA ARG B 57 2.705 6.335 -6.517 1.00 0.00 H new ATOM 0 HB2 ARG B 57 0.864 5.190 -8.647 1.00 0.00 H new ATOM 0 HB3 ARG B 57 1.813 4.286 -7.484 1.00 0.00 H new ATOM 0 HG2 ARG B 57 0.501 5.220 -5.627 1.00 0.00 H new ATOM 0 HG3 ARG B 57 -0.397 6.237 -6.736 1.00 0.00 H new ATOM 0 HD2 ARG B 57 -1.853 4.443 -6.401 1.00 0.00 H new ATOM 0 HD3 ARG B 57 -1.080 4.027 -7.917 1.00 0.00 H new ATOM 0 HE ARG B 57 0.044 2.237 -6.880 1.00 0.00 H new ATOM 0 HH11 ARG B 57 -1.452 4.336 -4.459 1.00 0.00 H new ATOM 0 HH12 ARG B 57 -1.373 3.117 -3.182 1.00 0.00 H new ATOM 0 HH21 ARG B 57 0.060 0.651 -5.244 1.00 0.00 H new ATOM 0 HH22 ARG B 57 -0.524 1.049 -3.625 1.00 0.00 H new ATOM 1839 N GLU B 58 3.138 7.174 -9.594 1.00 0.00 N ATOM 1840 CA GLU B 58 4.142 7.332 -10.637 1.00 0.00 C ATOM 1841 C GLU B 58 5.421 7.923 -10.057 1.00 0.00 C ATOM 1842 O GLU B 58 6.491 7.336 -10.172 1.00 0.00 O ATOM 1843 CB GLU B 58 3.605 8.243 -11.744 1.00 0.00 C ATOM 1844 CG GLU B 58 4.609 8.553 -12.839 1.00 0.00 C ATOM 1845 CD GLU B 58 4.099 9.599 -13.807 1.00 0.00 C ATOM 1846 OE1 GLU B 58 3.447 9.227 -14.803 1.00 0.00 O ATOM 1847 OE2 GLU B 58 4.353 10.799 -13.579 1.00 0.00 O ATOM 0 H GLU B 58 2.300 7.739 -9.734 1.00 0.00 H new ATOM 0 HA GLU B 58 4.367 6.351 -11.056 1.00 0.00 H new ATOM 0 HB2 GLU B 58 2.729 7.773 -12.192 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.271 9.180 -11.298 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.539 8.901 -12.389 1.00 0.00 H new ATOM 0 HG3 GLU B 58 4.842 7.639 -13.385 1.00 0.00 H new ATOM 1854 N LYS B 59 5.300 9.073 -9.410 1.00 0.00 N ATOM 1855 CA LYS B 59 6.457 9.754 -8.841 1.00 0.00 C ATOM 1856 C LYS B 59 7.056 8.956 -7.692 1.00 0.00 C ATOM 1857 O LYS B 59 8.266 8.980 -7.476 1.00 0.00 O ATOM 1858 CB LYS B 59 6.078 11.167 -8.388 1.00 0.00 C ATOM 1859 CG LYS B 59 6.417 12.234 -9.418 1.00 0.00 C ATOM 1860 CD LYS B 59 6.002 11.805 -10.815 1.00 0.00 C ATOM 1861 CE LYS B 59 6.646 12.665 -11.886 1.00 0.00 C ATOM 1862 NZ LYS B 59 6.693 11.960 -13.194 1.00 0.00 N ATOM 0 H LYS B 59 4.413 9.555 -9.265 1.00 0.00 H new ATOM 0 HA LYS B 59 7.218 9.835 -9.617 1.00 0.00 H new ATOM 0 HB2 LYS B 59 5.009 11.200 -8.177 1.00 0.00 H new ATOM 0 HB3 LYS B 59 6.594 11.394 -7.455 1.00 0.00 H new ATOM 0 HG2 LYS B 59 5.915 13.166 -9.158 1.00 0.00 H new ATOM 0 HG3 LYS B 59 7.489 12.433 -9.400 1.00 0.00 H new ATOM 0 HD2 LYS B 59 6.279 10.762 -10.972 1.00 0.00 H new ATOM 0 HD3 LYS B 59 4.917 11.864 -10.906 1.00 0.00 H new ATOM 0 HE2 LYS B 59 6.087 13.595 -11.992 1.00 0.00 H new ATOM 0 HE3 LYS B 59 7.657 12.934 -11.580 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 7.045 12.610 -13.926 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 7.329 11.140 -13.124 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 5.738 11.636 -13.448 1.00 0.00 H new ATOM 1876 N LEU B 60 6.209 8.239 -6.971 1.00 0.00 N ATOM 1877 CA LEU B 60 6.672 7.372 -5.899 1.00 0.00 C ATOM 1878 C LEU B 60 7.563 6.265 -6.452 1.00 0.00 C ATOM 1879 O LEU B 60 8.665 6.043 -5.954 1.00 0.00 O ATOM 1880 CB LEU B 60 5.483 6.768 -5.154 1.00 0.00 C ATOM 1881 CG LEU B 60 4.585 7.778 -4.442 1.00 0.00 C ATOM 1882 CD1 LEU B 60 3.362 7.084 -3.871 1.00 0.00 C ATOM 1883 CD2 LEU B 60 5.356 8.495 -3.342 1.00 0.00 C ATOM 0 H LEU B 60 5.198 8.240 -7.108 1.00 0.00 H new ATOM 0 HA LEU B 60 7.256 7.971 -5.201 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.878 6.204 -5.864 1.00 0.00 H new ATOM 0 HB3 LEU B 60 5.858 6.056 -4.418 1.00 0.00 H new ATOM 0 HG LEU B 60 4.254 8.521 -5.168 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.731 7.816 -3.366 1.00 0.00 H new ATOM 0 HD12 LEU B 60 2.800 6.615 -4.678 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.676 6.322 -3.157 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.701 9.211 -2.846 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.715 7.766 -2.615 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.205 9.022 -3.777 1.00 0.00 H new ATOM 1895 N SER B 61 7.093 5.590 -7.495 1.00 0.00 N ATOM 1896 CA SER B 61 7.859 4.518 -8.114 1.00 0.00 C ATOM 1897 C SER B 61 9.075 5.080 -8.846 1.00 0.00 C ATOM 1898 O SER B 61 10.152 4.482 -8.834 1.00 0.00 O ATOM 1899 CB SER B 61 6.971 3.715 -9.071 1.00 0.00 C ATOM 1900 OG SER B 61 6.283 4.566 -9.972 1.00 0.00 O ATOM 0 H SER B 61 6.187 5.767 -7.928 1.00 0.00 H new ATOM 0 HA SER B 61 8.215 3.848 -7.331 1.00 0.00 H new ATOM 0 HB2 SER B 61 7.583 3.008 -9.631 1.00 0.00 H new ATOM 0 HB3 SER B 61 6.251 3.130 -8.498 1.00 0.00 H new ATOM 0 HG SER B 61 5.474 4.913 -9.541 1.00 0.00 H new ATOM 1906 N GLU B 62 8.891 6.243 -9.461 1.00 0.00 N ATOM 1907 CA GLU B 62 9.956 6.921 -10.183 1.00 0.00 C ATOM 1908 C GLU B 62 11.142 7.184 -9.257 1.00 0.00 C ATOM 1909 O GLU B 62 12.289 6.872 -9.589 1.00 0.00 O ATOM 1910 CB GLU B 62 9.422 8.240 -10.756 1.00 0.00 C ATOM 1911 CG GLU B 62 10.305 8.873 -11.822 1.00 0.00 C ATOM 1912 CD GLU B 62 9.712 10.161 -12.367 1.00 0.00 C ATOM 1913 OE1 GLU B 62 8.633 10.108 -12.998 1.00 0.00 O ATOM 1914 OE2 GLU B 62 10.326 11.231 -12.169 1.00 0.00 O ATOM 0 H GLU B 62 8.000 6.740 -9.472 1.00 0.00 H new ATOM 0 HA GLU B 62 10.297 6.286 -11.001 1.00 0.00 H new ATOM 0 HB2 GLU B 62 8.434 8.063 -11.180 1.00 0.00 H new ATOM 0 HB3 GLU B 62 9.295 8.951 -9.939 1.00 0.00 H new ATOM 0 HG2 GLU B 62 11.290 9.078 -11.401 1.00 0.00 H new ATOM 0 HG3 GLU B 62 10.448 8.166 -12.639 1.00 0.00 H new ATOM 1921 N LEU B 63 10.856 7.734 -8.082 1.00 0.00 N ATOM 1922 CA LEU B 63 11.897 8.056 -7.116 1.00 0.00 C ATOM 1923 C LEU B 63 12.419 6.802 -6.420 1.00 0.00 C ATOM 1924 O LEU B 63 13.614 6.693 -6.151 1.00 0.00 O ATOM 1925 CB LEU B 63 11.384 9.055 -6.078 1.00 0.00 C ATOM 1926 CG LEU B 63 10.979 10.421 -6.634 1.00 0.00 C ATOM 1927 CD1 LEU B 63 10.544 11.349 -5.511 1.00 0.00 C ATOM 1928 CD2 LEU B 63 12.125 11.039 -7.418 1.00 0.00 C ATOM 0 H LEU B 63 9.911 7.966 -7.776 1.00 0.00 H new ATOM 0 HA LEU B 63 12.722 8.510 -7.665 1.00 0.00 H new ATOM 0 HB2 LEU B 63 10.524 8.618 -5.570 1.00 0.00 H new ATOM 0 HB3 LEU B 63 12.158 9.202 -5.325 1.00 0.00 H new ATOM 0 HG LEU B 63 10.135 10.278 -7.309 1.00 0.00 H new ATOM 0 HD11 LEU B 63 10.260 12.316 -5.927 1.00 0.00 H new ATOM 0 HD12 LEU B 63 9.692 10.914 -4.989 1.00 0.00 H new ATOM 0 HD13 LEU B 63 11.368 11.484 -4.811 1.00 0.00 H new ATOM 0 HD21 LEU B 63 11.818 12.010 -7.806 1.00 0.00 H new ATOM 0 HD22 LEU B 63 12.987 11.165 -6.763 1.00 0.00 H new ATOM 0 HD23 LEU B 63 12.393 10.385 -8.248 1.00 0.00 H new ATOM 1940 N ALA B 64 11.527 5.860 -6.134 1.00 0.00 N ATOM 1941 CA ALA B 64 11.911 4.624 -5.453 1.00 0.00 C ATOM 1942 C ALA B 64 12.917 3.829 -6.279 1.00 0.00 C ATOM 1943 O ALA B 64 13.988 3.467 -5.784 1.00 0.00 O ATOM 1944 CB ALA B 64 10.687 3.778 -5.146 1.00 0.00 C ATOM 0 H ALA B 64 10.535 5.926 -6.362 1.00 0.00 H new ATOM 0 HA ALA B 64 12.389 4.896 -4.512 1.00 0.00 H new ATOM 0 HB1 ALA B 64 10.995 2.863 -4.639 1.00 0.00 H new ATOM 0 HB2 ALA B 64 10.009 4.339 -4.502 1.00 0.00 H new ATOM 0 HB3 ALA B 64 10.178 3.524 -6.076 1.00 0.00 H new ATOM 1950 N ASP B 65 12.576 3.573 -7.541 1.00 0.00 N ATOM 1951 CA ASP B 65 13.473 2.854 -8.445 1.00 0.00 C ATOM 1952 C ASP B 65 14.765 3.636 -8.661 1.00 0.00 C ATOM 1953 O ASP B 65 15.837 3.048 -8.813 1.00 0.00 O ATOM 1954 CB ASP B 65 12.796 2.578 -9.794 1.00 0.00 C ATOM 1955 CG ASP B 65 12.010 1.277 -9.813 1.00 0.00 C ATOM 1956 OD1 ASP B 65 10.836 1.268 -9.392 1.00 0.00 O ATOM 1957 OD2 ASP B 65 12.552 0.257 -10.290 1.00 0.00 O ATOM 0 H ASP B 65 11.689 3.851 -7.960 1.00 0.00 H new ATOM 0 HA ASP B 65 13.714 1.899 -7.978 1.00 0.00 H new ATOM 0 HB2 ASP B 65 12.126 3.404 -10.033 1.00 0.00 H new ATOM 0 HB3 ASP B 65 13.556 2.548 -10.575 1.00 0.00 H new ATOM 1962 N ALA B 66 14.662 4.964 -8.668 1.00 0.00 N ATOM 1963 CA ALA B 66 15.837 5.823 -8.792 1.00 0.00 C ATOM 1964 C ALA B 66 16.776 5.638 -7.598 1.00 0.00 C ATOM 1965 O ALA B 66 17.988 5.501 -7.768 1.00 0.00 O ATOM 1966 CB ALA B 66 15.421 7.281 -8.920 1.00 0.00 C ATOM 0 H ALA B 66 13.778 5.467 -8.589 1.00 0.00 H new ATOM 0 HA ALA B 66 16.374 5.535 -9.696 1.00 0.00 H new ATOM 0 HB1 ALA B 66 16.309 7.906 -9.011 1.00 0.00 H new ATOM 0 HB2 ALA B 66 14.797 7.405 -9.805 1.00 0.00 H new ATOM 0 HB3 ALA B 66 14.858 7.578 -8.035 1.00 0.00 H new ATOM 1972 N LYS B 67 16.204 5.622 -6.395 1.00 0.00 N ATOM 1973 CA LYS B 67 16.978 5.429 -5.167 1.00 0.00 C ATOM 1974 C LYS B 67 17.593 4.034 -5.125 1.00 0.00 C ATOM 1975 O LYS B 67 18.708 3.849 -4.639 1.00 0.00 O ATOM 1976 CB LYS B 67 16.092 5.633 -3.931 1.00 0.00 C ATOM 1977 CG LYS B 67 15.602 7.061 -3.744 1.00 0.00 C ATOM 1978 CD LYS B 67 16.746 8.011 -3.428 1.00 0.00 C ATOM 1979 CE LYS B 67 16.237 9.424 -3.195 1.00 0.00 C ATOM 1980 NZ LYS B 67 17.340 10.365 -2.866 1.00 0.00 N ATOM 0 H LYS B 67 15.202 5.741 -6.243 1.00 0.00 H new ATOM 0 HA LYS B 67 17.778 6.169 -5.161 1.00 0.00 H new ATOM 0 HB2 LYS B 67 15.229 4.971 -4.003 1.00 0.00 H new ATOM 0 HB3 LYS B 67 16.650 5.333 -3.044 1.00 0.00 H new ATOM 0 HG2 LYS B 67 15.093 7.393 -4.649 1.00 0.00 H new ATOM 0 HG3 LYS B 67 14.870 7.092 -2.937 1.00 0.00 H new ATOM 0 HD2 LYS B 67 17.278 7.662 -2.543 1.00 0.00 H new ATOM 0 HD3 LYS B 67 17.461 8.010 -4.251 1.00 0.00 H new ATOM 0 HE2 LYS B 67 15.716 9.773 -4.086 1.00 0.00 H new ATOM 0 HE3 LYS B 67 15.510 9.418 -2.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 16.950 11.317 -2.715 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 17.822 10.046 -2.001 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 18.021 10.390 -3.652 1.00 0.00 H new ATOM 1994 N GLY B 68 16.858 3.059 -5.637 1.00 0.00 N ATOM 1995 CA GLY B 68 17.333 1.689 -5.630 1.00 0.00 C ATOM 1996 C GLY B 68 16.531 0.818 -4.691 1.00 0.00 C ATOM 1997 O GLY B 68 16.831 -0.363 -4.513 1.00 0.00 O ATOM 0 H GLY B 68 15.939 3.191 -6.059 1.00 0.00 H new ATOM 0 HA2 GLY B 68 17.278 1.281 -6.639 1.00 0.00 H new ATOM 0 HA3 GLY B 68 18.382 1.670 -5.335 1.00 0.00 H new ATOM 2001 N GLY B 69 15.509 1.405 -4.089 1.00 0.00 N ATOM 2002 CA GLY B 69 14.656 0.668 -3.183 1.00 0.00 C ATOM 2003 C GLY B 69 13.368 0.262 -3.854 1.00 0.00 C ATOM 2004 O GLY B 69 12.572 1.114 -4.246 1.00 0.00 O ATOM 0 H GLY B 69 15.254 2.385 -4.213 1.00 0.00 H new ATOM 0 HA2 GLY B 69 15.179 -0.220 -2.828 1.00 0.00 H new ATOM 0 HA3 GLY B 69 14.436 1.280 -2.308 1.00 0.00 H new ATOM 2008 N LYS B 70 13.165 -1.039 -3.998 1.00 0.00 N ATOM 2009 CA LYS B 70 12.010 -1.555 -4.720 1.00 0.00 C ATOM 2010 C LYS B 70 10.710 -1.307 -3.972 1.00 0.00 C ATOM 2011 O LYS B 70 9.664 -1.132 -4.585 1.00 0.00 O ATOM 2012 CB LYS B 70 12.154 -3.050 -4.986 1.00 0.00 C ATOM 2013 CG LYS B 70 13.243 -3.400 -5.980 1.00 0.00 C ATOM 2014 CD LYS B 70 13.043 -4.798 -6.542 1.00 0.00 C ATOM 2015 CE LYS B 70 11.722 -4.908 -7.289 1.00 0.00 C ATOM 2016 NZ LYS B 70 11.497 -6.264 -7.846 1.00 0.00 N ATOM 0 H LYS B 70 13.785 -1.758 -3.625 1.00 0.00 H new ATOM 0 HA LYS B 70 11.972 -1.016 -5.667 1.00 0.00 H new ATOM 0 HB2 LYS B 70 12.360 -3.557 -4.044 1.00 0.00 H new ATOM 0 HB3 LYS B 70 11.203 -3.436 -5.354 1.00 0.00 H new ATOM 0 HG2 LYS B 70 13.244 -2.674 -6.793 1.00 0.00 H new ATOM 0 HG3 LYS B 70 14.217 -3.336 -5.495 1.00 0.00 H new ATOM 0 HD2 LYS B 70 13.865 -5.043 -7.214 1.00 0.00 H new ATOM 0 HD3 LYS B 70 13.067 -5.526 -5.731 1.00 0.00 H new ATOM 0 HE2 LYS B 70 10.904 -4.655 -6.614 1.00 0.00 H new ATOM 0 HE3 LYS B 70 11.704 -4.178 -8.099 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 10.585 -6.287 -8.345 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 12.262 -6.497 -8.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 11.487 -6.960 -7.073 1.00 0.00 H new ATOM 2030 N TYR B 71 10.768 -1.293 -2.656 1.00 0.00 N ATOM 2031 CA TYR B 71 9.560 -1.188 -1.860 1.00 0.00 C ATOM 2032 C TYR B 71 9.462 0.183 -1.218 1.00 0.00 C ATOM 2033 O TYR B 71 10.470 0.772 -0.842 1.00 0.00 O ATOM 2034 CB TYR B 71 9.538 -2.283 -0.793 1.00 0.00 C ATOM 2035 CG TYR B 71 9.688 -3.672 -1.371 1.00 0.00 C ATOM 2036 CD1 TYR B 71 8.616 -4.309 -1.980 1.00 0.00 C ATOM 2037 CD2 TYR B 71 10.907 -4.337 -1.324 1.00 0.00 C ATOM 2038 CE1 TYR B 71 8.754 -5.569 -2.525 1.00 0.00 C ATOM 2039 CE2 TYR B 71 11.051 -5.601 -1.864 1.00 0.00 C ATOM 2040 CZ TYR B 71 9.971 -6.210 -2.465 1.00 0.00 C ATOM 2041 OH TYR B 71 10.111 -7.463 -3.017 1.00 0.00 O ATOM 0 H TYR B 71 11.632 -1.353 -2.117 1.00 0.00 H new ATOM 0 HA TYR B 71 8.698 -1.320 -2.514 1.00 0.00 H new ATOM 0 HB2 TYR B 71 10.342 -2.103 -0.079 1.00 0.00 H new ATOM 0 HB3 TYR B 71 8.601 -2.225 -0.239 1.00 0.00 H new ATOM 0 HD1 TYR B 71 7.659 -3.811 -2.028 1.00 0.00 H new ATOM 0 HD2 TYR B 71 11.756 -3.858 -0.858 1.00 0.00 H new ATOM 0 HE1 TYR B 71 7.910 -6.051 -2.997 1.00 0.00 H new ATOM 0 HE2 TYR B 71 12.003 -6.108 -1.815 1.00 0.00 H new ATOM 0 HH TYR B 71 11.031 -7.775 -2.891 1.00 0.00 H new ATOM 2051 N TYR B 72 8.255 0.702 -1.116 1.00 0.00 N ATOM 2052 CA TYR B 72 8.045 1.979 -0.465 1.00 0.00 C ATOM 2053 C TYR B 72 6.718 1.990 0.274 1.00 0.00 C ATOM 2054 O TYR B 72 5.791 1.256 -0.074 1.00 0.00 O ATOM 2055 CB TYR B 72 8.109 3.136 -1.475 1.00 0.00 C ATOM 2056 CG TYR B 72 7.054 3.085 -2.560 1.00 0.00 C ATOM 2057 CD1 TYR B 72 5.815 3.690 -2.386 1.00 0.00 C ATOM 2058 CD2 TYR B 72 7.302 2.440 -3.764 1.00 0.00 C ATOM 2059 CE1 TYR B 72 4.855 3.652 -3.379 1.00 0.00 C ATOM 2060 CE2 TYR B 72 6.347 2.398 -4.761 1.00 0.00 C ATOM 2061 CZ TYR B 72 5.127 3.004 -4.564 1.00 0.00 C ATOM 2062 OH TYR B 72 4.177 2.965 -5.561 1.00 0.00 O ATOM 0 H TYR B 72 7.408 0.261 -1.474 1.00 0.00 H new ATOM 0 HA TYR B 72 8.847 2.121 0.259 1.00 0.00 H new ATOM 0 HB2 TYR B 72 8.011 4.078 -0.935 1.00 0.00 H new ATOM 0 HB3 TYR B 72 9.093 3.138 -1.943 1.00 0.00 H new ATOM 0 HD1 TYR B 72 5.599 4.199 -1.458 1.00 0.00 H new ATOM 0 HD2 TYR B 72 8.258 1.963 -3.924 1.00 0.00 H new ATOM 0 HE1 TYR B 72 3.897 4.127 -3.227 1.00 0.00 H new ATOM 0 HE2 TYR B 72 6.557 1.892 -5.692 1.00 0.00 H new ATOM 0 HH TYR B 72 4.530 2.470 -6.330 1.00 0.00 H new ATOM 2072 N HIS B 73 6.643 2.812 1.302 1.00 0.00 N ATOM 2073 CA HIS B 73 5.419 2.979 2.062 1.00 0.00 C ATOM 2074 C HIS B 73 5.148 4.456 2.287 1.00 0.00 C ATOM 2075 O HIS B 73 5.965 5.165 2.873 1.00 0.00 O ATOM 2076 CB HIS B 73 5.506 2.240 3.404 1.00 0.00 C ATOM 2077 CG HIS B 73 4.346 2.503 4.319 1.00 0.00 C ATOM 2078 ND1 HIS B 73 4.502 2.911 5.621 1.00 0.00 N ATOM 2079 CD2 HIS B 73 3.010 2.430 4.109 1.00 0.00 C ATOM 2080 CE1 HIS B 73 3.319 3.082 6.174 1.00 0.00 C ATOM 2081 NE2 HIS B 73 2.388 2.798 5.278 1.00 0.00 N ATOM 0 H HIS B 73 7.423 3.380 1.633 1.00 0.00 H new ATOM 0 HA HIS B 73 4.595 2.550 1.493 1.00 0.00 H new ATOM 0 HB2 HIS B 73 5.571 1.169 3.214 1.00 0.00 H new ATOM 0 HB3 HIS B 73 6.427 2.531 3.909 1.00 0.00 H new ATOM 0 HD2 HIS B 73 2.523 2.136 3.191 1.00 0.00 H new ATOM 0 HE1 HIS B 73 3.139 3.401 7.190 1.00 0.00 H new ATOM 0 HE2 HIS B 73 1.380 2.844 5.429 1.00 0.00 H new ATOM 2090 N ILE B 74 4.009 4.916 1.796 1.00 0.00 N ATOM 2091 CA ILE B 74 3.589 6.289 2.006 1.00 0.00 C ATOM 2092 C ILE B 74 3.310 6.532 3.483 1.00 0.00 C ATOM 2093 O ILE B 74 2.528 5.808 4.100 1.00 0.00 O ATOM 2094 CB ILE B 74 2.318 6.618 1.197 1.00 0.00 C ATOM 2095 CG1 ILE B 74 2.540 6.333 -0.290 1.00 0.00 C ATOM 2096 CG2 ILE B 74 1.918 8.070 1.410 1.00 0.00 C ATOM 2097 CD1 ILE B 74 1.314 6.584 -1.141 1.00 0.00 C ATOM 0 H ILE B 74 3.357 4.355 1.247 1.00 0.00 H new ATOM 0 HA ILE B 74 4.399 6.935 1.667 1.00 0.00 H new ATOM 0 HB ILE B 74 1.507 5.981 1.550 1.00 0.00 H new ATOM 0 HG12 ILE B 74 3.358 6.955 -0.653 1.00 0.00 H new ATOM 0 HG13 ILE B 74 2.850 5.295 -0.411 1.00 0.00 H new ATOM 0 HG21 ILE B 74 1.019 8.288 0.833 1.00 0.00 H new ATOM 0 HG22 ILE B 74 1.720 8.241 2.468 1.00 0.00 H new ATOM 0 HG23 ILE B 74 2.727 8.722 1.082 1.00 0.00 H new ATOM 0 HD11 ILE B 74 1.543 6.362 -2.183 1.00 0.00 H new ATOM 0 HD12 ILE B 74 0.500 5.943 -0.804 1.00 0.00 H new ATOM 0 HD13 ILE B 74 1.015 7.628 -1.050 1.00 0.00 H new ATOM 2109 N ILE B 75 3.962 7.531 4.052 1.00 0.00 N ATOM 2110 CA ILE B 75 3.718 7.890 5.439 1.00 0.00 C ATOM 2111 C ILE B 75 2.881 9.155 5.521 1.00 0.00 C ATOM 2112 O ILE B 75 2.177 9.378 6.505 1.00 0.00 O ATOM 2113 CB ILE B 75 5.026 8.083 6.233 1.00 0.00 C ATOM 2114 CG1 ILE B 75 5.951 9.087 5.536 1.00 0.00 C ATOM 2115 CG2 ILE B 75 5.720 6.746 6.424 1.00 0.00 C ATOM 2116 CD1 ILE B 75 7.198 9.417 6.325 1.00 0.00 C ATOM 0 H ILE B 75 4.660 8.105 3.579 1.00 0.00 H new ATOM 0 HA ILE B 75 3.175 7.059 5.889 1.00 0.00 H new ATOM 0 HB ILE B 75 4.779 8.490 7.213 1.00 0.00 H new ATOM 0 HG12 ILE B 75 6.242 8.686 4.565 1.00 0.00 H new ATOM 0 HG13 ILE B 75 5.397 10.007 5.348 1.00 0.00 H new ATOM 0 HG21 ILE B 75 6.643 6.892 6.986 1.00 0.00 H new ATOM 0 HG22 ILE B 75 5.064 6.071 6.973 1.00 0.00 H new ATOM 0 HG23 ILE B 75 5.952 6.314 5.450 1.00 0.00 H new ATOM 0 HD11 ILE B 75 7.802 10.133 5.768 1.00 0.00 H new ATOM 0 HD12 ILE B 75 6.917 9.849 7.286 1.00 0.00 H new ATOM 0 HD13 ILE B 75 7.775 8.507 6.491 1.00 0.00 H new ATOM 2128 N ALA B 76 2.950 9.975 4.476 1.00 0.00 N ATOM 2129 CA ALA B 76 2.185 11.210 4.434 1.00 0.00 C ATOM 2130 C ALA B 76 1.938 11.675 3.001 1.00 0.00 C ATOM 2131 O ALA B 76 2.734 12.420 2.434 1.00 0.00 O ATOM 2132 CB ALA B 76 2.889 12.301 5.228 1.00 0.00 C ATOM 0 H ALA B 76 3.526 9.805 3.652 1.00 0.00 H new ATOM 0 HA ALA B 76 1.215 11.009 4.889 1.00 0.00 H new ATOM 0 HB1 ALA B 76 2.302 13.218 5.185 1.00 0.00 H new ATOM 0 HB2 ALA B 76 2.994 11.985 6.266 1.00 0.00 H new ATOM 0 HB3 ALA B 76 3.876 12.482 4.802 1.00 0.00 H new ATOM 2138 N ALA B 77 0.853 11.199 2.410 1.00 0.00 N ATOM 2139 CA ALA B 77 0.383 11.734 1.141 1.00 0.00 C ATOM 2140 C ALA B 77 -0.657 12.798 1.436 1.00 0.00 C ATOM 2141 O ALA B 77 -1.839 12.501 1.608 1.00 0.00 O ATOM 2142 CB ALA B 77 -0.196 10.637 0.259 1.00 0.00 C ATOM 0 H ALA B 77 0.281 10.444 2.788 1.00 0.00 H new ATOM 0 HA ALA B 77 1.219 12.169 0.593 1.00 0.00 H new ATOM 0 HB1 ALA B 77 -0.538 11.069 -0.681 1.00 0.00 H new ATOM 0 HB2 ALA B 77 0.571 9.890 0.057 1.00 0.00 H new ATOM 0 HB3 ALA B 77 -1.036 10.166 0.769 1.00 0.00 H new ATOM 2148 N ARG B 78 -0.203 14.030 1.533 1.00 0.00 N ATOM 2149 CA ARG B 78 -1.019 15.091 2.084 1.00 0.00 C ATOM 2150 C ARG B 78 -1.151 16.272 1.142 1.00 0.00 C ATOM 2151 O ARG B 78 -0.300 16.524 0.291 1.00 0.00 O ATOM 2152 CB ARG B 78 -0.438 15.542 3.423 1.00 0.00 C ATOM 2153 CG ARG B 78 1.080 15.556 3.446 1.00 0.00 C ATOM 2154 CD ARG B 78 1.609 15.922 4.818 1.00 0.00 C ATOM 2155 NE ARG B 78 1.796 17.361 4.976 1.00 0.00 N ATOM 2156 CZ ARG B 78 1.127 18.106 5.851 1.00 0.00 C ATOM 2157 NH1 ARG B 78 0.192 17.559 6.619 1.00 0.00 N ATOM 2158 NH2 ARG B 78 1.397 19.399 5.963 1.00 0.00 N ATOM 0 H ARG B 78 0.728 14.322 1.237 1.00 0.00 H new ATOM 0 HA ARG B 78 -2.023 14.692 2.231 1.00 0.00 H new ATOM 0 HB2 ARG B 78 -0.807 16.542 3.653 1.00 0.00 H new ATOM 0 HB3 ARG B 78 -0.800 14.880 4.210 1.00 0.00 H new ATOM 0 HG2 ARG B 78 1.459 14.575 3.158 1.00 0.00 H new ATOM 0 HG3 ARG B 78 1.450 16.269 2.710 1.00 0.00 H new ATOM 0 HD2 ARG B 78 0.917 15.562 5.579 1.00 0.00 H new ATOM 0 HD3 ARG B 78 2.559 15.414 4.986 1.00 0.00 H new ATOM 0 HE ARG B 78 2.482 17.823 4.379 1.00 0.00 H new ATOM 0 HH11 ARG B 78 -0.016 16.564 6.539 1.00 0.00 H new ATOM 0 HH12 ARG B 78 -0.319 18.134 7.289 1.00 0.00 H new ATOM 0 HH21 ARG B 78 2.118 19.822 5.378 1.00 0.00 H new ATOM 0 HH22 ARG B 78 0.884 19.971 6.634 1.00 0.00 H new ATOM 2172 N GLU B 79 -2.241 16.986 1.313 1.00 0.00 N ATOM 2173 CA GLU B 79 -2.530 18.168 0.536 1.00 0.00 C ATOM 2174 C GLU B 79 -2.437 19.394 1.437 1.00 0.00 C ATOM 2175 O GLU B 79 -3.255 19.571 2.343 1.00 0.00 O ATOM 2176 CB GLU B 79 -3.925 18.036 -0.068 1.00 0.00 C ATOM 2177 CG GLU B 79 -4.265 19.081 -1.111 1.00 0.00 C ATOM 2178 CD GLU B 79 -5.559 18.754 -1.817 1.00 0.00 C ATOM 2179 OE1 GLU B 79 -5.541 17.890 -2.715 1.00 0.00 O ATOM 2180 OE2 GLU B 79 -6.605 19.330 -1.459 1.00 0.00 O ATOM 0 H GLU B 79 -2.958 16.759 2.002 1.00 0.00 H new ATOM 0 HA GLU B 79 -1.809 18.279 -0.274 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -4.019 17.048 -0.519 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -4.660 18.091 0.735 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -4.345 20.059 -0.636 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -3.457 19.146 -1.840 1.00 0.00 H new ATOM 2187 N HIS B 80 -1.435 20.222 1.198 1.00 0.00 N ATOM 2188 CA HIS B 80 -1.173 21.373 2.049 1.00 0.00 C ATOM 2189 C HIS B 80 -1.382 22.663 1.269 1.00 0.00 C ATOM 2190 O HIS B 80 -0.448 23.196 0.665 1.00 0.00 O ATOM 2191 CB HIS B 80 0.258 21.305 2.601 1.00 0.00 C ATOM 2192 CG HIS B 80 0.596 22.398 3.570 1.00 0.00 C ATOM 2193 ND1 HIS B 80 1.662 23.251 3.399 1.00 0.00 N ATOM 2194 CD2 HIS B 80 0.019 22.752 4.740 1.00 0.00 C ATOM 2195 CE1 HIS B 80 1.728 24.080 4.423 1.00 0.00 C ATOM 2196 NE2 HIS B 80 0.742 23.800 5.252 1.00 0.00 N ATOM 0 H HIS B 80 -0.786 20.119 0.418 1.00 0.00 H new ATOM 0 HA HIS B 80 -1.871 21.359 2.886 1.00 0.00 H new ATOM 0 HB2 HIS B 80 0.400 20.342 3.092 1.00 0.00 H new ATOM 0 HB3 HIS B 80 0.959 21.344 1.767 1.00 0.00 H new ATOM 0 HD2 HIS B 80 -0.850 22.295 5.189 1.00 0.00 H new ATOM 0 HE1 HIS B 80 2.466 24.857 4.559 1.00 0.00 H new ATOM 0 HE2 HIS B 80 0.548 24.283 6.129 1.00 0.00 H new ATOM 2205 N GLY B 81 -2.620 23.130 1.245 1.00 0.00 N ATOM 2206 CA GLY B 81 -2.941 24.331 0.509 1.00 0.00 C ATOM 2207 C GLY B 81 -2.953 24.070 -0.980 1.00 0.00 C ATOM 2208 O GLY B 81 -3.712 23.226 -1.462 1.00 0.00 O ATOM 0 H GLY B 81 -3.409 22.697 1.724 1.00 0.00 H new ATOM 0 HA2 GLY B 81 -3.915 24.705 0.824 1.00 0.00 H new ATOM 0 HA3 GLY B 81 -2.212 25.108 0.739 1.00 0.00 H new ATOM 2212 N PRO B 82 -2.114 24.784 -1.740 1.00 0.00 N ATOM 2213 CA PRO B 82 -1.924 24.520 -3.157 1.00 0.00 C ATOM 2214 C PRO B 82 -0.887 23.425 -3.393 1.00 0.00 C ATOM 2215 O PRO B 82 -0.759 22.898 -4.496 1.00 0.00 O ATOM 2216 CB PRO B 82 -1.421 25.861 -3.685 1.00 0.00 C ATOM 2217 CG PRO B 82 -0.667 26.457 -2.541 1.00 0.00 C ATOM 2218 CD PRO B 82 -1.306 25.929 -1.279 1.00 0.00 C ATOM 0 HA PRO B 82 -2.831 24.166 -3.647 1.00 0.00 H new ATOM 0 HB2 PRO B 82 -0.780 25.729 -4.557 1.00 0.00 H new ATOM 0 HB3 PRO B 82 -2.248 26.502 -3.992 1.00 0.00 H new ATOM 0 HG2 PRO B 82 0.387 26.181 -2.586 1.00 0.00 H new ATOM 0 HG3 PRO B 82 -0.713 27.546 -2.572 1.00 0.00 H new ATOM 0 HD2 PRO B 82 -0.556 25.621 -0.551 1.00 0.00 H new ATOM 0 HD3 PRO B 82 -1.925 26.686 -0.798 1.00 0.00 H new ATOM 2226 N ASN B 83 -0.153 23.076 -2.344 1.00 0.00 N ATOM 2227 CA ASN B 83 0.916 22.096 -2.456 1.00 0.00 C ATOM 2228 C ASN B 83 0.401 20.687 -2.253 1.00 0.00 C ATOM 2229 O ASN B 83 -0.370 20.421 -1.330 1.00 0.00 O ATOM 2230 CB ASN B 83 2.026 22.358 -1.439 1.00 0.00 C ATOM 2231 CG ASN B 83 3.196 23.117 -2.026 1.00 0.00 C ATOM 2232 OD1 ASN B 83 3.026 24.020 -2.844 1.00 0.00 O ATOM 2233 ND2 ASN B 83 4.396 22.728 -1.633 1.00 0.00 N ATOM 0 H ASN B 83 -0.280 23.458 -1.407 1.00 0.00 H new ATOM 0 HA ASN B 83 1.317 22.194 -3.465 1.00 0.00 H new ATOM 0 HB2 ASN B 83 1.618 22.922 -0.600 1.00 0.00 H new ATOM 0 HB3 ASN B 83 2.379 21.407 -1.041 1.00 0.00 H new ATOM 0 HD21 ASN B 83 5.228 23.181 -2.011 1.00 0.00 H new ATOM 0 HD22 ASN B 83 4.490 21.974 -0.952 1.00 0.00 H new ATOM 2240 N PHE B 84 0.825 19.792 -3.121 1.00 0.00 N ATOM 2241 CA PHE B 84 0.572 18.381 -2.934 1.00 0.00 C ATOM 2242 C PHE B 84 1.858 17.710 -2.472 1.00 0.00 C ATOM 2243 O PHE B 84 2.833 17.632 -3.221 1.00 0.00 O ATOM 2244 CB PHE B 84 0.063 17.742 -4.225 1.00 0.00 C ATOM 2245 CG PHE B 84 -0.261 16.285 -4.066 1.00 0.00 C ATOM 2246 CD1 PHE B 84 -1.411 15.884 -3.406 1.00 0.00 C ATOM 2247 CD2 PHE B 84 0.591 15.316 -4.573 1.00 0.00 C ATOM 2248 CE1 PHE B 84 -1.708 14.543 -3.253 1.00 0.00 C ATOM 2249 CE2 PHE B 84 0.299 13.975 -4.424 1.00 0.00 C ATOM 2250 CZ PHE B 84 -0.852 13.588 -3.765 1.00 0.00 C ATOM 0 H PHE B 84 1.349 20.020 -3.966 1.00 0.00 H new ATOM 0 HA PHE B 84 -0.202 18.249 -2.178 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.828 18.273 -4.561 1.00 0.00 H new ATOM 0 HB3 PHE B 84 0.816 17.859 -5.004 1.00 0.00 H new ATOM 0 HD1 PHE B 84 -2.084 16.628 -3.006 1.00 0.00 H new ATOM 0 HD2 PHE B 84 1.492 15.613 -5.089 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -2.607 14.243 -2.735 1.00 0.00 H new ATOM 0 HE2 PHE B 84 0.970 13.229 -4.822 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.082 12.539 -3.650 1.00 0.00 H new ATOM 2260 N GLU B 85 1.851 17.238 -1.237 1.00 0.00 N ATOM 2261 CA GLU B 85 3.052 16.718 -0.606 1.00 0.00 C ATOM 2262 C GLU B 85 2.952 15.207 -0.437 1.00 0.00 C ATOM 2263 O GLU B 85 2.189 14.716 0.396 1.00 0.00 O ATOM 2264 CB GLU B 85 3.237 17.373 0.763 1.00 0.00 C ATOM 2265 CG GLU B 85 3.138 18.891 0.743 1.00 0.00 C ATOM 2266 CD GLU B 85 4.320 19.555 0.065 1.00 0.00 C ATOM 2267 OE1 GLU B 85 5.357 19.746 0.732 1.00 0.00 O ATOM 2268 OE2 GLU B 85 4.217 19.904 -1.124 1.00 0.00 O ATOM 0 H GLU B 85 1.019 17.204 -0.647 1.00 0.00 H new ATOM 0 HA GLU B 85 3.908 16.946 -1.241 1.00 0.00 H new ATOM 0 HB2 GLU B 85 2.485 16.979 1.447 1.00 0.00 H new ATOM 0 HB3 GLU B 85 4.211 17.088 1.162 1.00 0.00 H new ATOM 0 HG2 GLU B 85 2.222 19.183 0.230 1.00 0.00 H new ATOM 0 HG3 GLU B 85 3.061 19.258 1.767 1.00 0.00 H new ATOM 2275 N ALA B 86 3.712 14.473 -1.231 1.00 0.00 N ATOM 2276 CA ALA B 86 3.728 13.019 -1.130 1.00 0.00 C ATOM 2277 C ALA B 86 5.012 12.537 -0.468 1.00 0.00 C ATOM 2278 O ALA B 86 6.073 12.520 -1.089 1.00 0.00 O ATOM 2279 CB ALA B 86 3.565 12.386 -2.502 1.00 0.00 C ATOM 0 H ALA B 86 4.325 14.855 -1.951 1.00 0.00 H new ATOM 0 HA ALA B 86 2.888 12.712 -0.507 1.00 0.00 H new ATOM 0 HB1 ALA B 86 3.579 11.300 -2.406 1.00 0.00 H new ATOM 0 HB2 ALA B 86 2.616 12.699 -2.937 1.00 0.00 H new ATOM 0 HB3 ALA B 86 4.383 12.704 -3.149 1.00 0.00 H new ATOM 2285 N VAL B 87 4.914 12.160 0.797 1.00 0.00 N ATOM 2286 CA VAL B 87 6.069 11.679 1.540 1.00 0.00 C ATOM 2287 C VAL B 87 5.973 10.170 1.755 1.00 0.00 C ATOM 2288 O VAL B 87 4.994 9.668 2.324 1.00 0.00 O ATOM 2289 CB VAL B 87 6.191 12.387 2.909 1.00 0.00 C ATOM 2290 CG1 VAL B 87 7.481 11.989 3.608 1.00 0.00 C ATOM 2291 CG2 VAL B 87 6.114 13.899 2.747 1.00 0.00 C ATOM 0 H VAL B 87 4.046 12.178 1.332 1.00 0.00 H new ATOM 0 HA VAL B 87 6.957 11.907 0.951 1.00 0.00 H new ATOM 0 HB VAL B 87 5.353 12.069 3.529 1.00 0.00 H new ATOM 0 HG11 VAL B 87 7.546 12.499 4.569 1.00 0.00 H new ATOM 0 HG12 VAL B 87 7.491 10.911 3.768 1.00 0.00 H new ATOM 0 HG13 VAL B 87 8.332 12.272 2.989 1.00 0.00 H new ATOM 0 HG21 VAL B 87 6.202 14.375 3.724 1.00 0.00 H new ATOM 0 HG22 VAL B 87 6.926 14.238 2.104 1.00 0.00 H new ATOM 0 HG23 VAL B 87 5.158 14.169 2.297 1.00 0.00 H new ATOM 2301 N ALA B 88 6.987 9.452 1.296 1.00 0.00 N ATOM 2302 CA ALA B 88 7.020 8.003 1.420 1.00 0.00 C ATOM 2303 C ALA B 88 8.418 7.531 1.788 1.00 0.00 C ATOM 2304 O ALA B 88 9.406 8.176 1.447 1.00 0.00 O ATOM 2305 CB ALA B 88 6.566 7.351 0.121 1.00 0.00 C ATOM 0 H ALA B 88 7.802 9.852 0.832 1.00 0.00 H new ATOM 0 HA ALA B 88 6.336 7.709 2.216 1.00 0.00 H new ATOM 0 HB1 ALA B 88 6.596 6.267 0.228 1.00 0.00 H new ATOM 0 HB2 ALA B 88 5.548 7.665 -0.107 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.229 7.654 -0.689 1.00 0.00 H new ATOM 2311 N GLU B 89 8.503 6.408 2.478 1.00 0.00 N ATOM 2312 CA GLU B 89 9.789 5.867 2.884 1.00 0.00 C ATOM 2313 C GLU B 89 10.188 4.722 1.967 1.00 0.00 C ATOM 2314 O GLU B 89 9.358 3.883 1.608 1.00 0.00 O ATOM 2315 CB GLU B 89 9.734 5.392 4.334 1.00 0.00 C ATOM 2316 CG GLU B 89 9.313 6.478 5.305 1.00 0.00 C ATOM 2317 CD GLU B 89 9.260 5.989 6.735 1.00 0.00 C ATOM 2318 OE1 GLU B 89 8.426 5.112 7.036 1.00 0.00 O ATOM 2319 OE2 GLU B 89 10.037 6.495 7.570 1.00 0.00 O ATOM 0 H GLU B 89 7.698 5.853 2.769 1.00 0.00 H new ATOM 0 HA GLU B 89 10.539 6.655 2.808 1.00 0.00 H new ATOM 0 HB2 GLU B 89 9.038 4.557 4.409 1.00 0.00 H new ATOM 0 HB3 GLU B 89 10.715 5.016 4.623 1.00 0.00 H new ATOM 0 HG2 GLU B 89 10.010 7.313 5.236 1.00 0.00 H new ATOM 0 HG3 GLU B 89 8.332 6.857 5.018 1.00 0.00 H new ATOM 2326 N VAL B 90 11.456 4.701 1.589 1.00 0.00 N ATOM 2327 CA VAL B 90 11.971 3.711 0.658 1.00 0.00 C ATOM 2328 C VAL B 90 12.611 2.551 1.406 1.00 0.00 C ATOM 2329 O VAL B 90 13.479 2.749 2.262 1.00 0.00 O ATOM 2330 CB VAL B 90 13.008 4.333 -0.303 1.00 0.00 C ATOM 2331 CG1 VAL B 90 13.528 3.298 -1.288 1.00 0.00 C ATOM 2332 CG2 VAL B 90 12.407 5.516 -1.044 1.00 0.00 C ATOM 0 H VAL B 90 12.155 5.367 1.918 1.00 0.00 H new ATOM 0 HA VAL B 90 11.127 3.343 0.074 1.00 0.00 H new ATOM 0 HB VAL B 90 13.849 4.687 0.293 1.00 0.00 H new ATOM 0 HG11 VAL B 90 14.256 3.762 -1.953 1.00 0.00 H new ATOM 0 HG12 VAL B 90 14.003 2.483 -0.742 1.00 0.00 H new ATOM 0 HG13 VAL B 90 12.698 2.906 -1.876 1.00 0.00 H new ATOM 0 HG21 VAL B 90 13.152 5.941 -1.716 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.545 5.183 -1.622 1.00 0.00 H new ATOM 0 HG23 VAL B 90 12.092 6.273 -0.326 1.00 0.00 H new ATOM 2342 N TYR B 91 12.182 1.345 1.078 1.00 0.00 N ATOM 2343 CA TYR B 91 12.684 0.144 1.721 1.00 0.00 C ATOM 2344 C TYR B 91 13.266 -0.814 0.693 1.00 0.00 C ATOM 2345 O TYR B 91 12.783 -0.909 -0.437 1.00 0.00 O ATOM 2346 CB TYR B 91 11.567 -0.550 2.501 1.00 0.00 C ATOM 2347 CG TYR B 91 11.077 0.233 3.698 1.00 0.00 C ATOM 2348 CD1 TYR B 91 10.054 1.164 3.572 1.00 0.00 C ATOM 2349 CD2 TYR B 91 11.636 0.038 4.954 1.00 0.00 C ATOM 2350 CE1 TYR B 91 9.605 1.879 4.664 1.00 0.00 C ATOM 2351 CE2 TYR B 91 11.190 0.749 6.050 1.00 0.00 C ATOM 2352 CZ TYR B 91 10.175 1.668 5.898 1.00 0.00 C ATOM 2353 OH TYR B 91 9.725 2.376 6.988 1.00 0.00 O ATOM 0 H TYR B 91 11.478 1.171 0.361 1.00 0.00 H new ATOM 0 HA TYR B 91 13.473 0.436 2.414 1.00 0.00 H new ATOM 0 HB2 TYR B 91 10.728 -0.732 1.830 1.00 0.00 H new ATOM 0 HB3 TYR B 91 11.923 -1.524 2.837 1.00 0.00 H new ATOM 0 HD1 TYR B 91 9.603 1.331 2.605 1.00 0.00 H new ATOM 0 HD2 TYR B 91 12.432 -0.681 5.075 1.00 0.00 H new ATOM 0 HE1 TYR B 91 8.810 2.601 4.550 1.00 0.00 H new ATOM 0 HE2 TYR B 91 11.634 0.586 7.021 1.00 0.00 H new ATOM 0 HH TYR B 91 9.353 3.232 6.691 1.00 0.00 H new ATOM 2363 N ASN B 92 14.311 -1.512 1.089 1.00 0.00 N ATOM 2364 CA ASN B 92 14.928 -2.510 0.236 1.00 0.00 C ATOM 2365 C ASN B 92 14.876 -3.862 0.933 1.00 0.00 C ATOM 2366 O ASN B 92 14.536 -3.936 2.116 1.00 0.00 O ATOM 2367 CB ASN B 92 16.375 -2.117 -0.078 1.00 0.00 C ATOM 2368 CG ASN B 92 16.820 -2.584 -1.450 1.00 0.00 C ATOM 2369 OD1 ASN B 92 16.371 -3.617 -1.950 1.00 0.00 O ATOM 2370 ND2 ASN B 92 17.703 -1.821 -2.074 1.00 0.00 N ATOM 0 H ASN B 92 14.754 -1.406 2.002 1.00 0.00 H new ATOM 0 HA ASN B 92 14.384 -2.573 -0.707 1.00 0.00 H new ATOM 0 HB2 ASN B 92 16.475 -1.033 -0.017 1.00 0.00 H new ATOM 0 HB3 ASN B 92 17.035 -2.541 0.678 1.00 0.00 H new ATOM 0 HD21 ASN B 92 18.036 -2.081 -3.003 1.00 0.00 H new ATOM 0 HD22 ASN B 92 18.051 -0.973 -1.626 1.00 0.00 H new ATOM 2377 N ASP B 93 15.204 -4.923 0.214 1.00 0.00 N ATOM 2378 CA ASP B 93 15.124 -6.266 0.773 1.00 0.00 C ATOM 2379 C ASP B 93 16.251 -6.499 1.775 1.00 0.00 C ATOM 2380 O ASP B 93 17.340 -5.933 1.640 1.00 0.00 O ATOM 2381 CB ASP B 93 15.173 -7.314 -0.340 1.00 0.00 C ATOM 2382 CG ASP B 93 14.867 -8.704 0.172 1.00 0.00 C ATOM 2383 OD1 ASP B 93 13.809 -8.884 0.810 1.00 0.00 O ATOM 2384 OD2 ASP B 93 15.682 -9.620 -0.052 1.00 0.00 O ATOM 0 H ASP B 93 15.527 -4.883 -0.753 1.00 0.00 H new ATOM 0 HA ASP B 93 14.173 -6.363 1.297 1.00 0.00 H new ATOM 0 HB2 ASP B 93 14.457 -7.049 -1.118 1.00 0.00 H new ATOM 0 HB3 ASP B 93 16.161 -7.307 -0.800 1.00 0.00 H new ATOM 2389 N ALA B 94 15.993 -7.347 2.766 1.00 0.00 N ATOM 2390 CA ALA B 94 16.935 -7.588 3.861 1.00 0.00 C ATOM 2391 C ALA B 94 18.069 -8.521 3.442 1.00 0.00 C ATOM 2392 O ALA B 94 18.593 -9.285 4.251 1.00 0.00 O ATOM 2393 CB ALA B 94 16.199 -8.167 5.059 1.00 0.00 C ATOM 0 H ALA B 94 15.130 -7.886 2.835 1.00 0.00 H new ATOM 0 HA ALA B 94 17.380 -6.631 4.132 1.00 0.00 H new ATOM 0 HB1 ALA B 94 16.906 -8.344 5.870 1.00 0.00 H new ATOM 0 HB2 ALA B 94 15.435 -7.464 5.391 1.00 0.00 H new ATOM 0 HB3 ALA B 94 15.728 -9.109 4.776 1.00 0.00 H new ATOM 2399 N THR B 95 18.462 -8.432 2.187 1.00 0.00 N ATOM 2400 CA THR B 95 19.524 -9.270 1.655 1.00 0.00 C ATOM 2401 C THR B 95 20.781 -8.454 1.385 1.00 0.00 C ATOM 2402 O THR B 95 21.892 -8.983 1.390 1.00 0.00 O ATOM 2403 CB THR B 95 19.081 -9.966 0.357 1.00 0.00 C ATOM 2404 OG1 THR B 95 18.229 -9.089 -0.394 1.00 0.00 O ATOM 2405 CG2 THR B 95 18.354 -11.268 0.658 1.00 0.00 C ATOM 0 H THR B 95 18.060 -7.783 1.510 1.00 0.00 H new ATOM 0 HA THR B 95 19.746 -10.027 2.407 1.00 0.00 H new ATOM 0 HB THR B 95 19.969 -10.201 -0.230 1.00 0.00 H new ATOM 0 HG1 THR B 95 17.292 -9.327 -0.234 1.00 0.00 H new ATOM 0 HG21 THR B 95 18.051 -11.740 -0.277 1.00 0.00 H new ATOM 0 HG22 THR B 95 19.018 -11.938 1.205 1.00 0.00 H new ATOM 0 HG23 THR B 95 17.471 -11.060 1.262 1.00 0.00 H new ATOM 2413 N LYS B 96 20.598 -7.160 1.170 1.00 0.00 N ATOM 2414 CA LYS B 96 21.700 -6.275 0.828 1.00 0.00 C ATOM 2415 C LYS B 96 22.400 -5.759 2.079 1.00 0.00 C ATOM 2416 O LYS B 96 21.927 -4.824 2.725 1.00 0.00 O ATOM 2417 CB LYS B 96 21.187 -5.100 -0.003 1.00 0.00 C ATOM 2418 CG LYS B 96 20.613 -5.505 -1.351 1.00 0.00 C ATOM 2419 CD LYS B 96 19.847 -4.360 -1.990 1.00 0.00 C ATOM 2420 CE LYS B 96 19.346 -4.712 -3.382 1.00 0.00 C ATOM 2421 NZ LYS B 96 20.455 -4.786 -4.373 1.00 0.00 N ATOM 0 H LYS B 96 19.691 -6.698 1.227 1.00 0.00 H new ATOM 0 HA LYS B 96 22.423 -6.844 0.244 1.00 0.00 H new ATOM 0 HB2 LYS B 96 20.420 -4.574 0.565 1.00 0.00 H new ATOM 0 HB3 LYS B 96 22.004 -4.396 -0.163 1.00 0.00 H new ATOM 0 HG2 LYS B 96 21.420 -5.820 -2.013 1.00 0.00 H new ATOM 0 HG3 LYS B 96 19.952 -6.362 -1.225 1.00 0.00 H new ATOM 0 HD2 LYS B 96 19.000 -4.093 -1.357 1.00 0.00 H new ATOM 0 HD3 LYS B 96 20.490 -3.482 -2.048 1.00 0.00 H new ATOM 0 HE2 LYS B 96 18.826 -5.669 -3.348 1.00 0.00 H new ATOM 0 HE3 LYS B 96 18.620 -3.966 -3.705 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 20.061 -4.927 -5.325 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 20.999 -3.900 -4.352 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 21.080 -5.582 -4.135 1.00 0.00 H new ATOM 2435 N LEU B 97 23.524 -6.372 2.418 1.00 0.00 N ATOM 2436 CA LEU B 97 24.306 -5.945 3.568 1.00 0.00 C ATOM 2437 C LEU B 97 25.456 -5.051 3.124 1.00 0.00 C ATOM 2438 O LEU B 97 25.677 -4.858 1.925 1.00 0.00 O ATOM 2439 CB LEU B 97 24.846 -7.158 4.333 1.00 0.00 C ATOM 2440 CG LEU B 97 23.783 -8.061 4.964 1.00 0.00 C ATOM 2441 CD1 LEU B 97 24.435 -9.222 5.698 1.00 0.00 C ATOM 2442 CD2 LEU B 97 22.898 -7.264 5.911 1.00 0.00 C ATOM 0 H LEU B 97 23.915 -7.167 1.913 1.00 0.00 H new ATOM 0 HA LEU B 97 23.656 -5.377 4.233 1.00 0.00 H new ATOM 0 HB2 LEU B 97 25.450 -7.757 3.651 1.00 0.00 H new ATOM 0 HB3 LEU B 97 25.511 -6.803 5.120 1.00 0.00 H new ATOM 0 HG LEU B 97 23.159 -8.464 4.166 1.00 0.00 H new ATOM 0 HD11 LEU B 97 23.663 -9.853 6.140 1.00 0.00 H new ATOM 0 HD12 LEU B 97 25.026 -9.810 4.996 1.00 0.00 H new ATOM 0 HD13 LEU B 97 25.083 -8.837 6.485 1.00 0.00 H new ATOM 0 HD21 LEU B 97 22.149 -7.923 6.350 1.00 0.00 H new ATOM 0 HD22 LEU B 97 23.509 -6.832 6.703 1.00 0.00 H new ATOM 0 HD23 LEU B 97 22.401 -6.466 5.360 1.00 0.00 H new ATOM 2454 N GLU B 98 26.172 -4.495 4.086 1.00 0.00 N ATOM 2455 CA GLU B 98 27.298 -3.623 3.792 1.00 0.00 C ATOM 2456 C GLU B 98 28.515 -4.444 3.374 1.00 0.00 C ATOM 2457 O GLU B 98 28.990 -5.295 4.129 1.00 0.00 O ATOM 2458 CB GLU B 98 27.632 -2.764 5.015 1.00 0.00 C ATOM 2459 CG GLU B 98 28.748 -1.766 4.772 1.00 0.00 C ATOM 2460 CD GLU B 98 28.399 -0.754 3.701 1.00 0.00 C ATOM 2461 OE1 GLU B 98 28.510 -1.086 2.504 1.00 0.00 O ATOM 2462 OE2 GLU B 98 28.026 0.382 4.052 1.00 0.00 O ATOM 0 H GLU B 98 25.993 -4.632 5.081 1.00 0.00 H new ATOM 0 HA GLU B 98 27.024 -2.967 2.965 1.00 0.00 H new ATOM 0 HB2 GLU B 98 26.736 -2.226 5.326 1.00 0.00 H new ATOM 0 HB3 GLU B 98 27.914 -3.417 5.841 1.00 0.00 H new ATOM 0 HG2 GLU B 98 28.972 -1.243 5.702 1.00 0.00 H new ATOM 0 HG3 GLU B 98 29.652 -2.301 4.481 1.00 0.00 H new ATOM 2469 N HIS B 99 29.019 -4.182 2.174 1.00 0.00 N ATOM 2470 CA HIS B 99 30.161 -4.920 1.649 1.00 0.00 C ATOM 2471 C HIS B 99 31.465 -4.280 2.099 1.00 0.00 C ATOM 2472 O HIS B 99 32.170 -3.659 1.303 1.00 0.00 O ATOM 2473 CB HIS B 99 30.128 -4.984 0.120 1.00 0.00 C ATOM 2474 CG HIS B 99 28.990 -5.774 -0.444 1.00 0.00 C ATOM 2475 ND1 HIS B 99 29.114 -7.085 -0.840 1.00 0.00 N ATOM 2476 CD2 HIS B 99 27.708 -5.424 -0.702 1.00 0.00 C ATOM 2477 CE1 HIS B 99 27.960 -7.509 -1.319 1.00 0.00 C ATOM 2478 NE2 HIS B 99 27.088 -6.519 -1.248 1.00 0.00 N ATOM 0 H HIS B 99 28.655 -3.465 1.547 1.00 0.00 H new ATOM 0 HA HIS B 99 30.101 -5.935 2.042 1.00 0.00 H new ATOM 0 HB2 HIS B 99 30.078 -3.968 -0.272 1.00 0.00 H new ATOM 0 HB3 HIS B 99 31.064 -5.417 -0.233 1.00 0.00 H new ATOM 0 HD2 HIS B 99 27.257 -4.461 -0.513 1.00 0.00 H new ATOM 0 HE1 HIS B 99 27.762 -8.498 -1.704 1.00 0.00 H new ATOM 0 HE2 HIS B 99 26.114 -6.562 -1.549 1.00 0.00 H new ATOM 2487 N HIS B 100 31.763 -4.397 3.384 1.00 0.00 N ATOM 2488 CA HIS B 100 33.004 -3.862 3.933 1.00 0.00 C ATOM 2489 C HIS B 100 33.527 -4.751 5.052 1.00 0.00 C ATOM 2490 O HIS B 100 33.224 -4.533 6.225 1.00 0.00 O ATOM 2491 CB HIS B 100 32.820 -2.429 4.455 1.00 0.00 C ATOM 2492 CG HIS B 100 32.668 -1.390 3.382 1.00 0.00 C ATOM 2493 ND1 HIS B 100 33.690 -1.024 2.535 1.00 0.00 N ATOM 2494 CD2 HIS B 100 31.603 -0.634 3.026 1.00 0.00 C ATOM 2495 CE1 HIS B 100 33.262 -0.088 1.708 1.00 0.00 C ATOM 2496 NE2 HIS B 100 31.999 0.165 1.983 1.00 0.00 N ATOM 0 H HIS B 100 31.163 -4.858 4.068 1.00 0.00 H new ATOM 0 HA HIS B 100 33.732 -3.841 3.122 1.00 0.00 H new ATOM 0 HB2 HIS B 100 31.940 -2.400 5.098 1.00 0.00 H new ATOM 0 HB3 HIS B 100 33.677 -2.169 5.076 1.00 0.00 H new ATOM 0 HD2 HIS B 100 30.623 -0.656 3.479 1.00 0.00 H new ATOM 0 HE1 HIS B 100 33.848 0.389 0.937 1.00 0.00 H new ATOM 0 HE2 HIS B 100 31.411 0.844 1.500 1.00 0.00 H new ATOM 2505 N HIS B 101 34.270 -5.783 4.681 1.00 0.00 N ATOM 2506 CA HIS B 101 34.922 -6.653 5.653 1.00 0.00 C ATOM 2507 C HIS B 101 36.338 -6.975 5.195 1.00 0.00 C ATOM 2508 O HIS B 101 36.538 -7.583 4.144 1.00 0.00 O ATOM 2509 CB HIS B 101 34.126 -7.948 5.861 1.00 0.00 C ATOM 2510 CG HIS B 101 32.813 -7.747 6.555 1.00 0.00 C ATOM 2511 ND1 HIS B 101 32.702 -7.567 7.917 1.00 0.00 N ATOM 2512 CD2 HIS B 101 31.551 -7.690 6.068 1.00 0.00 C ATOM 2513 CE1 HIS B 101 31.431 -7.411 8.238 1.00 0.00 C ATOM 2514 NE2 HIS B 101 30.711 -7.482 7.133 1.00 0.00 N ATOM 0 H HIS B 101 34.438 -6.041 3.709 1.00 0.00 H new ATOM 0 HA HIS B 101 34.963 -6.127 6.607 1.00 0.00 H new ATOM 0 HB2 HIS B 101 33.946 -8.413 4.891 1.00 0.00 H new ATOM 0 HB3 HIS B 101 34.730 -8.645 6.442 1.00 0.00 H new ATOM 0 HD2 HIS B 101 31.259 -7.790 5.033 1.00 0.00 H new ATOM 0 HE1 HIS B 101 31.046 -7.252 9.234 1.00 0.00 H new ATOM 0 HE2 HIS B 101 29.696 -7.396 7.080 1.00 0.00 H new ATOM 2523 N HIS B 102 37.317 -6.541 5.973 1.00 0.00 N ATOM 2524 CA HIS B 102 38.721 -6.767 5.651 1.00 0.00 C ATOM 2525 C HIS B 102 39.364 -7.706 6.659 1.00 0.00 C ATOM 2526 O HIS B 102 39.724 -7.284 7.759 1.00 0.00 O ATOM 2527 CB HIS B 102 39.494 -5.446 5.637 1.00 0.00 C ATOM 2528 CG HIS B 102 39.335 -4.646 4.384 1.00 0.00 C ATOM 2529 ND1 HIS B 102 40.409 -4.168 3.666 1.00 0.00 N ATOM 2530 CD2 HIS B 102 38.230 -4.231 3.725 1.00 0.00 C ATOM 2531 CE1 HIS B 102 39.972 -3.494 2.622 1.00 0.00 C ATOM 2532 NE2 HIS B 102 38.653 -3.518 2.631 1.00 0.00 N ATOM 0 H HIS B 102 37.165 -6.026 6.840 1.00 0.00 H new ATOM 0 HA HIS B 102 38.761 -7.220 4.661 1.00 0.00 H new ATOM 0 HB2 HIS B 102 39.169 -4.841 6.483 1.00 0.00 H new ATOM 0 HB3 HIS B 102 40.553 -5.658 5.785 1.00 0.00 H new ATOM 0 HD2 HIS B 102 37.205 -4.424 4.007 1.00 0.00 H new ATOM 0 HE1 HIS B 102 40.589 -3.004 1.883 1.00 0.00 H new ATOM 0 HE2 HIS B 102 38.047 -3.079 1.938 1.00 0.00 H new ATOM 2541 N HIS B 103 39.497 -8.974 6.293 1.00 0.00 N ATOM 2542 CA HIS B 103 40.154 -9.944 7.162 1.00 0.00 C ATOM 2543 C HIS B 103 40.504 -11.209 6.388 1.00 0.00 C ATOM 2544 O HIS B 103 41.606 -11.743 6.511 1.00 0.00 O ATOM 2545 CB HIS B 103 39.256 -10.296 8.350 1.00 0.00 C ATOM 2546 CG HIS B 103 39.996 -10.921 9.491 1.00 0.00 C ATOM 2547 ND1 HIS B 103 40.447 -10.200 10.572 1.00 0.00 N ATOM 2548 CD2 HIS B 103 40.368 -12.202 9.715 1.00 0.00 C ATOM 2549 CE1 HIS B 103 41.067 -11.008 11.410 1.00 0.00 C ATOM 2550 NE2 HIS B 103 41.033 -12.229 10.915 1.00 0.00 N ATOM 0 H HIS B 103 39.162 -9.354 5.408 1.00 0.00 H new ATOM 0 HA HIS B 103 41.074 -9.494 7.535 1.00 0.00 H new ATOM 0 HB2 HIS B 103 38.759 -9.391 8.701 1.00 0.00 H new ATOM 0 HB3 HIS B 103 38.475 -10.979 8.016 1.00 0.00 H new ATOM 0 HD2 HIS B 103 40.177 -13.047 9.069 1.00 0.00 H new ATOM 0 HE1 HIS B 103 41.525 -10.718 12.344 1.00 0.00 H new ATOM 0 HE2 HIS B 103 41.435 -13.058 11.352 1.00 0.00 H new ATOM 2559 N HIS B 104 39.564 -11.674 5.586 1.00 0.00 N ATOM 2560 CA HIS B 104 39.735 -12.906 4.838 1.00 0.00 C ATOM 2561 C HIS B 104 39.515 -12.645 3.356 1.00 0.00 C ATOM 2562 O HIS B 104 38.356 -12.409 2.964 1.00 0.00 O ATOM 2563 CB HIS B 104 38.760 -13.973 5.342 1.00 0.00 C ATOM 2564 CG HIS B 104 38.953 -15.318 4.713 1.00 0.00 C ATOM 2565 ND1 HIS B 104 39.781 -16.283 5.244 1.00 0.00 N ATOM 2566 CD2 HIS B 104 38.414 -15.863 3.597 1.00 0.00 C ATOM 2567 CE1 HIS B 104 39.744 -17.358 4.483 1.00 0.00 C ATOM 2568 NE2 HIS B 104 38.923 -17.133 3.476 1.00 0.00 N ATOM 2569 OXT HIS B 104 40.500 -12.680 2.594 1.00 0.00 O ATOM 0 H HIS B 104 38.667 -11.213 5.435 1.00 0.00 H new ATOM 0 HA HIS B 104 40.751 -13.271 4.985 1.00 0.00 H new ATOM 0 HB2 HIS B 104 38.869 -14.069 6.422 1.00 0.00 H new ATOM 0 HB3 HIS B 104 37.740 -13.637 5.153 1.00 0.00 H new ATOM 0 HD2 HIS B 104 37.714 -15.387 2.926 1.00 0.00 H new ATOM 0 HE1 HIS B 104 40.294 -18.271 4.655 1.00 0.00 H new ATOM 0 HE2 HIS B 104 38.702 -17.793 2.730 1.00 0.00 H new TER 2578 HIS B 104