USER MOD reduce.3.24.130724 H: found=0, std=0, add=1234, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1234 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: A 45 LYS NZ :NH3+ 160:sc= 2.03 (180deg=1.15) USER MOD Set 1.2: B 65 ASN : amide:sc= 0.756 K(o=2.8,f=-4.3!) USER MOD Set 2.1: A 56 LYS NZ :NH3+ -175:sc= 1.28 (180deg=1.15) USER MOD Set 2.2: B 75 ASN : amide:sc= 0.909 K(o=2.2,f=1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 107:sc= 1.36 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.569 X(o=-0.57,f=-0.3) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0.143 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -149:sc= -0.641 (180deg=-2!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -90:sc= 0.887 USER MOD Single : A 18 ASN : amide:sc= -0.218 X(o=-0.22,f=-0.0055) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00966 USER MOD Single : A 30 SER OG : rot 180:sc= 0.0879 USER MOD Single : A 31 SER OG : rot 180:sc= 0.148 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 138:sc= 1.67 (180deg=0.103) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : A 40 ASN : amide:sc= -0.0608 X(o=-0.061,f=-0.055) USER MOD Single : A 46 HIS : no HD1:sc= -0.0131 X(o=-0.013,f=-0.34) USER MOD Single : A 47 THR OG1 : rot 77:sc= 1.24 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 CYS SG : rot 75:sc= -4.98! USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0.0713 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 GLN : amide:sc= 0.784 K(o=0.78,f=0) USER MOD Single : A 70 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 73 LYS NZ :NH3+ -170:sc= 1.3 (180deg=1.13) USER MOD Single : A 75 ASN : amide:sc= 0.385 X(o=0.38,f=-0.018) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -170:sc= 0 (180deg=-0.132) USER MOD Single : B 2 SER OG : rot 180:sc= 0.0997 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 HIS : no HD1:sc= -0.368 X(o=-0.37,f=-0.17) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 SER OG : rot 180:sc= 0.0872 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 MET CE :methyl 172:sc=-0.00478 (180deg=-0.145) USER MOD Single : B 14 THR OG1 : rot 180:sc= 0.129 USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0.14 USER MOD Single : B 30 SER OG : rot 180:sc= 0.151 USER MOD Single : B 31 SER OG : rot 180:sc= 0.0666 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -174:sc= 1.29 (180deg=1.02) USER MOD Single : B 38 ASN : amide:sc= 0 X(o=0,f=-0.096) USER MOD Single : B 40 ASN : amide:sc= -0.0114 X(o=-0.011,f=-0.27) USER MOD Single : B 45 LYS NZ :NH3+ -159:sc= 0.658 (180deg=-0.0146) USER MOD Single : B 46 HIS : no HE2:sc= 1.03 K(o=1,f=-6!) USER MOD Single : B 47 THR OG1 : rot 64:sc= 1.12 USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 CYS SG : rot 63:sc= -1.06 USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 THR OG1 : rot 172:sc= 1.06 USER MOD Single : B 59 SER OG : rot 81:sc= 0.0997 USER MOD Single : B 61 THR OG1 : rot 180:sc= 0.116 USER MOD Single : B 66 GLN : amide:sc= 1.21 K(o=1.2,f=-1.2) USER MOD Single : B 70 ASN : amide:sc= 0.643 K(o=0.64,f=0) USER MOD Single : B 73 LYS NZ :NH3+ 174:sc= 1.3 (180deg=1.28) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -77.004 41.729 -38.513 1.00 52.69 N ATOM 2 CA MET A 1 -76.895 40.259 -38.394 1.00 52.68 C ATOM 3 C MET A 1 -76.099 39.692 -39.563 1.00 52.43 C ATOM 4 O MET A 1 -76.629 39.514 -40.658 1.00 52.55 O ATOM 5 CB MET A 1 -78.307 39.661 -38.369 1.00 52.98 C ATOM 6 CG MET A 1 -78.335 38.163 -38.113 1.00 53.17 C ATOM 7 SD MET A 1 -80.010 37.492 -38.109 1.00 53.83 S ATOM 8 CE MET A 1 -80.233 37.128 -39.850 1.00 54.20 C ATOM 0 H1 MET A 1 -77.549 42.103 -37.710 1.00 52.69 H new ATOM 0 H2 MET A 1 -76.053 42.149 -38.511 1.00 52.69 H new ATOM 0 H3 MET A 1 -77.487 41.970 -39.402 1.00 52.69 H new ATOM 0 HA MET A 1 -76.372 40.002 -37.473 1.00 52.68 H new ATOM 0 HB2 MET A 1 -78.890 40.163 -37.597 1.00 52.98 H new ATOM 0 HB3 MET A 1 -78.795 39.866 -39.322 1.00 52.98 H new ATOM 0 HG2 MET A 1 -77.746 37.656 -38.878 1.00 53.17 H new ATOM 0 HG3 MET A 1 -77.861 37.953 -37.154 1.00 53.17 H new ATOM 0 HE1 MET A 1 -81.225 36.705 -40.009 1.00 54.20 H new ATOM 0 HE2 MET A 1 -80.133 38.046 -40.429 1.00 54.20 H new ATOM 0 HE3 MET A 1 -79.477 36.411 -40.172 1.00 54.20 H new ATOM 20 N SER A 2 -74.810 39.485 -39.348 1.00 52.13 N ATOM 21 CA SER A 2 -73.932 39.005 -40.401 1.00 51.92 C ATOM 22 C SER A 2 -73.700 37.504 -40.260 1.00 51.30 C ATOM 23 O SER A 2 -74.070 36.901 -39.248 1.00 50.91 O ATOM 24 CB SER A 2 -72.604 39.758 -40.344 1.00 51.94 C ATOM 25 OG SER A 2 -72.398 40.323 -39.056 1.00 52.25 O ATOM 0 H SER A 2 -74.349 39.642 -38.452 1.00 52.13 H new ATOM 0 HA SER A 2 -74.403 39.187 -41.367 1.00 51.92 H new ATOM 0 HB2 SER A 2 -71.785 39.079 -40.583 1.00 51.94 H new ATOM 0 HB3 SER A 2 -72.595 40.546 -41.097 1.00 51.94 H new ATOM 0 HG SER A 2 -71.703 39.818 -38.584 1.00 52.25 H new ATOM 31 N LEU A 3 -73.086 36.902 -41.268 1.00 51.24 N ATOM 32 CA LEU A 3 -72.787 35.478 -41.241 1.00 50.73 C ATOM 33 C LEU A 3 -71.524 35.225 -40.431 1.00 49.93 C ATOM 34 O LEU A 3 -70.427 35.128 -40.986 1.00 49.72 O ATOM 35 CB LEU A 3 -72.627 34.942 -42.668 1.00 50.73 C ATOM 36 CG LEU A 3 -73.788 34.085 -43.181 1.00 51.38 C ATOM 37 CD1 LEU A 3 -73.631 32.646 -42.718 1.00 51.29 C ATOM 38 CD2 LEU A 3 -75.123 34.652 -42.723 1.00 51.81 C ATOM 0 H LEU A 3 -72.784 37.379 -42.117 1.00 51.24 H new ATOM 0 HA LEU A 3 -73.616 34.952 -40.767 1.00 50.73 H new ATOM 0 HB2 LEU A 3 -72.496 35.788 -43.343 1.00 50.73 H new ATOM 0 HB3 LEU A 3 -71.712 34.351 -42.716 1.00 50.73 H new ATOM 0 HG LEU A 3 -73.769 34.102 -44.271 1.00 51.38 H new ATOM 0 HD11 LEU A 3 -74.464 32.051 -43.091 1.00 51.29 H new ATOM 0 HD12 LEU A 3 -72.695 32.240 -43.102 1.00 51.29 H new ATOM 0 HD13 LEU A 3 -73.621 32.613 -41.629 1.00 51.29 H new ATOM 0 HD21 LEU A 3 -75.932 34.027 -43.100 1.00 51.81 H new ATOM 0 HD22 LEU A 3 -75.156 34.671 -41.634 1.00 51.81 H new ATOM 0 HD23 LEU A 3 -75.239 35.665 -43.107 1.00 51.81 H new ATOM 50 N GLU A 4 -71.677 35.236 -39.112 1.00 49.54 N ATOM 51 CA GLU A 4 -70.547 35.103 -38.203 1.00 48.79 C ATOM 52 C GLU A 4 -69.828 33.774 -38.410 1.00 48.08 C ATOM 53 O GLU A 4 -70.378 32.703 -38.138 1.00 47.64 O ATOM 54 CB GLU A 4 -71.021 35.232 -36.755 1.00 48.81 C ATOM 55 CG GLU A 4 -71.637 36.585 -36.439 1.00 49.11 C ATOM 56 CD GLU A 4 -70.718 37.736 -36.793 1.00 49.00 C ATOM 57 OE1 GLU A 4 -69.624 37.836 -36.204 1.00 48.89 O ATOM 58 OE2 GLU A 4 -71.082 38.545 -37.669 1.00 49.07 O ATOM 0 H GLU A 4 -72.579 35.336 -38.647 1.00 49.54 H new ATOM 0 HA GLU A 4 -69.840 35.904 -38.418 1.00 48.79 H new ATOM 0 HB2 GLU A 4 -71.753 34.451 -36.549 1.00 48.81 H new ATOM 0 HB3 GLU A 4 -70.176 35.061 -36.088 1.00 48.81 H new ATOM 0 HG2 GLU A 4 -72.574 36.691 -36.986 1.00 49.11 H new ATOM 0 HG3 GLU A 4 -71.880 36.631 -35.377 1.00 49.11 H new ATOM 65 N LYS A 5 -68.601 33.856 -38.896 1.00 48.00 N ATOM 66 CA LYS A 5 -67.795 32.671 -39.147 1.00 47.39 C ATOM 67 C LYS A 5 -66.786 32.465 -38.021 1.00 46.83 C ATOM 68 O LYS A 5 -66.709 31.381 -37.441 1.00 46.53 O ATOM 69 CB LYS A 5 -67.068 32.796 -40.488 1.00 47.60 C ATOM 70 CG LYS A 5 -68.006 32.902 -41.680 1.00 48.09 C ATOM 71 CD LYS A 5 -67.357 32.370 -42.946 1.00 48.48 C ATOM 72 CE LYS A 5 -67.753 33.194 -44.161 1.00 49.07 C ATOM 73 NZ LYS A 5 -66.591 33.914 -44.746 1.00 49.26 N ATOM 0 H LYS A 5 -68.138 34.735 -39.126 1.00 48.00 H new ATOM 0 HA LYS A 5 -68.457 31.806 -39.186 1.00 47.39 H new ATOM 0 HB2 LYS A 5 -66.425 33.676 -40.463 1.00 47.60 H new ATOM 0 HB3 LYS A 5 -66.419 31.931 -40.622 1.00 47.60 H new ATOM 0 HG2 LYS A 5 -68.920 32.344 -41.476 1.00 48.09 H new ATOM 0 HG3 LYS A 5 -68.294 33.943 -41.827 1.00 48.09 H new ATOM 0 HD2 LYS A 5 -66.273 32.382 -42.834 1.00 48.48 H new ATOM 0 HD3 LYS A 5 -67.650 31.331 -43.098 1.00 48.48 H new ATOM 0 HE2 LYS A 5 -68.192 32.541 -44.915 1.00 49.07 H new ATOM 0 HE3 LYS A 5 -68.520 33.914 -43.877 1.00 49.07 H new ATOM 0 HZ1 LYS A 5 -66.903 34.464 -45.572 1.00 49.26 H new ATOM 0 HZ2 LYS A 5 -66.187 34.556 -44.035 1.00 49.26 H new ATOM 0 HZ3 LYS A 5 -65.869 33.226 -45.041 1.00 49.26 H new ATOM 87 N ALA A 6 -66.016 33.519 -37.738 1.00 46.75 N ATOM 88 CA ALA A 6 -64.982 33.494 -36.700 1.00 46.29 C ATOM 89 C ALA A 6 -63.881 32.490 -37.040 1.00 45.95 C ATOM 90 O ALA A 6 -63.860 31.924 -38.135 1.00 46.32 O ATOM 91 CB ALA A 6 -65.590 33.196 -35.335 1.00 46.58 C ATOM 0 H ALA A 6 -66.092 34.414 -38.222 1.00 46.75 H new ATOM 0 HA ALA A 6 -64.527 34.484 -36.659 1.00 46.29 H new ATOM 0 HB1 ALA A 6 -64.803 33.183 -34.581 1.00 46.58 H new ATOM 0 HB2 ALA A 6 -66.319 33.967 -35.085 1.00 46.58 H new ATOM 0 HB3 ALA A 6 -66.084 32.225 -35.361 1.00 46.58 H new ATOM 97 N HIS A 7 -62.960 32.278 -36.111 1.00 45.30 N ATOM 98 CA HIS A 7 -61.870 31.340 -36.320 1.00 44.97 C ATOM 99 C HIS A 7 -61.497 30.669 -35.003 1.00 44.39 C ATOM 100 O HIS A 7 -60.384 30.831 -34.499 1.00 43.96 O ATOM 101 CB HIS A 7 -60.654 32.051 -36.922 1.00 44.96 C ATOM 102 CG HIS A 7 -60.286 31.550 -38.289 1.00 45.01 C ATOM 103 ND1 HIS A 7 -59.118 31.898 -38.939 1.00 44.94 N ATOM 104 CD2 HIS A 7 -60.942 30.713 -39.130 1.00 45.18 C ATOM 105 CE1 HIS A 7 -59.076 31.300 -40.114 1.00 45.06 C ATOM 106 NE2 HIS A 7 -60.167 30.577 -40.253 1.00 45.21 N ATOM 0 H HIS A 7 -62.947 32.745 -35.204 1.00 45.30 H new ATOM 0 HA HIS A 7 -62.200 30.575 -37.023 1.00 44.97 H new ATOM 0 HB2 HIS A 7 -60.859 33.120 -36.978 1.00 44.96 H new ATOM 0 HB3 HIS A 7 -59.801 31.924 -36.255 1.00 44.96 H new ATOM 0 HD2 HIS A 7 -61.897 30.241 -38.949 1.00 45.18 H new ATOM 0 HE1 HIS A 7 -58.281 31.389 -40.839 1.00 45.06 H new ATOM 0 HE2 HIS A 7 -60.399 30.007 -41.066 1.00 45.21 H new ATOM 115 N THR A 8 -62.462 29.964 -34.428 1.00 44.44 N ATOM 116 CA THR A 8 -62.286 29.320 -33.134 1.00 43.96 C ATOM 117 C THR A 8 -61.493 28.018 -33.254 1.00 43.67 C ATOM 118 O THR A 8 -61.975 26.943 -32.891 1.00 43.66 O ATOM 119 CB THR A 8 -63.655 29.034 -32.495 1.00 44.29 C ATOM 120 OG1 THR A 8 -64.686 29.161 -33.486 1.00 44.86 O ATOM 121 CG2 THR A 8 -63.930 29.997 -31.350 1.00 43.97 C ATOM 0 H THR A 8 -63.383 29.823 -34.843 1.00 44.44 H new ATOM 0 HA THR A 8 -61.720 30.003 -32.501 1.00 43.96 H new ATOM 0 HB THR A 8 -63.645 28.018 -32.100 1.00 44.29 H new ATOM 0 HG1 THR A 8 -65.557 28.977 -33.077 1.00 44.86 H new ATOM 0 HG21 THR A 8 -64.904 29.775 -30.914 1.00 43.97 H new ATOM 0 HG22 THR A 8 -63.158 29.887 -30.589 1.00 43.97 H new ATOM 0 HG23 THR A 8 -63.926 31.020 -31.726 1.00 43.97 H new ATOM 129 N SER A 9 -60.267 28.133 -33.740 1.00 43.50 N ATOM 130 CA SER A 9 -59.377 26.994 -33.874 1.00 43.27 C ATOM 131 C SER A 9 -57.935 27.442 -33.675 1.00 42.89 C ATOM 132 O SER A 9 -57.341 28.062 -34.558 1.00 42.78 O ATOM 133 CB SER A 9 -59.546 26.336 -35.248 1.00 43.30 C ATOM 134 OG SER A 9 -60.432 27.087 -36.074 1.00 43.56 O ATOM 0 H SER A 9 -59.863 29.016 -34.051 1.00 43.50 H new ATOM 0 HA SER A 9 -59.630 26.258 -33.111 1.00 43.27 H new ATOM 0 HB2 SER A 9 -58.575 26.251 -35.735 1.00 43.30 H new ATOM 0 HB3 SER A 9 -59.930 25.324 -35.124 1.00 43.30 H new ATOM 0 HG SER A 9 -60.520 26.646 -36.945 1.00 43.56 H new ATOM 140 N VAL A 10 -57.407 27.191 -32.486 1.00 42.75 N ATOM 141 CA VAL A 10 -56.050 27.596 -32.137 1.00 42.43 C ATOM 142 C VAL A 10 -55.371 26.507 -31.309 1.00 41.60 C ATOM 143 O VAL A 10 -55.790 25.349 -31.337 1.00 41.43 O ATOM 144 CB VAL A 10 -56.032 28.927 -31.349 1.00 42.78 C ATOM 145 CG1 VAL A 10 -55.919 30.108 -32.298 1.00 43.09 C ATOM 146 CG2 VAL A 10 -57.269 29.061 -30.471 1.00 43.59 C ATOM 0 H VAL A 10 -57.902 26.704 -31.739 1.00 42.75 H new ATOM 0 HA VAL A 10 -55.506 27.746 -33.069 1.00 42.43 H new ATOM 0 HB VAL A 10 -55.157 28.921 -30.698 1.00 42.78 H new ATOM 0 HG11 VAL A 10 -55.908 31.035 -31.725 1.00 43.09 H new ATOM 0 HG12 VAL A 10 -54.997 30.026 -32.873 1.00 43.09 H new ATOM 0 HG13 VAL A 10 -56.771 30.112 -32.978 1.00 43.09 H new ATOM 0 HG21 VAL A 10 -57.230 30.006 -29.929 1.00 43.59 H new ATOM 0 HG22 VAL A 10 -58.162 29.038 -31.095 1.00 43.59 H new ATOM 0 HG23 VAL A 10 -57.302 28.236 -29.760 1.00 43.59 H new ATOM 156 N LYS A 11 -54.330 26.871 -30.574 1.00 41.14 N ATOM 157 CA LYS A 11 -53.617 25.910 -29.748 1.00 40.38 C ATOM 158 C LYS A 11 -53.515 26.412 -28.315 1.00 39.65 C ATOM 159 O LYS A 11 -52.428 26.725 -27.826 1.00 39.62 O ATOM 160 CB LYS A 11 -52.224 25.646 -30.320 1.00 40.21 C ATOM 161 CG LYS A 11 -52.169 24.437 -31.236 1.00 40.53 C ATOM 162 CD LYS A 11 -52.083 24.846 -32.700 1.00 40.45 C ATOM 163 CE LYS A 11 -53.344 24.476 -33.467 1.00 40.17 C ATOM 164 NZ LYS A 11 -53.870 23.145 -33.070 1.00 40.27 N ATOM 0 H LYS A 11 -53.962 27.821 -30.533 1.00 41.14 H new ATOM 0 HA LYS A 11 -54.175 24.974 -29.747 1.00 40.38 H new ATOM 0 HB2 LYS A 11 -51.893 26.526 -30.871 1.00 40.21 H new ATOM 0 HB3 LYS A 11 -51.523 25.502 -29.498 1.00 40.21 H new ATOM 0 HG2 LYS A 11 -51.306 23.823 -30.978 1.00 40.53 H new ATOM 0 HG3 LYS A 11 -53.055 23.822 -31.081 1.00 40.53 H new ATOM 0 HD2 LYS A 11 -51.919 25.922 -32.768 1.00 40.45 H new ATOM 0 HD3 LYS A 11 -51.222 24.363 -33.162 1.00 40.45 H new ATOM 0 HE2 LYS A 11 -54.108 25.234 -33.294 1.00 40.17 H new ATOM 0 HE3 LYS A 11 -53.131 24.477 -34.536 1.00 40.17 H new ATOM 0 HZ1 LYS A 11 -54.342 22.701 -33.884 1.00 40.27 H new ATOM 0 HZ2 LYS A 11 -53.084 22.541 -32.754 1.00 40.27 H new ATOM 0 HZ3 LYS A 11 -54.553 23.259 -32.294 1.00 40.27 H new ATOM 178 N LYS A 12 -54.657 26.504 -27.648 1.00 39.13 N ATOM 179 CA LYS A 12 -54.697 26.969 -26.271 1.00 38.46 C ATOM 180 C LYS A 12 -54.288 25.849 -25.321 1.00 37.88 C ATOM 181 O LYS A 12 -54.367 24.671 -25.678 1.00 37.85 O ATOM 182 CB LYS A 12 -56.094 27.477 -25.921 1.00 38.37 C ATOM 183 CG LYS A 12 -56.104 28.874 -25.318 1.00 38.40 C ATOM 184 CD LYS A 12 -56.270 29.948 -26.385 1.00 38.58 C ATOM 185 CE LYS A 12 -54.944 30.300 -27.043 1.00 38.68 C ATOM 186 NZ LYS A 12 -54.252 31.415 -26.344 1.00 38.69 N ATOM 0 H LYS A 12 -55.568 26.262 -28.039 1.00 39.13 H new ATOM 0 HA LYS A 12 -53.991 27.792 -26.163 1.00 38.46 H new ATOM 0 HB2 LYS A 12 -56.708 27.475 -26.822 1.00 38.37 H new ATOM 0 HB3 LYS A 12 -56.557 26.784 -25.218 1.00 38.37 H new ATOM 0 HG2 LYS A 12 -56.915 28.952 -24.594 1.00 38.40 H new ATOM 0 HG3 LYS A 12 -55.174 29.042 -24.774 1.00 38.40 H new ATOM 0 HD2 LYS A 12 -56.972 29.601 -27.144 1.00 38.58 H new ATOM 0 HD3 LYS A 12 -56.702 30.843 -25.936 1.00 38.58 H new ATOM 0 HE2 LYS A 12 -54.299 29.421 -27.051 1.00 38.68 H new ATOM 0 HE3 LYS A 12 -55.118 30.577 -28.083 1.00 38.68 H new ATOM 0 HZ1 LYS A 12 -53.354 31.622 -26.825 1.00 38.69 H new ATOM 0 HZ2 LYS A 12 -54.856 32.262 -26.359 1.00 38.69 H new ATOM 0 HZ3 LYS A 12 -54.062 31.142 -25.359 1.00 38.69 H new ATOM 200 N MET A 13 -53.799 26.235 -24.145 1.00 37.50 N ATOM 201 CA MET A 13 -53.296 25.294 -23.148 1.00 36.98 C ATOM 202 C MET A 13 -52.072 24.551 -23.681 1.00 36.15 C ATOM 203 O MET A 13 -51.968 23.330 -23.562 1.00 35.91 O ATOM 204 CB MET A 13 -54.386 24.304 -22.717 1.00 37.36 C ATOM 205 CG MET A 13 -54.186 23.729 -21.320 1.00 37.17 C ATOM 206 SD MET A 13 -52.944 24.618 -20.355 1.00 37.20 S ATOM 207 CE MET A 13 -51.762 23.308 -20.041 1.00 36.92 C ATOM 0 H MET A 13 -53.740 27.211 -23.856 1.00 37.50 H new ATOM 0 HA MET A 13 -52.999 25.865 -22.268 1.00 36.98 H new ATOM 0 HB2 MET A 13 -55.353 24.805 -22.757 1.00 37.36 H new ATOM 0 HB3 MET A 13 -54.421 23.484 -23.434 1.00 37.36 H new ATOM 0 HG2 MET A 13 -55.136 23.751 -20.786 1.00 37.17 H new ATOM 0 HG3 MET A 13 -53.891 22.683 -21.404 1.00 37.17 H new ATOM 0 HE1 MET A 13 -50.932 23.700 -19.453 1.00 36.92 H new ATOM 0 HE2 MET A 13 -52.249 22.503 -19.490 1.00 36.92 H new ATOM 0 HE3 MET A 13 -51.385 22.923 -20.989 1.00 36.92 H new ATOM 217 N THR A 14 -51.142 25.299 -24.259 1.00 35.77 N ATOM 218 CA THR A 14 -49.912 24.722 -24.780 1.00 35.01 C ATOM 219 C THR A 14 -48.853 24.633 -23.685 1.00 34.25 C ATOM 220 O THR A 14 -48.759 25.514 -22.826 1.00 34.26 O ATOM 221 CB THR A 14 -49.361 25.547 -25.954 1.00 35.04 C ATOM 222 OG1 THR A 14 -50.133 26.747 -26.110 1.00 35.67 O ATOM 223 CG2 THR A 14 -49.392 24.747 -27.248 1.00 35.17 C ATOM 0 H THR A 14 -51.217 26.309 -24.379 1.00 35.77 H new ATOM 0 HA THR A 14 -50.149 23.720 -25.137 1.00 35.01 H new ATOM 0 HB THR A 14 -48.325 25.803 -25.733 1.00 35.04 H new ATOM 0 HG1 THR A 14 -50.878 26.579 -26.725 1.00 35.67 H new ATOM 0 HG21 THR A 14 -48.997 25.355 -28.061 1.00 35.17 H new ATOM 0 HG22 THR A 14 -48.783 23.850 -27.136 1.00 35.17 H new ATOM 0 HG23 THR A 14 -50.419 24.462 -27.475 1.00 35.17 H new ATOM 231 N PHE A 15 -48.094 23.545 -23.692 1.00 33.64 N ATOM 232 CA PHE A 15 -47.067 23.316 -22.684 1.00 32.92 C ATOM 233 C PHE A 15 -45.929 24.325 -22.826 1.00 32.10 C ATOM 234 O PHE A 15 -45.609 25.052 -21.884 1.00 31.56 O ATOM 235 CB PHE A 15 -46.529 21.885 -22.806 1.00 32.71 C ATOM 236 CG PHE A 15 -45.336 21.593 -21.940 1.00 32.75 C ATOM 237 CD1 PHE A 15 -45.394 21.775 -20.567 1.00 32.99 C ATOM 238 CD2 PHE A 15 -44.157 21.129 -22.501 1.00 32.63 C ATOM 239 CE1 PHE A 15 -44.300 21.497 -19.772 1.00 33.10 C ATOM 240 CE2 PHE A 15 -43.060 20.848 -21.710 1.00 32.74 C ATOM 241 CZ PHE A 15 -43.131 21.034 -20.344 1.00 32.99 C ATOM 0 H PHE A 15 -48.171 22.804 -24.388 1.00 33.64 H new ATOM 0 HA PHE A 15 -47.513 23.448 -21.698 1.00 32.92 H new ATOM 0 HB2 PHE A 15 -47.327 21.187 -22.551 1.00 32.71 H new ATOM 0 HB3 PHE A 15 -46.262 21.698 -23.846 1.00 32.71 H new ATOM 0 HD1 PHE A 15 -46.305 22.138 -20.114 1.00 32.99 H new ATOM 0 HD2 PHE A 15 -44.095 20.985 -23.570 1.00 32.63 H new ATOM 0 HE1 PHE A 15 -44.358 21.641 -18.703 1.00 33.10 H new ATOM 0 HE2 PHE A 15 -42.148 20.483 -22.160 1.00 32.74 H new ATOM 0 HZ PHE A 15 -42.274 20.818 -19.723 1.00 32.99 H new ATOM 251 N GLY A 16 -45.310 24.352 -23.997 1.00 32.07 N ATOM 252 CA GLY A 16 -44.178 25.228 -24.213 1.00 31.38 C ATOM 253 C GLY A 16 -42.875 24.536 -23.873 1.00 30.74 C ATOM 254 O GLY A 16 -42.590 24.272 -22.700 1.00 30.29 O ATOM 0 H GLY A 16 -45.572 23.782 -24.802 1.00 32.07 H new ATOM 0 HA2 GLY A 16 -44.159 25.552 -25.254 1.00 31.38 H new ATOM 0 HA3 GLY A 16 -44.287 26.124 -23.602 1.00 31.38 H new ATOM 258 N GLU A 17 -42.110 24.193 -24.898 1.00 30.74 N ATOM 259 CA GLU A 17 -40.859 23.468 -24.722 1.00 30.20 C ATOM 260 C GLU A 17 -39.739 24.402 -24.273 1.00 29.71 C ATOM 261 O GLU A 17 -38.734 24.569 -24.968 1.00 29.63 O ATOM 262 CB GLU A 17 -40.473 22.765 -26.021 1.00 30.52 C ATOM 263 CG GLU A 17 -40.430 21.255 -25.903 1.00 30.95 C ATOM 264 CD GLU A 17 -39.054 20.696 -26.186 1.00 31.17 C ATOM 265 OE1 GLU A 17 -38.667 20.631 -27.372 1.00 31.28 O ATOM 266 OE2 GLU A 17 -38.347 20.323 -25.230 1.00 31.29 O ATOM 0 H GLU A 17 -42.336 24.407 -25.869 1.00 30.74 H new ATOM 0 HA GLU A 17 -41.006 22.721 -23.942 1.00 30.20 H new ATOM 0 HB2 GLU A 17 -41.185 23.040 -26.799 1.00 30.52 H new ATOM 0 HB3 GLU A 17 -39.495 23.124 -26.342 1.00 30.52 H new ATOM 0 HG2 GLU A 17 -40.739 20.962 -24.900 1.00 30.95 H new ATOM 0 HG3 GLU A 17 -41.147 20.818 -26.598 1.00 30.95 H new ATOM 273 N ASN A 18 -39.918 24.986 -23.096 1.00 29.45 N ATOM 274 CA ASN A 18 -38.933 25.892 -22.515 1.00 29.03 C ATOM 275 C ASN A 18 -37.640 25.144 -22.213 1.00 28.24 C ATOM 276 O ASN A 18 -36.555 25.578 -22.606 1.00 28.03 O ATOM 277 CB ASN A 18 -39.498 26.522 -21.236 1.00 29.10 C ATOM 278 CG ASN A 18 -38.437 27.191 -20.381 1.00 28.93 C ATOM 279 OD1 ASN A 18 -37.643 28.000 -20.867 1.00 28.81 O ATOM 280 ND2 ASN A 18 -38.418 26.861 -19.096 1.00 29.02 N ATOM 0 H ASN A 18 -40.747 24.847 -22.518 1.00 29.45 H new ATOM 0 HA ASN A 18 -38.713 26.684 -23.231 1.00 29.03 H new ATOM 0 HB2 ASN A 18 -40.256 27.258 -21.505 1.00 29.10 H new ATOM 0 HB3 ASN A 18 -39.996 25.751 -20.648 1.00 29.10 H new ATOM 0 HD21 ASN A 18 -37.729 27.281 -18.472 1.00 29.02 H new ATOM 0 HD22 ASN A 18 -39.092 26.187 -18.732 1.00 29.02 H new ATOM 287 N ARG A 19 -37.791 23.970 -21.607 1.00 27.89 N ATOM 288 CA ARG A 19 -36.671 23.077 -21.319 1.00 27.19 C ATOM 289 C ARG A 19 -35.626 23.748 -20.431 1.00 26.47 C ATOM 290 O ARG A 19 -34.575 24.187 -20.903 1.00 26.25 O ATOM 291 CB ARG A 19 -36.021 22.585 -22.617 1.00 27.23 C ATOM 292 CG ARG A 19 -35.747 21.089 -22.628 1.00 27.00 C ATOM 293 CD ARG A 19 -34.908 20.689 -23.828 1.00 27.20 C ATOM 294 NE ARG A 19 -35.699 20.610 -25.057 1.00 27.45 N ATOM 295 CZ ARG A 19 -35.177 20.620 -26.282 1.00 27.94 C ATOM 296 NH1 ARG A 19 -33.865 20.724 -26.453 1.00 28.23 N ATOM 297 NH2 ARG A 19 -35.974 20.524 -27.337 1.00 28.23 N ATOM 0 H ARG A 19 -38.695 23.610 -21.301 1.00 27.89 H new ATOM 0 HA ARG A 19 -37.072 22.221 -20.777 1.00 27.19 H new ATOM 0 HB2 ARG A 19 -36.670 22.834 -23.456 1.00 27.23 H new ATOM 0 HB3 ARG A 19 -35.083 23.119 -22.770 1.00 27.23 H new ATOM 0 HG2 ARG A 19 -35.231 20.805 -21.711 1.00 27.00 H new ATOM 0 HG3 ARG A 19 -36.691 20.545 -22.644 1.00 27.00 H new ATOM 0 HD2 ARG A 19 -34.103 21.411 -23.963 1.00 27.20 H new ATOM 0 HD3 ARG A 19 -34.441 19.723 -23.636 1.00 27.20 H new ATOM 0 HE ARG A 19 -36.713 20.543 -24.970 1.00 27.45 H new ATOM 0 HH11 ARG A 19 -33.249 20.797 -25.643 1.00 28.23 H new ATOM 0 HH12 ARG A 19 -33.472 20.731 -27.394 1.00 28.23 H new ATOM 0 HH21 ARG A 19 -36.983 20.443 -27.209 1.00 28.23 H new ATOM 0 HH22 ARG A 19 -35.579 20.531 -28.277 1.00 28.23 H new ATOM 311 N ASP A 20 -35.896 23.750 -19.135 1.00 26.17 N ATOM 312 CA ASP A 20 -34.954 24.279 -18.157 1.00 25.54 C ATOM 313 C ASP A 20 -34.442 23.155 -17.271 1.00 24.65 C ATOM 314 O ASP A 20 -34.843 23.030 -16.111 1.00 24.53 O ATOM 315 CB ASP A 20 -35.617 25.358 -17.298 1.00 26.03 C ATOM 316 CG ASP A 20 -34.609 26.241 -16.583 1.00 25.70 C ATOM 317 OD1 ASP A 20 -33.466 25.781 -16.369 1.00 25.48 O ATOM 318 OD2 ASP A 20 -34.943 27.396 -16.239 1.00 25.72 O ATOM 0 H ASP A 20 -36.762 23.390 -18.734 1.00 26.17 H new ATOM 0 HA ASP A 20 -34.116 24.727 -18.691 1.00 25.54 H new ATOM 0 HB2 ASP A 20 -36.254 25.978 -17.929 1.00 26.03 H new ATOM 0 HB3 ASP A 20 -36.264 24.883 -16.561 1.00 26.03 H new ATOM 323 N LEU A 21 -33.587 22.318 -17.837 1.00 24.13 N ATOM 324 CA LEU A 21 -33.045 21.174 -17.122 1.00 23.35 C ATOM 325 C LEU A 21 -31.547 21.047 -17.376 1.00 22.33 C ATOM 326 O LEU A 21 -31.112 20.211 -18.169 1.00 21.99 O ATOM 327 CB LEU A 21 -33.763 19.893 -17.557 1.00 23.63 C ATOM 328 CG LEU A 21 -34.537 19.171 -16.453 1.00 23.70 C ATOM 329 CD1 LEU A 21 -35.966 19.686 -16.371 1.00 24.80 C ATOM 330 CD2 LEU A 21 -34.521 17.670 -16.692 1.00 23.44 C ATOM 0 H LEU A 21 -33.252 22.411 -18.796 1.00 24.13 H new ATOM 0 HA LEU A 21 -33.205 21.324 -16.054 1.00 23.35 H new ATOM 0 HB2 LEU A 21 -34.455 20.140 -18.362 1.00 23.63 H new ATOM 0 HB3 LEU A 21 -33.025 19.205 -17.971 1.00 23.63 H new ATOM 0 HG LEU A 21 -34.049 19.375 -15.500 1.00 23.70 H new ATOM 0 HD11 LEU A 21 -36.498 19.159 -15.579 1.00 24.80 H new ATOM 0 HD12 LEU A 21 -35.956 20.754 -16.152 1.00 24.80 H new ATOM 0 HD13 LEU A 21 -36.469 19.515 -17.323 1.00 24.80 H new ATOM 0 HD21 LEU A 21 -35.076 17.169 -15.898 1.00 23.44 H new ATOM 0 HD22 LEU A 21 -34.985 17.450 -17.654 1.00 23.44 H new ATOM 0 HD23 LEU A 21 -33.491 17.313 -16.696 1.00 23.44 H new ATOM 342 N GLU A 22 -30.767 21.890 -16.718 1.00 21.92 N ATOM 343 CA GLU A 22 -29.321 21.876 -16.877 1.00 21.00 C ATOM 344 C GLU A 22 -28.639 21.889 -15.516 1.00 20.38 C ATOM 345 O GLU A 22 -29.137 22.507 -14.572 1.00 20.63 O ATOM 346 CB GLU A 22 -28.861 23.080 -17.700 1.00 21.11 C ATOM 347 CG GLU A 22 -28.739 22.791 -19.186 1.00 21.38 C ATOM 348 CD GLU A 22 -27.878 23.807 -19.905 1.00 21.67 C ATOM 349 OE1 GLU A 22 -26.667 23.883 -19.611 1.00 21.86 O ATOM 350 OE2 GLU A 22 -28.411 24.537 -20.768 1.00 21.81 O ATOM 0 H GLU A 22 -31.112 22.595 -16.067 1.00 21.92 H new ATOM 0 HA GLU A 22 -29.043 20.963 -17.404 1.00 21.00 H new ATOM 0 HB2 GLU A 22 -29.565 23.899 -17.554 1.00 21.11 H new ATOM 0 HB3 GLU A 22 -27.896 23.419 -17.324 1.00 21.11 H new ATOM 0 HG2 GLU A 22 -28.315 21.796 -19.326 1.00 21.38 H new ATOM 0 HG3 GLU A 22 -29.733 22.780 -19.634 1.00 21.38 H new ATOM 357 N ARG A 23 -27.514 21.195 -15.414 1.00 19.67 N ATOM 358 CA ARG A 23 -26.771 21.120 -14.166 1.00 19.08 C ATOM 359 C ARG A 23 -25.269 21.176 -14.420 1.00 18.24 C ATOM 360 O ARG A 23 -24.688 20.247 -14.985 1.00 17.96 O ATOM 361 CB ARG A 23 -27.125 19.836 -13.410 1.00 19.09 C ATOM 362 CG ARG A 23 -27.608 20.080 -11.988 1.00 19.33 C ATOM 363 CD ARG A 23 -26.530 19.746 -10.965 1.00 19.75 C ATOM 364 NE ARG A 23 -26.562 18.339 -10.570 1.00 20.13 N ATOM 365 CZ ARG A 23 -27.296 17.859 -9.568 1.00 20.90 C ATOM 366 NH1 ARG A 23 -28.039 18.671 -8.825 1.00 21.36 N ATOM 367 NH2 ARG A 23 -27.267 16.568 -9.290 1.00 21.30 N ATOM 0 H ARG A 23 -27.095 20.674 -16.185 1.00 19.67 H new ATOM 0 HA ARG A 23 -27.050 21.980 -13.557 1.00 19.08 H new ATOM 0 HB2 ARG A 23 -27.899 19.302 -13.961 1.00 19.09 H new ATOM 0 HB3 ARG A 23 -26.249 19.188 -13.381 1.00 19.09 H new ATOM 0 HG2 ARG A 23 -27.904 21.123 -11.878 1.00 19.33 H new ATOM 0 HG3 ARG A 23 -28.494 19.475 -11.795 1.00 19.33 H new ATOM 0 HD2 ARG A 23 -25.551 19.983 -11.381 1.00 19.75 H new ATOM 0 HD3 ARG A 23 -26.662 20.373 -10.083 1.00 19.75 H new ATOM 0 HE ARG A 23 -25.985 17.683 -11.096 1.00 20.13 H new ATOM 0 HH11 ARG A 23 -28.051 19.672 -9.020 1.00 21.36 H new ATOM 0 HH12 ARG A 23 -28.598 18.293 -8.060 1.00 21.36 H new ATOM 0 HH21 ARG A 23 -26.683 15.940 -9.843 1.00 21.30 H new ATOM 0 HH22 ARG A 23 -27.829 16.199 -8.523 1.00 21.30 H new ATOM 381 N VAL A 24 -24.644 22.264 -13.987 1.00 17.96 N ATOM 382 CA VAL A 24 -23.204 22.437 -14.136 1.00 17.23 C ATOM 383 C VAL A 24 -22.451 21.575 -13.130 1.00 16.44 C ATOM 384 O VAL A 24 -22.639 21.710 -11.921 1.00 16.45 O ATOM 385 CB VAL A 24 -22.782 23.910 -13.944 1.00 17.51 C ATOM 386 CG1 VAL A 24 -21.308 24.094 -14.270 1.00 16.96 C ATOM 387 CG2 VAL A 24 -23.633 24.831 -14.801 1.00 18.40 C ATOM 0 H VAL A 24 -25.115 23.044 -13.527 1.00 17.96 H new ATOM 0 HA VAL A 24 -22.952 22.129 -15.151 1.00 17.23 H new ATOM 0 HB VAL A 24 -22.939 24.172 -12.898 1.00 17.51 H new ATOM 0 HG11 VAL A 24 -21.032 25.139 -14.128 1.00 16.96 H new ATOM 0 HG12 VAL A 24 -20.708 23.467 -13.610 1.00 16.96 H new ATOM 0 HG13 VAL A 24 -21.126 23.808 -15.306 1.00 16.96 H new ATOM 0 HG21 VAL A 24 -23.318 25.863 -14.649 1.00 18.40 H new ATOM 0 HG22 VAL A 24 -23.512 24.565 -15.851 1.00 18.40 H new ATOM 0 HG23 VAL A 24 -24.680 24.726 -14.518 1.00 18.40 H new ATOM 397 N VAL A 25 -21.614 20.681 -13.638 1.00 15.87 N ATOM 398 CA VAL A 25 -20.825 19.804 -12.784 1.00 15.18 C ATOM 399 C VAL A 25 -19.553 20.508 -12.323 1.00 14.49 C ATOM 400 O VAL A 25 -18.602 20.667 -13.090 1.00 14.22 O ATOM 401 CB VAL A 25 -20.441 18.489 -13.499 1.00 15.12 C ATOM 402 CG1 VAL A 25 -19.961 17.454 -12.491 1.00 15.22 C ATOM 403 CG2 VAL A 25 -21.611 17.945 -14.306 1.00 15.32 C ATOM 0 H VAL A 25 -21.464 20.544 -14.638 1.00 15.87 H new ATOM 0 HA VAL A 25 -21.448 19.559 -11.924 1.00 15.18 H new ATOM 0 HB VAL A 25 -19.626 18.705 -14.189 1.00 15.12 H new ATOM 0 HG11 VAL A 25 -19.695 16.534 -13.012 1.00 15.22 H new ATOM 0 HG12 VAL A 25 -19.088 17.838 -11.963 1.00 15.22 H new ATOM 0 HG13 VAL A 25 -20.756 17.248 -11.775 1.00 15.22 H new ATOM 0 HG21 VAL A 25 -21.314 17.019 -14.799 1.00 15.32 H new ATOM 0 HG22 VAL A 25 -22.452 17.748 -13.641 1.00 15.32 H new ATOM 0 HG23 VAL A 25 -21.907 18.677 -15.057 1.00 15.32 H new ATOM 413 N THR A 26 -19.557 20.962 -11.082 1.00 14.33 N ATOM 414 CA THR A 26 -18.430 21.687 -10.518 1.00 13.78 C ATOM 415 C THR A 26 -17.538 20.764 -9.687 1.00 13.06 C ATOM 416 O THR A 26 -17.215 21.064 -8.537 1.00 13.24 O ATOM 417 CB THR A 26 -18.916 22.853 -9.638 1.00 14.30 C ATOM 418 OG1 THR A 26 -20.352 22.946 -9.696 1.00 15.24 O ATOM 419 CG2 THR A 26 -18.297 24.167 -10.089 1.00 14.19 C ATOM 0 H THR A 26 -20.338 20.840 -10.438 1.00 14.33 H new ATOM 0 HA THR A 26 -17.849 22.082 -11.351 1.00 13.78 H new ATOM 0 HB THR A 26 -18.606 22.660 -8.611 1.00 14.30 H new ATOM 0 HG1 THR A 26 -20.655 23.689 -9.133 1.00 15.24 H new ATOM 0 HG21 THR A 26 -18.656 24.976 -9.452 1.00 14.19 H new ATOM 0 HG22 THR A 26 -17.211 24.102 -10.016 1.00 14.19 H new ATOM 0 HG23 THR A 26 -18.580 24.367 -11.123 1.00 14.19 H new ATOM 427 N ALA A 27 -17.137 19.649 -10.283 1.00 12.38 N ATOM 428 CA ALA A 27 -16.278 18.686 -9.608 1.00 11.72 C ATOM 429 C ALA A 27 -14.861 19.230 -9.463 1.00 10.95 C ATOM 430 O ALA A 27 -14.247 19.647 -10.443 1.00 10.49 O ATOM 431 CB ALA A 27 -16.263 17.370 -10.372 1.00 11.52 C ATOM 0 H ALA A 27 -17.394 19.389 -11.235 1.00 12.38 H new ATOM 0 HA ALA A 27 -16.679 18.510 -8.610 1.00 11.72 H new ATOM 0 HB1 ALA A 27 -15.617 16.658 -9.858 1.00 11.52 H new ATOM 0 HB2 ALA A 27 -17.275 16.969 -10.426 1.00 11.52 H new ATOM 0 HB3 ALA A 27 -15.886 17.539 -11.381 1.00 11.52 H new ATOM 437 N PRO A 28 -14.341 19.282 -8.229 1.00 10.96 N ATOM 438 CA PRO A 28 -12.998 19.798 -7.965 1.00 10.40 C ATOM 439 C PRO A 28 -11.910 18.827 -8.419 1.00 9.29 C ATOM 440 O PRO A 28 -12.083 17.608 -8.353 1.00 9.03 O ATOM 441 CB PRO A 28 -12.973 19.966 -6.445 1.00 11.01 C ATOM 442 CG PRO A 28 -13.960 18.976 -5.934 1.00 11.79 C ATOM 443 CD PRO A 28 -15.026 18.860 -6.993 1.00 11.72 C ATOM 0 HA PRO A 28 -12.799 20.722 -8.508 1.00 10.40 H new ATOM 0 HB2 PRO A 28 -11.978 19.776 -6.043 1.00 11.01 H new ATOM 0 HB3 PRO A 28 -13.245 20.981 -6.155 1.00 11.01 H new ATOM 0 HG2 PRO A 28 -13.486 18.012 -5.752 1.00 11.79 H new ATOM 0 HG3 PRO A 28 -14.387 19.305 -4.987 1.00 11.79 H new ATOM 0 HD2 PRO A 28 -15.402 17.840 -7.072 1.00 11.72 H new ATOM 0 HD3 PRO A 28 -15.881 19.499 -6.772 1.00 11.72 H new ATOM 451 N VAL A 29 -10.802 19.375 -8.895 1.00 8.79 N ATOM 452 CA VAL A 29 -9.690 18.565 -9.373 1.00 7.84 C ATOM 453 C VAL A 29 -8.748 18.220 -8.228 1.00 7.19 C ATOM 454 O VAL A 29 -8.096 19.100 -7.660 1.00 7.22 O ATOM 455 CB VAL A 29 -8.902 19.293 -10.482 1.00 7.91 C ATOM 456 CG1 VAL A 29 -7.817 18.391 -11.055 1.00 7.97 C ATOM 457 CG2 VAL A 29 -9.840 19.764 -11.580 1.00 8.51 C ATOM 0 H VAL A 29 -10.648 20.381 -8.961 1.00 8.79 H new ATOM 0 HA VAL A 29 -10.109 17.648 -9.787 1.00 7.84 H new ATOM 0 HB VAL A 29 -8.421 20.166 -10.042 1.00 7.91 H new ATOM 0 HG11 VAL A 29 -7.274 18.925 -11.835 1.00 7.97 H new ATOM 0 HG12 VAL A 29 -7.125 18.105 -10.262 1.00 7.97 H new ATOM 0 HG13 VAL A 29 -8.274 17.496 -11.478 1.00 7.97 H new ATOM 0 HG21 VAL A 29 -9.267 20.275 -12.354 1.00 8.51 H new ATOM 0 HG22 VAL A 29 -10.351 18.905 -12.015 1.00 8.51 H new ATOM 0 HG23 VAL A 29 -10.576 20.450 -11.160 1.00 8.51 H new ATOM 467 N SER A 30 -8.686 16.944 -7.885 1.00 6.88 N ATOM 468 CA SER A 30 -7.826 16.481 -6.809 1.00 6.51 C ATOM 469 C SER A 30 -6.365 16.483 -7.250 1.00 5.49 C ATOM 470 O SER A 30 -6.026 15.938 -8.304 1.00 5.34 O ATOM 471 CB SER A 30 -8.250 15.078 -6.369 1.00 7.14 C ATOM 472 OG SER A 30 -9.530 14.746 -6.894 1.00 8.11 O ATOM 0 H SER A 30 -9.225 16.207 -8.339 1.00 6.88 H new ATOM 0 HA SER A 30 -7.927 17.161 -5.963 1.00 6.51 H new ATOM 0 HB2 SER A 30 -7.514 14.349 -6.707 1.00 7.14 H new ATOM 0 HB3 SER A 30 -8.274 15.026 -5.281 1.00 7.14 H new ATOM 0 HG SER A 30 -9.780 13.845 -6.601 1.00 8.11 H new ATOM 478 N SER A 31 -5.519 17.137 -6.469 1.00 5.13 N ATOM 479 CA SER A 31 -4.107 17.240 -6.792 1.00 4.45 C ATOM 480 C SER A 31 -3.426 15.876 -6.694 1.00 3.89 C ATOM 481 O SER A 31 -3.818 15.034 -5.886 1.00 4.19 O ATOM 482 CB SER A 31 -3.431 18.239 -5.852 1.00 4.99 C ATOM 483 OG SER A 31 -4.338 18.695 -4.860 1.00 5.80 O ATOM 0 H SER A 31 -5.789 17.606 -5.604 1.00 5.13 H new ATOM 0 HA SER A 31 -4.011 17.594 -7.819 1.00 4.45 H new ATOM 0 HB2 SER A 31 -2.570 17.771 -5.375 1.00 4.99 H new ATOM 0 HB3 SER A 31 -3.056 19.087 -6.425 1.00 4.99 H new ATOM 0 HG SER A 31 -3.884 19.331 -4.269 1.00 5.80 H new ATOM 489 N GLY A 32 -2.420 15.665 -7.524 1.00 3.41 N ATOM 490 CA GLY A 32 -1.706 14.409 -7.519 1.00 3.15 C ATOM 491 C GLY A 32 -0.268 14.581 -7.085 1.00 2.12 C ATOM 492 O GLY A 32 0.656 14.382 -7.874 1.00 2.44 O ATOM 0 H GLY A 32 -2.083 16.346 -8.205 1.00 3.41 H new ATOM 0 HA2 GLY A 32 -2.206 13.709 -6.849 1.00 3.15 H new ATOM 0 HA3 GLY A 32 -1.734 13.971 -8.517 1.00 3.15 H new ATOM 496 N LYS A 33 -0.074 14.967 -5.831 1.00 1.50 N ATOM 497 CA LYS A 33 1.266 15.189 -5.306 1.00 0.87 C ATOM 498 C LYS A 33 1.871 13.886 -4.803 1.00 0.73 C ATOM 499 O LYS A 33 3.023 13.849 -4.373 1.00 0.87 O ATOM 500 CB LYS A 33 1.236 16.227 -4.183 1.00 1.50 C ATOM 501 CG LYS A 33 1.498 17.642 -4.668 1.00 2.21 C ATOM 502 CD LYS A 33 2.837 17.751 -5.378 1.00 3.19 C ATOM 503 CE LYS A 33 3.096 19.164 -5.866 1.00 4.16 C ATOM 504 NZ LYS A 33 3.666 20.023 -4.797 1.00 4.98 N ATOM 0 H LYS A 33 -0.825 15.132 -5.161 1.00 1.50 H new ATOM 0 HA LYS A 33 1.890 15.568 -6.116 1.00 0.87 H new ATOM 0 HB2 LYS A 33 0.264 16.193 -3.691 1.00 1.50 H new ATOM 0 HB3 LYS A 33 1.982 15.963 -3.433 1.00 1.50 H new ATOM 0 HG2 LYS A 33 0.701 17.949 -5.345 1.00 2.21 H new ATOM 0 HG3 LYS A 33 1.478 18.327 -3.821 1.00 2.21 H new ATOM 0 HD2 LYS A 33 3.635 17.447 -4.700 1.00 3.19 H new ATOM 0 HD3 LYS A 33 2.858 17.064 -6.224 1.00 3.19 H new ATOM 0 HE2 LYS A 33 3.781 19.136 -6.713 1.00 4.16 H new ATOM 0 HE3 LYS A 33 2.164 19.601 -6.225 1.00 4.16 H new ATOM 0 HZ1 LYS A 33 3.828 20.980 -5.170 1.00 4.98 H new ATOM 0 HZ2 LYS A 33 3.001 20.071 -3.999 1.00 4.98 H new ATOM 0 HZ3 LYS A 33 4.568 19.620 -4.472 1.00 4.98 H new ATOM 518 N ILE A 34 1.112 12.810 -4.922 1.00 0.64 N ATOM 519 CA ILE A 34 1.602 11.497 -4.564 1.00 0.59 C ATOM 520 C ILE A 34 1.553 10.580 -5.782 1.00 0.52 C ATOM 521 O ILE A 34 0.806 10.834 -6.736 1.00 0.59 O ATOM 522 CB ILE A 34 0.800 10.891 -3.383 1.00 0.65 C ATOM 523 CG1 ILE A 34 1.729 10.107 -2.455 1.00 1.10 C ATOM 524 CG2 ILE A 34 -0.335 9.999 -3.869 1.00 1.06 C ATOM 525 CD1 ILE A 34 1.847 10.703 -1.070 1.00 1.67 C ATOM 0 H ILE A 34 0.152 12.824 -5.265 1.00 0.64 H new ATOM 0 HA ILE A 34 2.636 11.595 -4.233 1.00 0.59 H new ATOM 0 HB ILE A 34 0.356 11.718 -2.829 1.00 0.65 H new ATOM 0 HG12 ILE A 34 1.365 9.083 -2.371 1.00 1.10 H new ATOM 0 HG13 ILE A 34 2.720 10.057 -2.905 1.00 1.10 H new ATOM 0 HG21 ILE A 34 -0.872 9.594 -3.011 1.00 1.06 H new ATOM 0 HG22 ILE A 34 -1.020 10.584 -4.483 1.00 1.06 H new ATOM 0 HG23 ILE A 34 0.074 9.180 -4.461 1.00 1.06 H new ATOM 0 HD11 ILE A 34 2.522 10.094 -0.468 1.00 1.67 H new ATOM 0 HD12 ILE A 34 2.241 11.717 -1.143 1.00 1.67 H new ATOM 0 HD13 ILE A 34 0.864 10.728 -0.600 1.00 1.67 H new ATOM 537 N LYS A 35 2.424 9.592 -5.800 1.00 0.50 N ATOM 538 CA LYS A 35 2.531 8.670 -6.916 1.00 0.49 C ATOM 539 C LYS A 35 2.309 7.245 -6.429 1.00 0.44 C ATOM 540 O LYS A 35 2.827 6.856 -5.384 1.00 0.47 O ATOM 541 CB LYS A 35 3.905 8.799 -7.584 1.00 0.59 C ATOM 542 CG LYS A 35 4.315 10.235 -7.877 1.00 0.92 C ATOM 543 CD LYS A 35 4.157 10.564 -9.353 1.00 1.10 C ATOM 544 CE LYS A 35 2.722 10.929 -9.691 1.00 1.08 C ATOM 545 NZ LYS A 35 2.272 12.151 -8.971 1.00 1.27 N ATOM 0 H LYS A 35 3.079 9.404 -5.041 1.00 0.50 H new ATOM 0 HA LYS A 35 1.767 8.915 -7.654 1.00 0.49 H new ATOM 0 HB2 LYS A 35 4.656 8.341 -6.940 1.00 0.59 H new ATOM 0 HB3 LYS A 35 3.899 8.235 -8.517 1.00 0.59 H new ATOM 0 HG2 LYS A 35 3.707 10.917 -7.283 1.00 0.92 H new ATOM 0 HG3 LYS A 35 5.352 10.388 -7.577 1.00 0.92 H new ATOM 0 HD2 LYS A 35 4.816 11.392 -9.615 1.00 1.10 H new ATOM 0 HD3 LYS A 35 4.467 9.708 -9.953 1.00 1.10 H new ATOM 0 HE2 LYS A 35 2.632 11.088 -10.766 1.00 1.08 H new ATOM 0 HE3 LYS A 35 2.067 10.096 -9.436 1.00 1.08 H new ATOM 0 HZ1 LYS A 35 1.725 12.754 -9.618 1.00 1.27 H new ATOM 0 HZ2 LYS A 35 1.675 11.879 -8.164 1.00 1.27 H new ATOM 0 HZ3 LYS A 35 3.101 12.676 -8.626 1.00 1.27 H new ATOM 559 N ARG A 36 1.507 6.486 -7.156 1.00 0.52 N ATOM 560 CA ARG A 36 1.195 5.114 -6.767 1.00 0.53 C ATOM 561 C ARG A 36 1.932 4.131 -7.662 1.00 0.56 C ATOM 562 O ARG A 36 1.658 4.044 -8.862 1.00 0.76 O ATOM 563 CB ARG A 36 -0.310 4.850 -6.841 1.00 0.64 C ATOM 564 CG ARG A 36 -1.174 6.084 -6.634 1.00 1.17 C ATOM 565 CD ARG A 36 -1.986 6.421 -7.879 1.00 1.51 C ATOM 566 NE ARG A 36 -2.163 5.270 -8.764 1.00 2.02 N ATOM 567 CZ ARG A 36 -2.322 5.358 -10.083 1.00 2.75 C ATOM 568 NH1 ARG A 36 -2.384 6.547 -10.669 1.00 2.99 N ATOM 569 NH2 ARG A 36 -2.434 4.256 -10.817 1.00 3.65 N ATOM 0 H ARG A 36 1.058 6.793 -8.019 1.00 0.52 H new ATOM 0 HA ARG A 36 1.520 4.976 -5.736 1.00 0.53 H new ATOM 0 HB2 ARG A 36 -0.543 4.417 -7.814 1.00 0.64 H new ATOM 0 HB3 ARG A 36 -0.574 4.106 -6.089 1.00 0.64 H new ATOM 0 HG2 ARG A 36 -1.848 5.919 -5.794 1.00 1.17 H new ATOM 0 HG3 ARG A 36 -0.541 6.932 -6.373 1.00 1.17 H new ATOM 0 HD2 ARG A 36 -2.964 6.798 -7.579 1.00 1.51 H new ATOM 0 HD3 ARG A 36 -1.489 7.222 -8.426 1.00 1.51 H new ATOM 0 HE ARG A 36 -2.165 4.341 -8.344 1.00 2.02 H new ATOM 0 HH11 ARG A 36 -2.310 7.396 -10.109 1.00 2.99 H new ATOM 0 HH12 ARG A 36 -2.506 6.612 -11.680 1.00 2.99 H new ATOM 0 HH21 ARG A 36 -2.398 3.340 -10.370 1.00 3.65 H new ATOM 0 HH22 ARG A 36 -2.556 4.326 -11.827 1.00 3.65 H new ATOM 583 N VAL A 37 2.866 3.399 -7.081 1.00 0.49 N ATOM 584 CA VAL A 37 3.644 2.428 -7.831 1.00 0.56 C ATOM 585 C VAL A 37 3.408 1.020 -7.294 1.00 0.53 C ATOM 586 O VAL A 37 3.284 0.816 -6.085 1.00 0.55 O ATOM 587 CB VAL A 37 5.154 2.759 -7.785 1.00 0.69 C ATOM 588 CG1 VAL A 37 5.956 1.812 -8.667 1.00 1.04 C ATOM 589 CG2 VAL A 37 5.397 4.199 -8.207 1.00 1.26 C ATOM 0 H VAL A 37 3.105 3.458 -6.091 1.00 0.49 H new ATOM 0 HA VAL A 37 3.313 2.475 -8.869 1.00 0.56 H new ATOM 0 HB VAL A 37 5.490 2.630 -6.756 1.00 0.69 H new ATOM 0 HG11 VAL A 37 7.013 2.072 -8.612 1.00 1.04 H new ATOM 0 HG12 VAL A 37 5.816 0.787 -8.323 1.00 1.04 H new ATOM 0 HG13 VAL A 37 5.614 1.898 -9.698 1.00 1.04 H new ATOM 0 HG21 VAL A 37 6.465 4.414 -8.169 1.00 1.26 H new ATOM 0 HG22 VAL A 37 5.033 4.346 -9.224 1.00 1.26 H new ATOM 0 HG23 VAL A 37 4.867 4.870 -7.531 1.00 1.26 H new ATOM 599 N ASN A 38 3.347 0.058 -8.204 1.00 0.55 N ATOM 600 CA ASN A 38 3.154 -1.336 -7.839 1.00 0.56 C ATOM 601 C ASN A 38 4.472 -2.088 -7.976 1.00 0.49 C ATOM 602 O ASN A 38 5.136 -2.012 -9.010 1.00 0.57 O ATOM 603 CB ASN A 38 2.062 -1.975 -8.716 1.00 0.74 C ATOM 604 CG ASN A 38 2.333 -3.433 -9.065 1.00 0.81 C ATOM 605 OD1 ASN A 38 2.996 -3.733 -10.058 1.00 1.53 O ATOM 606 ND2 ASN A 38 1.813 -4.349 -8.261 1.00 1.00 N ATOM 0 H ASN A 38 3.429 0.221 -9.208 1.00 0.55 H new ATOM 0 HA ASN A 38 2.825 -1.393 -6.801 1.00 0.56 H new ATOM 0 HB2 ASN A 38 1.106 -1.906 -8.198 1.00 0.74 H new ATOM 0 HB3 ASN A 38 1.967 -1.401 -9.638 1.00 0.74 H new ATOM 0 HD21 ASN A 38 1.957 -5.340 -8.456 1.00 1.00 H new ATOM 0 HD22 ASN A 38 1.269 -4.063 -7.447 1.00 1.00 H new ATOM 613 N VAL A 39 4.889 -2.731 -6.902 1.00 0.41 N ATOM 614 CA VAL A 39 6.164 -3.425 -6.875 1.00 0.44 C ATOM 615 C VAL A 39 5.957 -4.929 -6.803 1.00 0.42 C ATOM 616 O VAL A 39 4.891 -5.399 -6.401 1.00 0.48 O ATOM 617 CB VAL A 39 7.034 -2.990 -5.677 1.00 0.61 C ATOM 618 CG1 VAL A 39 8.492 -2.886 -6.089 1.00 1.24 C ATOM 619 CG2 VAL A 39 6.544 -1.671 -5.094 1.00 0.63 C ATOM 0 H VAL A 39 4.360 -2.788 -6.032 1.00 0.41 H new ATOM 0 HA VAL A 39 6.681 -3.162 -7.798 1.00 0.44 H new ATOM 0 HB VAL A 39 6.947 -3.751 -4.902 1.00 0.61 H new ATOM 0 HG11 VAL A 39 9.091 -2.578 -5.232 1.00 1.24 H new ATOM 0 HG12 VAL A 39 8.840 -3.856 -6.445 1.00 1.24 H new ATOM 0 HG13 VAL A 39 8.593 -2.149 -6.886 1.00 1.24 H new ATOM 0 HG21 VAL A 39 7.175 -1.389 -4.251 1.00 0.63 H new ATOM 0 HG22 VAL A 39 6.591 -0.895 -5.859 1.00 0.63 H new ATOM 0 HG23 VAL A 39 5.514 -1.784 -4.754 1.00 0.63 H new ATOM 629 N ASN A 40 7.006 -5.671 -7.116 1.00 0.46 N ATOM 630 CA ASN A 40 6.988 -7.121 -7.007 1.00 0.51 C ATOM 631 C ASN A 40 8.024 -7.567 -5.984 1.00 0.44 C ATOM 632 O ASN A 40 9.219 -7.315 -6.145 1.00 0.56 O ATOM 633 CB ASN A 40 7.250 -7.787 -8.368 1.00 0.67 C ATOM 634 CG ASN A 40 8.292 -7.061 -9.209 1.00 1.45 C ATOM 635 OD1 ASN A 40 9.483 -7.376 -9.155 1.00 2.02 O ATOM 636 ND2 ASN A 40 7.848 -6.102 -10.009 1.00 2.13 N ATOM 0 H ASN A 40 7.890 -5.288 -7.451 1.00 0.46 H new ATOM 0 HA ASN A 40 5.997 -7.432 -6.676 1.00 0.51 H new ATOM 0 HB2 ASN A 40 7.578 -8.814 -8.204 1.00 0.67 H new ATOM 0 HB3 ASN A 40 6.315 -7.836 -8.926 1.00 0.67 H new ATOM 0 HD21 ASN A 40 8.500 -5.596 -10.608 1.00 2.13 H new ATOM 0 HD22 ASN A 40 6.855 -5.870 -10.025 1.00 2.13 H new ATOM 643 N PHE A 41 7.547 -8.127 -4.886 1.00 0.40 N ATOM 644 CA PHE A 41 8.415 -8.536 -3.789 1.00 0.45 C ATOM 645 C PHE A 41 8.584 -10.043 -3.777 1.00 0.45 C ATOM 646 O PHE A 41 7.599 -10.777 -3.806 1.00 0.56 O ATOM 647 CB PHE A 41 7.825 -8.097 -2.446 1.00 0.62 C ATOM 648 CG PHE A 41 8.197 -6.707 -2.018 1.00 0.54 C ATOM 649 CD1 PHE A 41 8.821 -5.826 -2.888 1.00 0.98 C ATOM 650 CD2 PHE A 41 7.909 -6.281 -0.733 1.00 1.14 C ATOM 651 CE1 PHE A 41 9.146 -4.545 -2.483 1.00 1.10 C ATOM 652 CE2 PHE A 41 8.232 -5.004 -0.321 1.00 1.16 C ATOM 653 CZ PHE A 41 8.850 -4.136 -1.195 1.00 0.75 C ATOM 0 H PHE A 41 6.556 -8.311 -4.728 1.00 0.40 H new ATOM 0 HA PHE A 41 9.385 -8.060 -3.937 1.00 0.45 H new ATOM 0 HB2 PHE A 41 6.739 -8.166 -2.503 1.00 0.62 H new ATOM 0 HB3 PHE A 41 8.149 -8.798 -1.677 1.00 0.62 H new ATOM 0 HD1 PHE A 41 9.056 -6.144 -3.893 1.00 0.98 H new ATOM 0 HD2 PHE A 41 7.425 -6.957 -0.044 1.00 1.14 H new ATOM 0 HE1 PHE A 41 9.629 -3.866 -3.170 1.00 1.10 H new ATOM 0 HE2 PHE A 41 8.001 -4.685 0.685 1.00 1.16 H new ATOM 0 HZ PHE A 41 9.103 -3.136 -0.874 1.00 0.75 H new ATOM 663 N ASP A 42 9.815 -10.502 -3.655 1.00 0.45 N ATOM 664 CA ASP A 42 10.082 -11.931 -3.536 1.00 0.47 C ATOM 665 C ASP A 42 9.435 -12.482 -2.268 1.00 0.40 C ATOM 666 O ASP A 42 9.223 -11.745 -1.300 1.00 0.35 O ATOM 667 CB ASP A 42 11.586 -12.193 -3.510 1.00 0.62 C ATOM 668 CG ASP A 42 11.925 -13.670 -3.515 1.00 0.70 C ATOM 669 OD1 ASP A 42 12.065 -14.250 -4.614 1.00 1.35 O ATOM 670 OD2 ASP A 42 12.065 -14.256 -2.421 1.00 1.38 O ATOM 0 H ASP A 42 10.647 -9.912 -3.635 1.00 0.45 H new ATOM 0 HA ASP A 42 9.655 -12.436 -4.402 1.00 0.47 H new ATOM 0 HB2 ASP A 42 12.048 -11.716 -4.374 1.00 0.62 H new ATOM 0 HB3 ASP A 42 12.016 -11.729 -2.622 1.00 0.62 H new ATOM 675 N GLU A 43 9.065 -13.756 -2.300 1.00 0.46 N ATOM 676 CA GLU A 43 8.372 -14.382 -1.183 1.00 0.48 C ATOM 677 C GLU A 43 9.186 -14.290 0.103 1.00 0.40 C ATOM 678 O GLU A 43 8.623 -14.098 1.179 1.00 0.42 O ATOM 679 CB GLU A 43 8.055 -15.840 -1.503 1.00 0.65 C ATOM 680 CG GLU A 43 6.568 -16.101 -1.679 1.00 1.08 C ATOM 681 CD GLU A 43 5.876 -16.429 -0.374 1.00 1.04 C ATOM 682 OE1 GLU A 43 6.158 -17.502 0.201 1.00 1.45 O ATOM 683 OE2 GLU A 43 5.058 -15.614 0.091 1.00 1.28 O ATOM 0 H GLU A 43 9.234 -14.377 -3.091 1.00 0.46 H new ATOM 0 HA GLU A 43 7.439 -13.841 -1.028 1.00 0.48 H new ATOM 0 HB2 GLU A 43 8.579 -16.128 -2.414 1.00 0.65 H new ATOM 0 HB3 GLU A 43 8.437 -16.473 -0.702 1.00 0.65 H new ATOM 0 HG2 GLU A 43 6.099 -15.223 -2.124 1.00 1.08 H new ATOM 0 HG3 GLU A 43 6.428 -16.926 -2.378 1.00 1.08 H new ATOM 690 N GLU A 44 10.507 -14.342 -0.017 1.00 0.38 N ATOM 691 CA GLU A 44 11.390 -14.191 1.138 1.00 0.42 C ATOM 692 C GLU A 44 11.178 -12.837 1.786 1.00 0.37 C ATOM 693 O GLU A 44 11.013 -12.727 3.003 1.00 0.43 O ATOM 694 CB GLU A 44 12.851 -14.310 0.717 1.00 0.52 C ATOM 695 CG GLU A 44 13.758 -14.845 1.810 1.00 0.60 C ATOM 696 CD GLU A 44 14.819 -15.778 1.273 1.00 1.56 C ATOM 697 OE1 GLU A 44 14.484 -16.934 0.938 1.00 2.34 O ATOM 698 OE2 GLU A 44 15.994 -15.364 1.185 1.00 2.19 O ATOM 0 H GLU A 44 10.993 -14.488 -0.902 1.00 0.38 H new ATOM 0 HA GLU A 44 11.152 -14.983 1.848 1.00 0.42 H new ATOM 0 HB2 GLU A 44 12.918 -14.965 -0.152 1.00 0.52 H new ATOM 0 HB3 GLU A 44 13.211 -13.330 0.405 1.00 0.52 H new ATOM 0 HG2 GLU A 44 14.237 -14.010 2.322 1.00 0.60 H new ATOM 0 HG3 GLU A 44 13.157 -15.371 2.552 1.00 0.60 H new ATOM 705 N LYS A 45 11.180 -11.812 0.951 1.00 0.32 N ATOM 706 CA LYS A 45 11.015 -10.443 1.402 1.00 0.35 C ATOM 707 C LYS A 45 9.655 -10.235 2.045 1.00 0.30 C ATOM 708 O LYS A 45 9.502 -9.414 2.944 1.00 0.35 O ATOM 709 CB LYS A 45 11.189 -9.488 0.222 1.00 0.39 C ATOM 710 CG LYS A 45 12.491 -9.704 -0.526 1.00 0.56 C ATOM 711 CD LYS A 45 12.975 -8.431 -1.193 1.00 0.68 C ATOM 712 CE LYS A 45 14.435 -8.159 -0.873 1.00 1.04 C ATOM 713 NZ LYS A 45 15.273 -8.089 -2.100 1.00 1.09 N ATOM 0 H LYS A 45 11.296 -11.906 -0.058 1.00 0.32 H new ATOM 0 HA LYS A 45 11.776 -10.236 2.154 1.00 0.35 H new ATOM 0 HB2 LYS A 45 10.354 -9.615 -0.468 1.00 0.39 H new ATOM 0 HB3 LYS A 45 11.150 -8.461 0.584 1.00 0.39 H new ATOM 0 HG2 LYS A 45 13.252 -10.064 0.166 1.00 0.56 H new ATOM 0 HG3 LYS A 45 12.353 -10.479 -1.280 1.00 0.56 H new ATOM 0 HD2 LYS A 45 12.846 -8.512 -2.272 1.00 0.68 H new ATOM 0 HD3 LYS A 45 12.365 -7.590 -0.862 1.00 0.68 H new ATOM 0 HE2 LYS A 45 14.517 -7.221 -0.325 1.00 1.04 H new ATOM 0 HE3 LYS A 45 14.815 -8.944 -0.219 1.00 1.04 H new ATOM 0 HZ1 LYS A 45 16.156 -7.582 -1.889 1.00 1.09 H new ATOM 0 HZ2 LYS A 45 15.495 -9.052 -2.424 1.00 1.09 H new ATOM 0 HZ3 LYS A 45 14.754 -7.584 -2.846 1.00 1.09 H new ATOM 727 N HIS A 46 8.666 -10.986 1.590 1.00 0.28 N ATOM 728 CA HIS A 46 7.320 -10.837 2.125 1.00 0.31 C ATOM 729 C HIS A 46 7.110 -11.679 3.378 1.00 0.32 C ATOM 730 O HIS A 46 6.430 -11.247 4.309 1.00 0.34 O ATOM 731 CB HIS A 46 6.260 -11.156 1.078 1.00 0.38 C ATOM 732 CG HIS A 46 5.145 -10.157 1.089 1.00 0.43 C ATOM 733 ND1 HIS A 46 3.894 -10.427 1.601 1.00 0.58 N ATOM 734 CD2 HIS A 46 5.114 -8.858 0.694 1.00 0.47 C ATOM 735 CE1 HIS A 46 3.146 -9.343 1.522 1.00 0.64 C ATOM 736 NE2 HIS A 46 3.862 -8.379 0.976 1.00 0.58 N ATOM 0 H HIS A 46 8.765 -11.695 0.863 1.00 0.28 H new ATOM 0 HA HIS A 46 7.210 -9.790 2.407 1.00 0.31 H new ATOM 0 HB2 HIS A 46 6.720 -11.175 0.090 1.00 0.38 H new ATOM 0 HB3 HIS A 46 5.857 -12.152 1.262 1.00 0.38 H new ATOM 0 HD2 HIS A 46 5.925 -8.306 0.242 1.00 0.47 H new ATOM 0 HE1 HIS A 46 2.120 -9.259 1.849 1.00 0.64 H new ATOM 0 HE2 HIS A 46 3.536 -7.430 0.793 1.00 0.58 H new ATOM 745 N THR A 47 7.753 -12.837 3.437 1.00 0.33 N ATOM 746 CA THR A 47 7.690 -13.677 4.628 1.00 0.40 C ATOM 747 C THR A 47 8.374 -12.969 5.795 1.00 0.39 C ATOM 748 O THR A 47 7.804 -12.842 6.888 1.00 0.43 O ATOM 749 CB THR A 47 8.351 -15.051 4.385 1.00 0.47 C ATOM 750 OG1 THR A 47 7.852 -15.624 3.168 1.00 0.72 O ATOM 751 CG2 THR A 47 8.078 -16.000 5.541 1.00 0.60 C ATOM 0 H THR A 47 8.321 -13.216 2.680 1.00 0.33 H new ATOM 0 HA THR A 47 6.640 -13.848 4.867 1.00 0.40 H new ATOM 0 HB THR A 47 9.428 -14.900 4.307 1.00 0.47 H new ATOM 0 HG1 THR A 47 8.279 -15.187 2.402 1.00 0.72 H new ATOM 0 HG21 THR A 47 8.555 -16.960 5.344 1.00 0.60 H new ATOM 0 HG22 THR A 47 8.480 -15.577 6.462 1.00 0.60 H new ATOM 0 HG23 THR A 47 7.003 -16.144 5.647 1.00 0.60 H new ATOM 759 N ARG A 48 9.532 -12.384 5.505 1.00 0.35 N ATOM 760 CA ARG A 48 10.238 -11.564 6.474 1.00 0.38 C ATOM 761 C ARG A 48 9.398 -10.360 6.848 1.00 0.34 C ATOM 762 O ARG A 48 9.335 -9.982 8.010 1.00 0.38 O ATOM 763 CB ARG A 48 11.563 -11.084 5.904 1.00 0.42 C ATOM 764 CG ARG A 48 12.577 -10.710 6.967 1.00 0.73 C ATOM 765 CD ARG A 48 13.443 -11.897 7.338 1.00 0.80 C ATOM 766 NE ARG A 48 14.838 -11.679 6.981 1.00 0.90 N ATOM 767 CZ ARG A 48 15.697 -11.024 7.754 1.00 1.43 C ATOM 768 NH1 ARG A 48 15.322 -10.606 8.954 1.00 1.83 N ATOM 769 NH2 ARG A 48 16.938 -10.818 7.346 1.00 1.87 N ATOM 0 H ARG A 48 10.000 -12.465 4.602 1.00 0.35 H new ATOM 0 HA ARG A 48 10.426 -12.172 7.359 1.00 0.38 H new ATOM 0 HB2 ARG A 48 11.983 -11.867 5.272 1.00 0.42 H new ATOM 0 HB3 ARG A 48 11.383 -10.220 5.264 1.00 0.42 H new ATOM 0 HG2 ARG A 48 13.206 -9.897 6.604 1.00 0.73 H new ATOM 0 HG3 ARG A 48 12.060 -10.342 7.853 1.00 0.73 H new ATOM 0 HD2 ARG A 48 13.366 -12.083 8.409 1.00 0.80 H new ATOM 0 HD3 ARG A 48 13.073 -12.789 6.833 1.00 0.80 H new ATOM 0 HE ARG A 48 15.173 -12.048 6.091 1.00 0.90 H new ATOM 0 HH11 ARG A 48 14.374 -10.787 9.284 1.00 1.83 H new ATOM 0 HH12 ARG A 48 15.981 -10.103 9.548 1.00 1.83 H new ATOM 0 HH21 ARG A 48 17.239 -11.163 6.434 1.00 1.87 H new ATOM 0 HH22 ARG A 48 17.594 -10.314 7.943 1.00 1.87 H new ATOM 783 N PHE A 49 8.763 -9.765 5.843 1.00 0.32 N ATOM 784 CA PHE A 49 7.914 -8.601 6.044 1.00 0.32 C ATOM 785 C PHE A 49 6.900 -8.857 7.143 1.00 0.36 C ATOM 786 O PHE A 49 6.849 -8.129 8.126 1.00 0.39 O ATOM 787 CB PHE A 49 7.185 -8.244 4.752 1.00 0.33 C ATOM 788 CG PHE A 49 7.533 -6.890 4.213 1.00 0.39 C ATOM 789 CD1 PHE A 49 8.819 -6.389 4.338 1.00 0.85 C ATOM 790 CD2 PHE A 49 6.573 -6.117 3.582 1.00 0.85 C ATOM 791 CE1 PHE A 49 9.141 -5.144 3.839 1.00 0.94 C ATOM 792 CE2 PHE A 49 6.890 -4.871 3.081 1.00 0.92 C ATOM 793 CZ PHE A 49 8.176 -4.381 3.217 1.00 0.67 C ATOM 0 H PHE A 49 8.823 -10.075 4.873 1.00 0.32 H new ATOM 0 HA PHE A 49 8.552 -7.768 6.339 1.00 0.32 H new ATOM 0 HB2 PHE A 49 7.416 -8.995 3.997 1.00 0.33 H new ATOM 0 HB3 PHE A 49 6.110 -8.289 4.928 1.00 0.33 H new ATOM 0 HD1 PHE A 49 9.577 -6.979 4.831 1.00 0.85 H new ATOM 0 HD2 PHE A 49 5.566 -6.493 3.481 1.00 0.85 H new ATOM 0 HE1 PHE A 49 10.149 -4.767 3.936 1.00 0.94 H new ATOM 0 HE2 PHE A 49 6.135 -4.280 2.584 1.00 0.92 H new ATOM 0 HZ PHE A 49 8.424 -3.401 2.836 1.00 0.67 H new ATOM 803 N LYS A 50 6.130 -9.924 6.993 1.00 0.39 N ATOM 804 CA LYS A 50 5.126 -10.279 7.986 1.00 0.45 C ATOM 805 C LYS A 50 5.748 -10.397 9.380 1.00 0.42 C ATOM 806 O LYS A 50 5.245 -9.816 10.340 1.00 0.42 O ATOM 807 CB LYS A 50 4.434 -11.589 7.598 1.00 0.54 C ATOM 808 CG LYS A 50 3.856 -11.582 6.188 1.00 0.93 C ATOM 809 CD LYS A 50 2.343 -11.447 6.203 1.00 1.47 C ATOM 810 CE LYS A 50 1.656 -12.805 6.213 1.00 1.37 C ATOM 811 NZ LYS A 50 1.079 -13.126 7.544 1.00 2.17 N ATOM 0 H LYS A 50 6.180 -10.558 6.196 1.00 0.39 H new ATOM 0 HA LYS A 50 4.382 -9.483 8.015 1.00 0.45 H new ATOM 0 HB2 LYS A 50 5.149 -12.407 7.684 1.00 0.54 H new ATOM 0 HB3 LYS A 50 3.633 -11.791 8.309 1.00 0.54 H new ATOM 0 HG2 LYS A 50 4.289 -10.758 5.621 1.00 0.93 H new ATOM 0 HG3 LYS A 50 4.134 -12.503 5.676 1.00 0.93 H new ATOM 0 HD2 LYS A 50 2.037 -10.878 7.081 1.00 1.47 H new ATOM 0 HD3 LYS A 50 2.019 -10.882 5.329 1.00 1.47 H new ATOM 0 HE2 LYS A 50 0.866 -12.817 5.463 1.00 1.37 H new ATOM 0 HE3 LYS A 50 2.373 -13.576 5.933 1.00 1.37 H new ATOM 0 HZ1 LYS A 50 0.621 -14.059 7.508 1.00 2.17 H new ATOM 0 HZ2 LYS A 50 1.836 -13.140 8.257 1.00 2.17 H new ATOM 0 HZ3 LYS A 50 0.376 -12.404 7.801 1.00 2.17 H new ATOM 825 N ALA A 51 6.852 -11.132 9.480 1.00 0.43 N ATOM 826 CA ALA A 51 7.504 -11.360 10.771 1.00 0.46 C ATOM 827 C ALA A 51 8.121 -10.082 11.356 1.00 0.44 C ATOM 828 O ALA A 51 7.805 -9.685 12.486 1.00 0.47 O ATOM 829 CB ALA A 51 8.569 -12.436 10.626 1.00 0.53 C ATOM 0 H ALA A 51 7.314 -11.579 8.688 1.00 0.43 H new ATOM 0 HA ALA A 51 6.734 -11.689 11.469 1.00 0.46 H new ATOM 0 HB1 ALA A 51 9.052 -12.602 11.589 1.00 0.53 H new ATOM 0 HB2 ALA A 51 8.106 -13.363 10.287 1.00 0.53 H new ATOM 0 HB3 ALA A 51 9.314 -12.115 9.898 1.00 0.53 H new ATOM 835 N ALA A 52 9.043 -9.480 10.610 1.00 0.46 N ATOM 836 CA ALA A 52 9.777 -8.304 11.068 1.00 0.53 C ATOM 837 C ALA A 52 8.839 -7.153 11.421 1.00 0.53 C ATOM 838 O ALA A 52 8.954 -6.557 12.493 1.00 0.65 O ATOM 839 CB ALA A 52 10.766 -7.867 10.005 1.00 0.58 C ATOM 0 H ALA A 52 9.302 -9.792 9.674 1.00 0.46 H new ATOM 0 HA ALA A 52 10.316 -8.578 11.975 1.00 0.53 H new ATOM 0 HB1 ALA A 52 11.310 -6.989 10.353 1.00 0.58 H new ATOM 0 HB2 ALA A 52 11.470 -8.676 9.808 1.00 0.58 H new ATOM 0 HB3 ALA A 52 10.230 -7.621 9.088 1.00 0.58 H new ATOM 845 N CYS A 53 7.928 -6.827 10.510 1.00 0.48 N ATOM 846 CA CYS A 53 7.016 -5.712 10.715 1.00 0.56 C ATOM 847 C CYS A 53 6.033 -5.980 11.849 1.00 0.49 C ATOM 848 O CYS A 53 5.653 -5.057 12.562 1.00 0.53 O ATOM 849 CB CYS A 53 6.264 -5.396 9.428 1.00 0.68 C ATOM 850 SG CYS A 53 7.325 -5.384 7.971 1.00 1.29 S ATOM 0 H CYS A 53 7.803 -7.319 9.625 1.00 0.48 H new ATOM 0 HA CYS A 53 7.617 -4.848 10.999 1.00 0.56 H new ATOM 0 HB2 CYS A 53 5.472 -6.132 9.287 1.00 0.68 H new ATOM 0 HB3 CYS A 53 5.781 -4.424 9.526 1.00 0.68 H new ATOM 0 HG CYS A 53 7.619 -6.606 7.638 1.00 1.29 H new ATOM 856 N ALA A 54 5.652 -7.240 12.047 1.00 0.45 N ATOM 857 CA ALA A 54 4.757 -7.580 13.150 1.00 0.52 C ATOM 858 C ALA A 54 5.402 -7.245 14.488 1.00 0.53 C ATOM 859 O ALA A 54 4.760 -6.678 15.375 1.00 0.63 O ATOM 860 CB ALA A 54 4.379 -9.047 13.108 1.00 0.63 C ATOM 0 H ALA A 54 5.943 -8.029 11.470 1.00 0.45 H new ATOM 0 HA ALA A 54 3.850 -6.986 13.040 1.00 0.52 H new ATOM 0 HB1 ALA A 54 3.712 -9.275 13.940 1.00 0.63 H new ATOM 0 HB2 ALA A 54 3.874 -9.266 12.167 1.00 0.63 H new ATOM 0 HB3 ALA A 54 5.279 -9.657 13.187 1.00 0.63 H new ATOM 866 N ARG A 55 6.691 -7.551 14.604 1.00 0.53 N ATOM 867 CA ARG A 55 7.448 -7.249 15.812 1.00 0.66 C ATOM 868 C ARG A 55 7.556 -5.739 16.025 1.00 0.65 C ATOM 869 O ARG A 55 7.446 -5.246 17.149 1.00 0.75 O ATOM 870 CB ARG A 55 8.845 -7.864 15.722 1.00 0.77 C ATOM 871 CG ARG A 55 9.732 -7.543 16.914 1.00 1.38 C ATOM 872 CD ARG A 55 11.203 -7.554 16.534 1.00 1.87 C ATOM 873 NE ARG A 55 11.760 -6.205 16.417 1.00 2.37 N ATOM 874 CZ ARG A 55 12.472 -5.780 15.373 1.00 2.79 C ATOM 875 NH1 ARG A 55 12.654 -6.575 14.323 1.00 2.91 N ATOM 876 NH2 ARG A 55 12.981 -4.553 15.363 1.00 3.58 N ATOM 0 H ARG A 55 7.234 -8.010 13.872 1.00 0.53 H new ATOM 0 HA ARG A 55 6.920 -7.679 16.663 1.00 0.66 H new ATOM 0 HB2 ARG A 55 8.751 -8.946 15.631 1.00 0.77 H new ATOM 0 HB3 ARG A 55 9.331 -7.509 14.813 1.00 0.77 H new ATOM 0 HG2 ARG A 55 9.466 -6.564 17.313 1.00 1.38 H new ATOM 0 HG3 ARG A 55 9.555 -8.270 17.707 1.00 1.38 H new ATOM 0 HD2 ARG A 55 11.765 -8.112 17.283 1.00 1.87 H new ATOM 0 HD3 ARG A 55 11.327 -8.079 15.587 1.00 1.87 H new ATOM 0 HE ARG A 55 11.593 -5.550 17.181 1.00 2.37 H new ATOM 0 HH11 ARG A 55 12.249 -7.511 14.316 1.00 2.91 H new ATOM 0 HH12 ARG A 55 13.199 -6.249 13.525 1.00 2.91 H new ATOM 0 HH21 ARG A 55 12.828 -3.931 16.157 1.00 3.58 H new ATOM 0 HH22 ARG A 55 13.525 -4.233 14.562 1.00 3.58 H new ATOM 890 N LYS A 56 7.804 -5.013 14.944 1.00 0.59 N ATOM 891 CA LYS A 56 7.982 -3.567 15.017 1.00 0.64 C ATOM 892 C LYS A 56 6.644 -2.842 15.147 1.00 0.54 C ATOM 893 O LYS A 56 6.603 -1.668 15.513 1.00 0.67 O ATOM 894 CB LYS A 56 8.719 -3.071 13.776 1.00 0.71 C ATOM 895 CG LYS A 56 10.207 -3.361 13.798 1.00 1.15 C ATOM 896 CD LYS A 56 10.739 -3.606 12.400 1.00 1.46 C ATOM 897 CE LYS A 56 11.055 -2.301 11.693 1.00 2.01 C ATOM 898 NZ LYS A 56 12.483 -1.929 11.836 1.00 2.32 N ATOM 0 H LYS A 56 7.887 -5.401 14.004 1.00 0.59 H new ATOM 0 HA LYS A 56 8.571 -3.348 15.907 1.00 0.64 H new ATOM 0 HB2 LYS A 56 8.280 -3.535 12.893 1.00 0.71 H new ATOM 0 HB3 LYS A 56 8.568 -1.996 13.679 1.00 0.71 H new ATOM 0 HG2 LYS A 56 10.737 -2.522 14.250 1.00 1.15 H new ATOM 0 HG3 LYS A 56 10.401 -4.234 14.422 1.00 1.15 H new ATOM 0 HD2 LYS A 56 11.638 -4.220 12.453 1.00 1.46 H new ATOM 0 HD3 LYS A 56 10.004 -4.166 11.822 1.00 1.46 H new ATOM 0 HE2 LYS A 56 10.807 -2.391 10.635 1.00 2.01 H new ATOM 0 HE3 LYS A 56 10.430 -1.506 12.100 1.00 2.01 H new ATOM 0 HZ1 LYS A 56 12.642 -0.992 11.413 1.00 2.32 H new ATOM 0 HZ2 LYS A 56 12.735 -1.901 12.845 1.00 2.32 H new ATOM 0 HZ3 LYS A 56 13.075 -2.633 11.351 1.00 2.32 H new ATOM 912 N GLY A 57 5.568 -3.517 14.773 1.00 0.48 N ATOM 913 CA GLY A 57 4.262 -2.893 14.785 1.00 0.47 C ATOM 914 C GLY A 57 4.048 -2.029 13.562 1.00 0.51 C ATOM 915 O GLY A 57 3.725 -0.850 13.677 1.00 0.58 O ATOM 0 H GLY A 57 5.576 -4.488 14.461 1.00 0.48 H new ATOM 0 HA2 GLY A 57 3.491 -3.662 14.828 1.00 0.47 H new ATOM 0 HA3 GLY A 57 4.156 -2.285 15.684 1.00 0.47 H new ATOM 919 N THR A 58 4.340 -2.587 12.400 1.00 0.59 N ATOM 920 CA THR A 58 4.263 -1.844 11.154 1.00 0.73 C ATOM 921 C THR A 58 3.259 -2.472 10.189 1.00 0.56 C ATOM 922 O THR A 58 3.323 -3.672 9.902 1.00 0.53 O ATOM 923 CB THR A 58 5.646 -1.784 10.476 1.00 1.06 C ATOM 924 OG1 THR A 58 6.673 -1.685 11.473 1.00 2.01 O ATOM 925 CG2 THR A 58 5.737 -0.603 9.527 1.00 0.61 C ATOM 0 H THR A 58 4.634 -3.558 12.293 1.00 0.59 H new ATOM 0 HA THR A 58 3.929 -0.836 11.398 1.00 0.73 H new ATOM 0 HB THR A 58 5.783 -2.699 9.899 1.00 1.06 H new ATOM 0 HG1 THR A 58 7.550 -1.649 11.037 1.00 2.01 H new ATOM 0 HG21 THR A 58 6.723 -0.585 9.062 1.00 0.61 H new ATOM 0 HG22 THR A 58 4.974 -0.697 8.755 1.00 0.61 H new ATOM 0 HG23 THR A 58 5.580 0.322 10.081 1.00 0.61 H new ATOM 933 N SER A 59 2.373 -1.644 9.654 1.00 0.55 N ATOM 934 CA SER A 59 1.420 -2.085 8.646 1.00 0.50 C ATOM 935 C SER A 59 2.145 -2.343 7.330 1.00 0.44 C ATOM 936 O SER A 59 3.128 -1.671 7.026 1.00 0.43 O ATOM 937 CB SER A 59 0.329 -1.031 8.458 1.00 0.61 C ATOM 938 OG SER A 59 0.263 -0.167 9.582 1.00 0.72 O ATOM 0 H SER A 59 2.294 -0.658 9.903 1.00 0.55 H new ATOM 0 HA SER A 59 0.951 -3.012 8.977 1.00 0.50 H new ATOM 0 HB2 SER A 59 0.530 -0.450 7.558 1.00 0.61 H new ATOM 0 HB3 SER A 59 -0.634 -1.520 8.313 1.00 0.61 H new ATOM 0 HG SER A 59 -0.440 0.501 9.440 1.00 0.72 H new ATOM 944 N ILE A 60 1.726 -3.386 6.619 1.00 0.46 N ATOM 945 CA ILE A 60 2.406 -3.842 5.405 1.00 0.50 C ATOM 946 C ILE A 60 2.678 -2.702 4.407 1.00 0.47 C ATOM 947 O ILE A 60 3.716 -2.693 3.741 1.00 0.50 O ATOM 948 CB ILE A 60 1.617 -4.998 4.730 1.00 0.61 C ATOM 949 CG1 ILE A 60 2.550 -6.178 4.455 1.00 0.99 C ATOM 950 CG2 ILE A 60 0.927 -4.556 3.444 1.00 1.01 C ATOM 951 CD1 ILE A 60 2.896 -6.976 5.694 1.00 0.96 C ATOM 0 H ILE A 60 0.906 -3.940 6.866 1.00 0.46 H new ATOM 0 HA ILE A 60 3.380 -4.219 5.716 1.00 0.50 H new ATOM 0 HB ILE A 60 0.834 -5.306 5.423 1.00 0.61 H new ATOM 0 HG12 ILE A 60 2.082 -6.839 3.726 1.00 0.99 H new ATOM 0 HG13 ILE A 60 3.470 -5.806 4.003 1.00 0.99 H new ATOM 0 HG21 ILE A 60 0.390 -5.400 3.011 1.00 1.01 H new ATOM 0 HG22 ILE A 60 0.224 -3.753 3.666 1.00 1.01 H new ATOM 0 HG23 ILE A 60 1.674 -4.199 2.735 1.00 1.01 H new ATOM 0 HD11 ILE A 60 3.561 -7.797 5.424 1.00 0.96 H new ATOM 0 HD12 ILE A 60 3.393 -6.329 6.417 1.00 0.96 H new ATOM 0 HD13 ILE A 60 1.984 -7.378 6.135 1.00 0.96 H new ATOM 963 N THR A 61 1.786 -1.717 4.343 1.00 0.45 N ATOM 964 CA THR A 61 1.987 -0.573 3.461 1.00 0.45 C ATOM 965 C THR A 61 2.965 0.429 4.086 1.00 0.42 C ATOM 966 O THR A 61 3.835 0.987 3.407 1.00 0.41 O ATOM 967 CB THR A 61 0.647 0.133 3.145 1.00 0.51 C ATOM 968 OG1 THR A 61 -0.258 -0.787 2.517 1.00 0.68 O ATOM 969 CG2 THR A 61 0.858 1.332 2.231 1.00 0.77 C ATOM 0 H THR A 61 0.924 -1.688 4.887 1.00 0.45 H new ATOM 0 HA THR A 61 2.409 -0.948 2.529 1.00 0.45 H new ATOM 0 HB THR A 61 0.224 0.483 4.087 1.00 0.51 H new ATOM 0 HG1 THR A 61 -1.104 -0.332 2.322 1.00 0.68 H new ATOM 0 HG21 THR A 61 -0.101 1.807 2.027 1.00 0.77 H new ATOM 0 HG22 THR A 61 1.521 2.048 2.717 1.00 0.77 H new ATOM 0 HG23 THR A 61 1.305 1.001 1.294 1.00 0.77 H new ATOM 977 N ASP A 62 2.843 0.609 5.395 1.00 0.42 N ATOM 978 CA ASP A 62 3.696 1.531 6.140 1.00 0.42 C ATOM 979 C ASP A 62 5.165 1.128 6.065 1.00 0.36 C ATOM 980 O ASP A 62 6.045 1.986 6.044 1.00 0.35 O ATOM 981 CB ASP A 62 3.253 1.604 7.601 1.00 0.47 C ATOM 982 CG ASP A 62 3.851 2.788 8.341 1.00 0.61 C ATOM 983 OD1 ASP A 62 3.888 3.902 7.772 1.00 0.92 O ATOM 984 OD2 ASP A 62 4.271 2.612 9.506 1.00 1.06 O ATOM 0 H ASP A 62 2.154 0.123 5.969 1.00 0.42 H new ATOM 0 HA ASP A 62 3.593 2.514 5.680 1.00 0.42 H new ATOM 0 HB2 ASP A 62 2.166 1.667 7.643 1.00 0.47 H new ATOM 0 HB3 ASP A 62 3.539 0.683 8.109 1.00 0.47 H new ATOM 989 N VAL A 63 5.426 -0.175 5.994 1.00 0.34 N ATOM 990 CA VAL A 63 6.801 -0.664 5.900 1.00 0.32 C ATOM 991 C VAL A 63 7.490 -0.120 4.662 1.00 0.31 C ATOM 992 O VAL A 63 8.559 0.480 4.753 1.00 0.35 O ATOM 993 CB VAL A 63 6.901 -2.196 5.843 1.00 0.36 C ATOM 994 CG1 VAL A 63 8.260 -2.639 6.352 1.00 0.68 C ATOM 995 CG2 VAL A 63 5.793 -2.855 6.634 1.00 0.66 C ATOM 0 H VAL A 63 4.713 -0.905 6.000 1.00 0.34 H new ATOM 0 HA VAL A 63 7.287 -0.313 6.810 1.00 0.32 H new ATOM 0 HB VAL A 63 6.787 -2.508 4.805 1.00 0.36 H new ATOM 0 HG11 VAL A 63 8.328 -3.726 6.310 1.00 0.68 H new ATOM 0 HG12 VAL A 63 9.041 -2.203 5.730 1.00 0.68 H new ATOM 0 HG13 VAL A 63 8.389 -2.307 7.382 1.00 0.68 H new ATOM 0 HG21 VAL A 63 5.896 -3.938 6.571 1.00 0.66 H new ATOM 0 HG22 VAL A 63 5.856 -2.545 7.677 1.00 0.66 H new ATOM 0 HG23 VAL A 63 4.827 -2.558 6.225 1.00 0.66 H new ATOM 1005 N VAL A 64 6.878 -0.345 3.505 1.00 0.29 N ATOM 1006 CA VAL A 64 7.444 0.104 2.243 1.00 0.29 C ATOM 1007 C VAL A 64 7.641 1.613 2.255 1.00 0.31 C ATOM 1008 O VAL A 64 8.664 2.120 1.793 1.00 0.34 O ATOM 1009 CB VAL A 64 6.560 -0.280 1.040 1.00 0.31 C ATOM 1010 CG1 VAL A 64 7.403 -0.401 -0.222 1.00 0.33 C ATOM 1011 CG2 VAL A 64 5.804 -1.574 1.308 1.00 0.38 C ATOM 0 H VAL A 64 5.989 -0.837 3.417 1.00 0.29 H new ATOM 0 HA VAL A 64 8.406 -0.397 2.133 1.00 0.29 H new ATOM 0 HB VAL A 64 5.826 0.512 0.892 1.00 0.31 H new ATOM 0 HG11 VAL A 64 6.764 -0.673 -1.062 1.00 0.33 H new ATOM 0 HG12 VAL A 64 7.888 0.553 -0.429 1.00 0.33 H new ATOM 0 HG13 VAL A 64 8.162 -1.170 -0.080 1.00 0.33 H new ATOM 0 HG21 VAL A 64 5.188 -1.821 0.443 1.00 0.38 H new ATOM 0 HG22 VAL A 64 6.515 -2.380 1.490 1.00 0.38 H new ATOM 0 HG23 VAL A 64 5.167 -1.448 2.183 1.00 0.38 H new ATOM 1021 N ASN A 65 6.698 2.314 2.877 1.00 0.32 N ATOM 1022 CA ASN A 65 6.796 3.757 3.041 1.00 0.35 C ATOM 1023 C ASN A 65 8.004 4.122 3.909 1.00 0.38 C ATOM 1024 O ASN A 65 8.719 5.086 3.628 1.00 0.40 O ATOM 1025 CB ASN A 65 5.510 4.307 3.664 1.00 0.40 C ATOM 1026 CG ASN A 65 5.332 5.791 3.417 1.00 0.48 C ATOM 1027 OD1 ASN A 65 5.504 6.608 4.322 1.00 0.91 O ATOM 1028 ND2 ASN A 65 4.982 6.150 2.191 1.00 0.48 N ATOM 0 H ASN A 65 5.855 1.902 3.277 1.00 0.32 H new ATOM 0 HA ASN A 65 6.931 4.207 2.057 1.00 0.35 H new ATOM 0 HB2 ASN A 65 4.654 3.769 3.256 1.00 0.40 H new ATOM 0 HB3 ASN A 65 5.522 4.120 4.738 1.00 0.40 H new ATOM 0 HD21 ASN A 65 4.845 7.136 1.968 1.00 0.48 H new ATOM 0 HD22 ASN A 65 4.850 5.441 1.470 1.00 0.48 H new ATOM 1035 N GLN A 66 8.256 3.314 4.931 1.00 0.39 N ATOM 1036 CA GLN A 66 9.388 3.526 5.825 1.00 0.42 C ATOM 1037 C GLN A 66 10.715 3.322 5.096 1.00 0.40 C ATOM 1038 O GLN A 66 11.589 4.192 5.128 1.00 0.44 O ATOM 1039 CB GLN A 66 9.309 2.573 7.016 1.00 0.44 C ATOM 1040 CG GLN A 66 9.278 3.275 8.360 1.00 0.87 C ATOM 1041 CD GLN A 66 8.129 2.805 9.227 1.00 1.45 C ATOM 1042 OE1 GLN A 66 8.312 1.996 10.141 1.00 2.20 O ATOM 1043 NE2 GLN A 66 6.938 3.293 8.938 1.00 1.61 N ATOM 0 H GLN A 66 7.687 2.500 5.163 1.00 0.39 H new ATOM 0 HA GLN A 66 9.342 4.556 6.179 1.00 0.42 H new ATOM 0 HB2 GLN A 66 8.415 1.957 6.918 1.00 0.44 H new ATOM 0 HB3 GLN A 66 10.165 1.899 6.988 1.00 0.44 H new ATOM 0 HG2 GLN A 66 10.219 3.099 8.881 1.00 0.87 H new ATOM 0 HG3 GLN A 66 9.196 4.351 8.204 1.00 0.87 H new ATOM 0 HE21 GLN A 66 6.832 3.960 8.174 1.00 1.61 H new ATOM 0 HE22 GLN A 66 6.123 3.003 9.479 1.00 1.61 H new ATOM 1052 N LEU A 67 10.890 2.148 4.492 1.00 0.36 N ATOM 1053 CA LEU A 67 12.160 1.812 3.852 1.00 0.35 C ATOM 1054 C LEU A 67 12.447 2.725 2.665 1.00 0.31 C ATOM 1055 O LEU A 67 13.598 3.102 2.441 1.00 0.32 O ATOM 1056 CB LEU A 67 12.217 0.341 3.410 1.00 0.38 C ATOM 1057 CG LEU A 67 10.887 -0.311 3.036 1.00 0.63 C ATOM 1058 CD1 LEU A 67 10.805 -0.543 1.537 1.00 1.04 C ATOM 1059 CD2 LEU A 67 10.717 -1.623 3.786 1.00 1.01 C ATOM 0 H LEU A 67 10.177 1.421 4.432 1.00 0.36 H new ATOM 0 HA LEU A 67 12.932 1.966 4.606 1.00 0.35 H new ATOM 0 HB2 LEU A 67 12.886 0.268 2.552 1.00 0.38 H new ATOM 0 HB3 LEU A 67 12.667 -0.240 4.215 1.00 0.38 H new ATOM 0 HG LEU A 67 10.080 0.363 3.321 1.00 0.63 H new ATOM 0 HD11 LEU A 67 9.850 -1.008 1.293 1.00 1.04 H new ATOM 0 HD12 LEU A 67 10.888 0.411 1.016 1.00 1.04 H new ATOM 0 HD13 LEU A 67 11.618 -1.199 1.225 1.00 1.04 H new ATOM 0 HD21 LEU A 67 9.766 -2.078 3.511 1.00 1.01 H new ATOM 0 HD22 LEU A 67 11.531 -2.299 3.526 1.00 1.01 H new ATOM 0 HD23 LEU A 67 10.732 -1.433 4.859 1.00 1.01 H new ATOM 1071 N VAL A 68 11.409 3.112 1.923 1.00 0.29 N ATOM 1072 CA VAL A 68 11.599 4.015 0.793 1.00 0.28 C ATOM 1073 C VAL A 68 12.079 5.370 1.282 1.00 0.30 C ATOM 1074 O VAL A 68 12.976 5.972 0.692 1.00 0.32 O ATOM 1075 CB VAL A 68 10.324 4.176 -0.073 1.00 0.28 C ATOM 1076 CG1 VAL A 68 9.254 5.003 0.618 1.00 0.81 C ATOM 1077 CG2 VAL A 68 10.674 4.772 -1.426 1.00 0.69 C ATOM 0 H VAL A 68 10.445 2.819 2.081 1.00 0.29 H new ATOM 0 HA VAL A 68 12.358 3.565 0.152 1.00 0.28 H new ATOM 0 HB VAL A 68 9.907 3.180 -0.220 1.00 0.28 H new ATOM 0 HG11 VAL A 68 8.382 5.085 -0.031 1.00 0.81 H new ATOM 0 HG12 VAL A 68 8.967 4.519 1.552 1.00 0.81 H new ATOM 0 HG13 VAL A 68 9.644 5.999 0.830 1.00 0.81 H new ATOM 0 HG21 VAL A 68 9.768 4.879 -2.022 1.00 0.69 H new ATOM 0 HG22 VAL A 68 11.133 5.751 -1.285 1.00 0.69 H new ATOM 0 HG23 VAL A 68 11.373 4.115 -1.943 1.00 0.69 H new ATOM 1087 N ASP A 69 11.554 5.796 2.423 1.00 0.33 N ATOM 1088 CA ASP A 69 11.993 7.035 3.048 1.00 0.39 C ATOM 1089 C ASP A 69 13.439 6.912 3.502 1.00 0.36 C ATOM 1090 O ASP A 69 14.253 7.806 3.276 1.00 0.37 O ATOM 1091 CB ASP A 69 11.099 7.373 4.242 1.00 0.50 C ATOM 1092 CG ASP A 69 10.911 8.862 4.412 1.00 0.74 C ATOM 1093 OD1 ASP A 69 11.116 9.610 3.431 1.00 1.11 O ATOM 1094 OD2 ASP A 69 10.564 9.295 5.530 1.00 1.33 O ATOM 0 H ASP A 69 10.823 5.301 2.934 1.00 0.33 H new ATOM 0 HA ASP A 69 11.920 7.838 2.314 1.00 0.39 H new ATOM 0 HB2 ASP A 69 10.126 6.899 4.111 1.00 0.50 H new ATOM 0 HB3 ASP A 69 11.536 6.958 5.150 1.00 0.50 H new ATOM 1099 N ASN A 70 13.748 5.776 4.114 1.00 0.35 N ATOM 1100 CA ASN A 70 15.086 5.501 4.620 1.00 0.37 C ATOM 1101 C ASN A 70 16.122 5.503 3.500 1.00 0.33 C ATOM 1102 O ASN A 70 17.080 6.278 3.532 1.00 0.40 O ATOM 1103 CB ASN A 70 15.106 4.149 5.341 1.00 0.44 C ATOM 1104 CG ASN A 70 16.103 4.107 6.485 1.00 0.89 C ATOM 1105 OD1 ASN A 70 17.174 4.707 6.419 1.00 0.95 O ATOM 1106 ND2 ASN A 70 15.756 3.390 7.541 1.00 1.69 N ATOM 0 H ASN A 70 13.080 5.022 4.273 1.00 0.35 H new ATOM 0 HA ASN A 70 15.346 6.295 5.321 1.00 0.37 H new ATOM 0 HB2 ASN A 70 14.109 3.933 5.726 1.00 0.44 H new ATOM 0 HB3 ASN A 70 15.349 3.364 4.625 1.00 0.44 H new ATOM 0 HD21 ASN A 70 16.387 3.320 8.340 1.00 1.69 H new ATOM 0 HD22 ASN A 70 14.858 2.907 7.557 1.00 1.69 H new ATOM 1113 N TRP A 71 15.947 4.602 2.536 1.00 0.30 N ATOM 1114 CA TRP A 71 16.911 4.437 1.454 1.00 0.36 C ATOM 1115 C TRP A 71 17.075 5.719 0.642 1.00 0.35 C ATOM 1116 O TRP A 71 18.191 6.094 0.280 1.00 0.40 O ATOM 1117 CB TRP A 71 16.497 3.284 0.528 1.00 0.42 C ATOM 1118 CG TRP A 71 17.522 2.969 -0.518 1.00 0.52 C ATOM 1119 CD1 TRP A 71 18.665 2.244 -0.353 1.00 0.63 C ATOM 1120 CD2 TRP A 71 17.498 3.372 -1.892 1.00 0.58 C ATOM 1121 NE1 TRP A 71 19.366 2.197 -1.533 1.00 0.72 N ATOM 1122 CE2 TRP A 71 18.665 2.872 -2.490 1.00 0.68 C ATOM 1123 CE3 TRP A 71 16.600 4.108 -2.675 1.00 0.62 C ATOM 1124 CZ2 TRP A 71 18.969 3.090 -3.829 1.00 0.77 C ATOM 1125 CZ3 TRP A 71 16.900 4.319 -4.007 1.00 0.73 C ATOM 1126 CH2 TRP A 71 18.075 3.809 -4.573 1.00 0.77 C ATOM 0 H TRP A 71 15.145 3.975 2.483 1.00 0.30 H new ATOM 0 HA TRP A 71 17.871 4.201 1.913 1.00 0.36 H new ATOM 0 HB2 TRP A 71 16.314 2.393 1.128 1.00 0.42 H new ATOM 0 HB3 TRP A 71 15.556 3.538 0.040 1.00 0.42 H new ATOM 0 HD1 TRP A 71 18.974 1.776 0.570 1.00 0.63 H new ATOM 0 HE1 TRP A 71 20.264 1.733 -1.672 1.00 0.72 H new ATOM 0 HE3 TRP A 71 15.691 4.503 -2.246 1.00 0.62 H new ATOM 0 HZ2 TRP A 71 19.879 2.705 -4.266 1.00 0.77 H new ATOM 0 HZ3 TRP A 71 16.217 4.887 -4.622 1.00 0.73 H new ATOM 0 HH2 TRP A 71 18.279 3.987 -5.618 1.00 0.77 H new ATOM 1137 N LEU A 72 15.964 6.362 0.313 1.00 0.36 N ATOM 1138 CA LEU A 72 16.000 7.551 -0.531 1.00 0.42 C ATOM 1139 C LEU A 72 16.724 8.704 0.149 1.00 0.49 C ATOM 1140 O LEU A 72 17.381 9.501 -0.512 1.00 0.61 O ATOM 1141 CB LEU A 72 14.586 7.986 -0.910 1.00 0.45 C ATOM 1142 CG LEU A 72 14.343 8.234 -2.404 1.00 0.42 C ATOM 1143 CD1 LEU A 72 15.495 7.706 -3.250 1.00 1.23 C ATOM 1144 CD2 LEU A 72 13.034 7.595 -2.834 1.00 1.38 C ATOM 0 H LEU A 72 15.030 6.084 0.615 1.00 0.36 H new ATOM 0 HA LEU A 72 16.551 7.287 -1.434 1.00 0.42 H new ATOM 0 HB2 LEU A 72 13.887 7.222 -0.569 1.00 0.45 H new ATOM 0 HB3 LEU A 72 14.349 8.900 -0.366 1.00 0.45 H new ATOM 0 HG LEU A 72 14.282 9.311 -2.561 1.00 0.42 H new ATOM 0 HD11 LEU A 72 15.291 7.898 -4.303 1.00 1.23 H new ATOM 0 HD12 LEU A 72 16.418 8.209 -2.962 1.00 1.23 H new ATOM 0 HD13 LEU A 72 15.601 6.633 -3.091 1.00 1.23 H new ATOM 0 HD21 LEU A 72 12.872 7.777 -3.896 1.00 1.38 H new ATOM 0 HD22 LEU A 72 13.077 6.521 -2.653 1.00 1.38 H new ATOM 0 HD23 LEU A 72 12.213 8.027 -2.262 1.00 1.38 H new ATOM 1156 N LYS A 73 16.551 8.828 1.457 1.00 0.51 N ATOM 1157 CA LYS A 73 17.137 9.943 2.186 1.00 0.64 C ATOM 1158 C LYS A 73 18.585 9.659 2.588 1.00 0.63 C ATOM 1159 O LYS A 73 19.330 10.574 2.929 1.00 0.74 O ATOM 1160 CB LYS A 73 16.296 10.277 3.418 1.00 0.82 C ATOM 1161 CG LYS A 73 14.951 10.909 3.073 1.00 0.97 C ATOM 1162 CD LYS A 73 14.180 11.297 4.323 1.00 1.32 C ATOM 1163 CE LYS A 73 13.225 12.447 4.053 1.00 1.19 C ATOM 1164 NZ LYS A 73 11.804 12.038 4.194 1.00 1.42 N ATOM 0 H LYS A 73 16.015 8.177 2.031 1.00 0.51 H new ATOM 0 HA LYS A 73 17.144 10.805 1.519 1.00 0.64 H new ATOM 0 HB2 LYS A 73 16.126 9.366 3.992 1.00 0.82 H new ATOM 0 HB3 LYS A 73 16.856 10.958 4.059 1.00 0.82 H new ATOM 0 HG2 LYS A 73 15.111 11.792 2.454 1.00 0.97 H new ATOM 0 HG3 LYS A 73 14.360 10.209 2.482 1.00 0.97 H new ATOM 0 HD2 LYS A 73 13.620 10.436 4.689 1.00 1.32 H new ATOM 0 HD3 LYS A 73 14.879 11.580 5.110 1.00 1.32 H new ATOM 0 HE2 LYS A 73 13.437 13.263 4.743 1.00 1.19 H new ATOM 0 HE3 LYS A 73 13.394 12.829 3.046 1.00 1.19 H new ATOM 0 HZ1 LYS A 73 11.188 12.797 3.840 1.00 1.42 H new ATOM 0 HZ2 LYS A 73 11.636 11.171 3.645 1.00 1.42 H new ATOM 0 HZ3 LYS A 73 11.592 11.859 5.196 1.00 1.42 H new ATOM 1178 N GLU A 74 18.980 8.394 2.560 1.00 0.60 N ATOM 1179 CA GLU A 74 20.347 8.025 2.919 1.00 0.77 C ATOM 1180 C GLU A 74 21.233 7.917 1.678 1.00 0.85 C ATOM 1181 O GLU A 74 22.313 8.508 1.616 1.00 1.00 O ATOM 1182 CB GLU A 74 20.366 6.702 3.686 1.00 0.93 C ATOM 1183 CG GLU A 74 19.827 6.807 5.106 1.00 1.00 C ATOM 1184 CD GLU A 74 20.163 8.127 5.780 1.00 1.39 C ATOM 1185 OE1 GLU A 74 21.359 8.482 5.853 1.00 1.30 O ATOM 1186 OE2 GLU A 74 19.233 8.803 6.264 1.00 2.41 O ATOM 0 H GLU A 74 18.382 7.611 2.296 1.00 0.60 H new ATOM 0 HA GLU A 74 20.743 8.812 3.560 1.00 0.77 H new ATOM 0 HB2 GLU A 74 19.778 5.966 3.138 1.00 0.93 H new ATOM 0 HB3 GLU A 74 21.389 6.329 3.723 1.00 0.93 H new ATOM 0 HG2 GLU A 74 18.744 6.682 5.086 1.00 1.00 H new ATOM 0 HG3 GLU A 74 20.232 5.989 5.702 1.00 1.00 H new ATOM 1193 N ASN A 75 20.781 7.127 0.708 1.00 0.95 N ATOM 1194 CA ASN A 75 21.549 6.883 -0.514 1.00 1.20 C ATOM 1195 C ASN A 75 21.581 8.118 -1.412 1.00 1.20 C ATOM 1196 O ASN A 75 22.549 8.340 -2.143 1.00 1.32 O ATOM 1197 CB ASN A 75 20.977 5.673 -1.270 1.00 1.49 C ATOM 1198 CG ASN A 75 20.363 6.026 -2.610 1.00 1.22 C ATOM 1199 OD1 ASN A 75 21.037 6.037 -3.642 1.00 1.55 O ATOM 1200 ND2 ASN A 75 19.070 6.298 -2.606 1.00 0.88 N ATOM 0 H ASN A 75 19.884 6.642 0.743 1.00 0.95 H new ATOM 0 HA ASN A 75 22.577 6.662 -0.226 1.00 1.20 H new ATOM 0 HB2 ASN A 75 21.772 4.944 -1.426 1.00 1.49 H new ATOM 0 HB3 ASN A 75 20.221 5.192 -0.649 1.00 1.49 H new ATOM 0 HD21 ASN A 75 18.594 6.528 -3.479 1.00 0.88 H new ATOM 0 HD22 ASN A 75 18.547 6.278 -1.730 1.00 0.88 H new ATOM 1207 N GLU A 76 20.545 8.939 -1.332 1.00 1.19 N ATOM 1208 CA GLU A 76 20.473 10.146 -2.135 1.00 1.36 C ATOM 1209 C GLU A 76 20.486 11.374 -1.239 1.00 1.69 C ATOM 1210 O GLU A 76 21.175 12.355 -1.580 1.00 2.16 O ATOM 1211 CB GLU A 76 19.209 10.129 -2.998 1.00 1.69 C ATOM 1212 CG GLU A 76 19.488 10.057 -4.492 1.00 1.63 C ATOM 1213 CD GLU A 76 19.616 11.427 -5.122 1.00 2.07 C ATOM 1214 OE1 GLU A 76 18.722 12.275 -4.911 1.00 2.17 O ATOM 1215 OE2 GLU A 76 20.604 11.662 -5.846 1.00 2.92 O ATOM 1216 OXT GLU A 76 19.818 11.348 -0.184 1.00 2.16 O ATOM 0 H GLU A 76 19.744 8.790 -0.719 1.00 1.19 H new ATOM 0 HA GLU A 76 21.343 10.186 -2.791 1.00 1.36 H new ATOM 0 HB2 GLU A 76 18.595 9.275 -2.711 1.00 1.69 H new ATOM 0 HB3 GLU A 76 18.625 11.026 -2.789 1.00 1.69 H new ATOM 0 HG2 GLU A 76 20.407 9.495 -4.661 1.00 1.63 H new ATOM 0 HG3 GLU A 76 18.684 9.508 -4.983 1.00 1.63 H new TER 1223 GLU A 76 ATOM 1224 N MET B 1 -48.872 -56.712 -53.677 1.00 49.72 N ATOM 1225 CA MET B 1 -49.453 -56.405 -55.005 1.00 50.01 C ATOM 1226 C MET B 1 -50.893 -55.916 -54.885 1.00 50.09 C ATOM 1227 O MET B 1 -51.348 -55.099 -55.686 1.00 50.14 O ATOM 1228 CB MET B 1 -49.393 -57.670 -55.865 1.00 49.83 C ATOM 1229 CG MET B 1 -49.707 -57.431 -57.333 1.00 50.16 C ATOM 1230 SD MET B 1 -50.788 -58.702 -58.023 1.00 50.63 S ATOM 1231 CE MET B 1 -52.232 -57.723 -58.431 1.00 50.90 C ATOM 0 H1 MET B 1 -47.850 -56.877 -53.775 1.00 49.72 H new ATOM 0 H2 MET B 1 -49.033 -55.911 -53.034 1.00 49.72 H new ATOM 0 H3 MET B 1 -49.325 -57.564 -53.289 1.00 49.72 H new ATOM 0 HA MET B 1 -48.877 -55.604 -55.469 1.00 50.01 H new ATOM 0 HB2 MET B 1 -48.398 -58.107 -55.783 1.00 49.83 H new ATOM 0 HB3 MET B 1 -50.096 -58.402 -55.467 1.00 49.83 H new ATOM 0 HG2 MET B 1 -50.180 -56.455 -57.446 1.00 50.16 H new ATOM 0 HG3 MET B 1 -48.777 -57.402 -57.900 1.00 50.16 H new ATOM 0 HE1 MET B 1 -52.995 -58.366 -58.869 1.00 50.90 H new ATOM 0 HE2 MET B 1 -52.624 -57.259 -57.526 1.00 50.90 H new ATOM 0 HE3 MET B 1 -51.956 -56.948 -59.146 1.00 50.90 H new ATOM 1243 N SER B 2 -51.628 -56.456 -53.918 1.00 50.14 N ATOM 1244 CA SER B 2 -53.031 -56.106 -53.747 1.00 50.28 C ATOM 1245 C SER B 2 -53.185 -54.720 -53.118 1.00 49.60 C ATOM 1246 O SER B 2 -53.599 -53.771 -53.785 1.00 49.19 O ATOM 1247 CB SER B 2 -53.733 -57.162 -52.894 1.00 50.63 C ATOM 1248 OG SER B 2 -52.919 -58.317 -52.749 1.00 50.88 O ATOM 0 H SER B 2 -51.276 -57.135 -53.244 1.00 50.14 H new ATOM 0 HA SER B 2 -53.497 -56.077 -54.732 1.00 50.28 H new ATOM 0 HB2 SER B 2 -53.963 -56.748 -51.912 1.00 50.63 H new ATOM 0 HB3 SER B 2 -54.682 -57.436 -53.355 1.00 50.63 H new ATOM 0 HG SER B 2 -53.386 -58.979 -52.198 1.00 50.88 H new ATOM 1254 N LEU B 3 -52.837 -54.601 -51.846 1.00 49.51 N ATOM 1255 CA LEU B 3 -52.948 -53.330 -51.144 1.00 48.94 C ATOM 1256 C LEU B 3 -51.616 -52.934 -50.525 1.00 48.22 C ATOM 1257 O LEU B 3 -51.191 -53.509 -49.520 1.00 48.18 O ATOM 1258 CB LEU B 3 -54.026 -53.409 -50.061 1.00 48.75 C ATOM 1259 CG LEU B 3 -55.070 -52.292 -50.108 1.00 48.99 C ATOM 1260 CD1 LEU B 3 -55.904 -52.402 -51.374 1.00 49.26 C ATOM 1261 CD2 LEU B 3 -55.962 -52.342 -48.876 1.00 48.96 C ATOM 0 H LEU B 3 -52.476 -55.368 -51.279 1.00 49.51 H new ATOM 0 HA LEU B 3 -53.232 -52.568 -51.870 1.00 48.94 H new ATOM 0 HB2 LEU B 3 -54.537 -54.368 -50.147 1.00 48.75 H new ATOM 0 HB3 LEU B 3 -53.541 -53.393 -49.085 1.00 48.75 H new ATOM 0 HG LEU B 3 -54.551 -51.333 -50.116 1.00 48.99 H new ATOM 0 HD11 LEU B 3 -56.643 -51.601 -51.394 1.00 49.26 H new ATOM 0 HD12 LEU B 3 -55.255 -52.319 -52.246 1.00 49.26 H new ATOM 0 HD13 LEU B 3 -56.413 -53.366 -51.392 1.00 49.26 H new ATOM 0 HD21 LEU B 3 -56.698 -51.540 -48.927 1.00 48.96 H new ATOM 0 HD22 LEU B 3 -56.475 -53.303 -48.837 1.00 48.96 H new ATOM 0 HD23 LEU B 3 -55.353 -52.219 -47.981 1.00 48.96 H new ATOM 1273 N GLU B 4 -50.970 -51.939 -51.115 1.00 47.69 N ATOM 1274 CA GLU B 4 -49.699 -51.449 -50.606 1.00 46.99 C ATOM 1275 C GLU B 4 -49.860 -50.061 -50.003 1.00 46.41 C ATOM 1276 O GLU B 4 -50.568 -49.212 -50.552 1.00 46.09 O ATOM 1277 CB GLU B 4 -48.650 -51.419 -51.717 1.00 47.08 C ATOM 1278 CG GLU B 4 -47.299 -51.963 -51.287 1.00 47.35 C ATOM 1279 CD GLU B 4 -47.341 -53.446 -50.984 1.00 47.87 C ATOM 1280 OE1 GLU B 4 -47.706 -53.823 -49.850 1.00 47.70 O ATOM 1281 OE2 GLU B 4 -47.003 -54.243 -51.881 1.00 48.48 O ATOM 0 H GLU B 4 -51.306 -51.455 -51.948 1.00 47.69 H new ATOM 0 HA GLU B 4 -49.362 -52.131 -49.825 1.00 46.99 H new ATOM 0 HB2 GLU B 4 -49.013 -51.999 -52.565 1.00 47.08 H new ATOM 0 HB3 GLU B 4 -48.527 -50.392 -52.062 1.00 47.08 H new ATOM 0 HG2 GLU B 4 -46.569 -51.777 -52.074 1.00 47.35 H new ATOM 0 HG3 GLU B 4 -46.959 -51.424 -50.403 1.00 47.35 H new ATOM 1288 N LYS B 5 -49.215 -49.845 -48.868 1.00 46.34 N ATOM 1289 CA LYS B 5 -49.290 -48.574 -48.171 1.00 45.89 C ATOM 1290 C LYS B 5 -48.518 -47.497 -48.927 1.00 45.32 C ATOM 1291 O LYS B 5 -49.027 -46.396 -49.143 1.00 45.40 O ATOM 1292 CB LYS B 5 -48.746 -48.719 -46.748 1.00 46.20 C ATOM 1293 CG LYS B 5 -49.813 -49.064 -45.720 1.00 46.45 C ATOM 1294 CD LYS B 5 -49.434 -50.290 -44.902 1.00 47.12 C ATOM 1295 CE LYS B 5 -49.838 -50.133 -43.444 1.00 47.36 C ATOM 1296 NZ LYS B 5 -50.396 -51.393 -42.877 1.00 47.29 N ATOM 0 H LYS B 5 -48.629 -50.541 -48.408 1.00 46.34 H new ATOM 0 HA LYS B 5 -50.336 -48.271 -48.118 1.00 45.89 H new ATOM 0 HB2 LYS B 5 -47.980 -49.494 -46.738 1.00 46.20 H new ATOM 0 HB3 LYS B 5 -48.261 -47.787 -46.457 1.00 46.20 H new ATOM 0 HG2 LYS B 5 -49.964 -48.215 -45.054 1.00 46.45 H new ATOM 0 HG3 LYS B 5 -50.761 -49.244 -46.227 1.00 46.45 H new ATOM 0 HD2 LYS B 5 -49.917 -51.172 -45.322 1.00 47.12 H new ATOM 0 HD3 LYS B 5 -48.358 -50.454 -44.967 1.00 47.12 H new ATOM 0 HE2 LYS B 5 -48.971 -49.826 -42.859 1.00 47.36 H new ATOM 0 HE3 LYS B 5 -50.579 -49.338 -43.357 1.00 47.36 H new ATOM 0 HZ1 LYS B 5 -50.658 -51.240 -41.882 1.00 47.29 H new ATOM 0 HZ2 LYS B 5 -51.239 -51.673 -43.418 1.00 47.29 H new ATOM 0 HZ3 LYS B 5 -49.681 -52.146 -42.935 1.00 47.29 H new ATOM 1310 N ALA B 6 -47.290 -47.832 -49.328 1.00 44.78 N ATOM 1311 CA ALA B 6 -46.420 -46.909 -50.052 1.00 44.24 C ATOM 1312 C ALA B 6 -46.226 -45.623 -49.258 1.00 43.74 C ATOM 1313 O ALA B 6 -46.424 -44.518 -49.768 1.00 43.85 O ATOM 1314 CB ALA B 6 -46.976 -46.619 -51.439 1.00 44.52 C ATOM 0 H ALA B 6 -46.874 -48.748 -49.160 1.00 44.78 H new ATOM 0 HA ALA B 6 -45.445 -47.380 -50.176 1.00 44.24 H new ATOM 0 HB1 ALA B 6 -46.312 -45.929 -51.960 1.00 44.52 H new ATOM 0 HB2 ALA B 6 -47.049 -47.549 -52.003 1.00 44.52 H new ATOM 0 HB3 ALA B 6 -47.965 -46.171 -51.348 1.00 44.52 H new ATOM 1320 N HIS B 7 -45.857 -45.781 -47.999 1.00 43.26 N ATOM 1321 CA HIS B 7 -45.669 -44.647 -47.118 1.00 42.80 C ATOM 1322 C HIS B 7 -44.199 -44.272 -47.034 1.00 42.47 C ATOM 1323 O HIS B 7 -43.347 -45.103 -46.713 1.00 42.04 O ATOM 1324 CB HIS B 7 -46.223 -44.951 -45.725 1.00 42.48 C ATOM 1325 CG HIS B 7 -47.632 -44.483 -45.536 1.00 42.63 C ATOM 1326 ND1 HIS B 7 -48.473 -44.989 -44.568 1.00 42.29 N ATOM 1327 CD2 HIS B 7 -48.354 -43.554 -46.205 1.00 43.14 C ATOM 1328 CE1 HIS B 7 -49.647 -44.393 -44.651 1.00 42.58 C ATOM 1329 NE2 HIS B 7 -49.601 -43.518 -45.636 1.00 43.10 N ATOM 0 H HIS B 7 -45.682 -46.687 -47.565 1.00 43.26 H new ATOM 0 HA HIS B 7 -46.217 -43.800 -47.530 1.00 42.80 H new ATOM 0 HB2 HIS B 7 -46.177 -46.026 -45.549 1.00 42.48 H new ATOM 0 HB3 HIS B 7 -45.587 -44.479 -44.977 1.00 42.48 H new ATOM 0 HD2 HIS B 7 -48.011 -42.952 -47.034 1.00 43.14 H new ATOM 0 HE1 HIS B 7 -50.501 -44.589 -44.019 1.00 42.58 H new ATOM 0 HE2 HIS B 7 -50.368 -42.913 -45.927 1.00 43.10 H new ATOM 1338 N THR B 8 -43.910 -43.022 -47.345 1.00 42.72 N ATOM 1339 CA THR B 8 -42.552 -42.513 -47.309 1.00 42.49 C ATOM 1340 C THR B 8 -42.523 -41.203 -46.533 1.00 42.09 C ATOM 1341 O THR B 8 -41.731 -40.303 -46.816 1.00 42.17 O ATOM 1342 CB THR B 8 -42.000 -42.293 -48.734 1.00 43.02 C ATOM 1343 OG1 THR B 8 -42.760 -43.065 -49.683 1.00 43.54 O ATOM 1344 CG2 THR B 8 -40.535 -42.691 -48.816 1.00 43.04 C ATOM 0 H THR B 8 -44.607 -42.333 -47.629 1.00 42.72 H new ATOM 0 HA THR B 8 -41.920 -43.250 -46.814 1.00 42.49 H new ATOM 0 HB THR B 8 -42.088 -41.233 -48.971 1.00 43.02 H new ATOM 0 HG1 THR B 8 -42.404 -42.918 -50.584 1.00 43.54 H new ATOM 0 HG21 THR B 8 -40.170 -42.527 -49.830 1.00 43.04 H new ATOM 0 HG22 THR B 8 -39.954 -42.087 -48.119 1.00 43.04 H new ATOM 0 HG23 THR B 8 -40.429 -43.745 -48.559 1.00 43.04 H new ATOM 1352 N SER B 9 -43.424 -41.098 -45.567 1.00 41.72 N ATOM 1353 CA SER B 9 -43.558 -39.907 -44.750 1.00 41.37 C ATOM 1354 C SER B 9 -42.539 -39.906 -43.615 1.00 40.97 C ATOM 1355 O SER B 9 -42.896 -39.884 -42.437 1.00 40.81 O ATOM 1356 CB SER B 9 -44.978 -39.839 -44.193 1.00 41.56 C ATOM 1357 OG SER B 9 -45.824 -40.763 -44.856 1.00 41.99 O ATOM 0 H SER B 9 -44.083 -41.840 -45.329 1.00 41.72 H new ATOM 0 HA SER B 9 -43.366 -39.029 -45.367 1.00 41.37 H new ATOM 0 HB2 SER B 9 -44.965 -40.053 -43.124 1.00 41.56 H new ATOM 0 HB3 SER B 9 -45.372 -38.829 -44.311 1.00 41.56 H new ATOM 0 HG SER B 9 -46.728 -40.704 -44.483 1.00 41.99 H new ATOM 1363 N VAL B 10 -41.268 -39.918 -43.983 1.00 40.88 N ATOM 1364 CA VAL B 10 -40.190 -39.895 -43.007 1.00 40.57 C ATOM 1365 C VAL B 10 -39.483 -38.548 -43.034 1.00 39.78 C ATOM 1366 O VAL B 10 -39.128 -38.046 -44.103 1.00 39.60 O ATOM 1367 CB VAL B 10 -39.158 -41.018 -43.254 1.00 41.04 C ATOM 1368 CG1 VAL B 10 -39.549 -42.276 -42.496 1.00 41.05 C ATOM 1369 CG2 VAL B 10 -39.007 -41.310 -44.743 1.00 41.81 C ATOM 0 H VAL B 10 -40.957 -39.944 -44.954 1.00 40.88 H new ATOM 0 HA VAL B 10 -40.641 -40.059 -42.029 1.00 40.57 H new ATOM 0 HB VAL B 10 -38.192 -40.676 -42.882 1.00 41.04 H new ATOM 0 HG11 VAL B 10 -38.811 -43.057 -42.681 1.00 41.05 H new ATOM 0 HG12 VAL B 10 -39.588 -42.060 -41.428 1.00 41.05 H new ATOM 0 HG13 VAL B 10 -40.528 -42.615 -42.834 1.00 41.05 H new ATOM 0 HG21 VAL B 10 -38.274 -42.104 -44.886 1.00 41.81 H new ATOM 0 HG22 VAL B 10 -39.967 -41.625 -45.151 1.00 41.81 H new ATOM 0 HG23 VAL B 10 -38.671 -40.410 -45.258 1.00 41.81 H new ATOM 1379 N LYS B 11 -39.314 -37.952 -41.865 1.00 39.37 N ATOM 1380 CA LYS B 11 -38.665 -36.654 -41.760 1.00 38.66 C ATOM 1381 C LYS B 11 -37.183 -36.770 -42.082 1.00 37.92 C ATOM 1382 O LYS B 11 -36.660 -36.007 -42.899 1.00 37.86 O ATOM 1383 CB LYS B 11 -38.849 -36.076 -40.357 1.00 38.51 C ATOM 1384 CG LYS B 11 -39.861 -34.944 -40.297 1.00 38.70 C ATOM 1385 CD LYS B 11 -41.286 -35.465 -40.330 1.00 39.11 C ATOM 1386 CE LYS B 11 -42.286 -34.332 -40.503 1.00 39.26 C ATOM 1387 NZ LYS B 11 -43.668 -34.837 -40.711 1.00 39.34 N ATOM 0 H LYS B 11 -39.617 -38.346 -40.974 1.00 39.37 H new ATOM 0 HA LYS B 11 -39.129 -35.982 -42.482 1.00 38.66 H new ATOM 0 HB2 LYS B 11 -39.165 -36.872 -39.683 1.00 38.51 H new ATOM 0 HB3 LYS B 11 -37.888 -35.713 -39.993 1.00 38.51 H new ATOM 0 HG2 LYS B 11 -39.706 -34.365 -39.387 1.00 38.70 H new ATOM 0 HG3 LYS B 11 -39.701 -34.267 -41.137 1.00 38.70 H new ATOM 0 HD2 LYS B 11 -41.396 -36.178 -41.147 1.00 39.11 H new ATOM 0 HD3 LYS B 11 -41.500 -36.004 -39.407 1.00 39.11 H new ATOM 0 HE2 LYS B 11 -42.263 -33.690 -39.622 1.00 39.26 H new ATOM 0 HE3 LYS B 11 -41.993 -33.716 -41.353 1.00 39.26 H new ATOM 0 HZ1 LYS B 11 -44.318 -34.033 -40.824 1.00 39.34 H new ATOM 0 HZ2 LYS B 11 -43.696 -35.429 -41.566 1.00 39.34 H new ATOM 0 HZ3 LYS B 11 -43.958 -35.403 -39.888 1.00 39.34 H new ATOM 1401 N LYS B 12 -36.543 -37.778 -41.490 1.00 37.43 N ATOM 1402 CA LYS B 12 -35.132 -38.078 -41.728 1.00 36.75 C ATOM 1403 C LYS B 12 -34.270 -36.824 -41.644 1.00 36.06 C ATOM 1404 O LYS B 12 -33.430 -36.567 -42.510 1.00 35.87 O ATOM 1405 CB LYS B 12 -34.969 -38.752 -43.088 1.00 36.61 C ATOM 1406 CG LYS B 12 -35.312 -40.231 -43.077 1.00 36.83 C ATOM 1407 CD LYS B 12 -34.118 -41.090 -43.462 1.00 36.79 C ATOM 1408 CE LYS B 12 -34.204 -42.467 -42.831 1.00 36.93 C ATOM 1409 NZ LYS B 12 -33.053 -43.327 -43.209 1.00 36.94 N ATOM 0 H LYS B 12 -36.991 -38.412 -40.829 1.00 37.43 H new ATOM 0 HA LYS B 12 -34.792 -38.759 -40.947 1.00 36.75 H new ATOM 0 HB2 LYS B 12 -35.605 -38.245 -43.814 1.00 36.61 H new ATOM 0 HB3 LYS B 12 -33.940 -38.629 -43.425 1.00 36.61 H new ATOM 0 HG2 LYS B 12 -35.660 -40.516 -42.084 1.00 36.83 H new ATOM 0 HG3 LYS B 12 -36.133 -40.419 -43.769 1.00 36.83 H new ATOM 0 HD2 LYS B 12 -34.071 -41.187 -44.547 1.00 36.79 H new ATOM 0 HD3 LYS B 12 -33.197 -40.600 -43.146 1.00 36.79 H new ATOM 0 HE2 LYS B 12 -34.240 -42.367 -41.746 1.00 36.93 H new ATOM 0 HE3 LYS B 12 -35.132 -42.949 -43.138 1.00 36.93 H new ATOM 0 HZ1 LYS B 12 -33.152 -44.258 -42.756 1.00 36.94 H new ATOM 0 HZ2 LYS B 12 -33.032 -43.445 -44.242 1.00 36.94 H new ATOM 0 HZ3 LYS B 12 -32.168 -42.881 -42.894 1.00 36.94 H new ATOM 1423 N MET B 13 -34.481 -36.054 -40.589 1.00 35.73 N ATOM 1424 CA MET B 13 -33.731 -34.828 -40.369 1.00 35.11 C ATOM 1425 C MET B 13 -32.990 -34.908 -39.043 1.00 34.05 C ATOM 1426 O MET B 13 -32.981 -33.962 -38.257 1.00 33.69 O ATOM 1427 CB MET B 13 -34.671 -33.620 -40.388 1.00 35.48 C ATOM 1428 CG MET B 13 -34.035 -32.358 -40.956 1.00 35.31 C ATOM 1429 SD MET B 13 -33.244 -32.627 -42.561 1.00 35.65 S ATOM 1430 CE MET B 13 -34.659 -33.069 -43.562 1.00 35.62 C ATOM 0 H MET B 13 -35.171 -36.259 -39.866 1.00 35.73 H new ATOM 0 HA MET B 13 -33.003 -34.707 -41.171 1.00 35.11 H new ATOM 0 HB2 MET B 13 -35.554 -33.868 -40.977 1.00 35.48 H new ATOM 0 HB3 MET B 13 -35.011 -33.419 -39.372 1.00 35.48 H new ATOM 0 HG2 MET B 13 -34.799 -31.587 -41.058 1.00 35.31 H new ATOM 0 HG3 MET B 13 -33.294 -31.982 -40.250 1.00 35.31 H new ATOM 0 HE1 MET B 13 -34.360 -33.127 -44.609 1.00 35.62 H new ATOM 0 HE2 MET B 13 -35.044 -34.037 -43.240 1.00 35.62 H new ATOM 0 HE3 MET B 13 -35.436 -32.313 -43.448 1.00 35.62 H new ATOM 1440 N THR B 14 -32.404 -36.067 -38.793 1.00 33.61 N ATOM 1441 CA THR B 14 -31.678 -36.321 -37.561 1.00 32.62 C ATOM 1442 C THR B 14 -30.328 -35.612 -37.559 1.00 31.94 C ATOM 1443 O THR B 14 -29.608 -35.620 -38.559 1.00 32.15 O ATOM 1444 CB THR B 14 -31.458 -37.827 -37.374 1.00 32.54 C ATOM 1445 OG1 THR B 14 -31.770 -38.516 -38.596 1.00 33.35 O ATOM 1446 CG2 THR B 14 -32.325 -38.367 -36.248 1.00 32.48 C ATOM 0 H THR B 14 -32.418 -36.857 -39.438 1.00 33.61 H new ATOM 0 HA THR B 14 -32.278 -35.933 -36.738 1.00 32.62 H new ATOM 0 HB THR B 14 -30.413 -37.993 -37.114 1.00 32.54 H new ATOM 0 HG1 THR B 14 -31.627 -39.478 -38.475 1.00 33.35 H new ATOM 0 HG21 THR B 14 -32.150 -39.437 -36.136 1.00 32.48 H new ATOM 0 HG22 THR B 14 -32.072 -37.858 -35.318 1.00 32.48 H new ATOM 0 HG23 THR B 14 -33.375 -38.193 -36.482 1.00 32.48 H new ATOM 1454 N PHE B 15 -29.993 -35.007 -36.431 1.00 31.19 N ATOM 1455 CA PHE B 15 -28.721 -34.320 -36.271 1.00 30.54 C ATOM 1456 C PHE B 15 -28.133 -34.622 -34.897 1.00 29.77 C ATOM 1457 O PHE B 15 -26.918 -34.777 -34.750 1.00 29.39 O ATOM 1458 CB PHE B 15 -28.884 -32.804 -36.473 1.00 30.31 C ATOM 1459 CG PHE B 15 -29.932 -32.165 -35.602 1.00 30.09 C ATOM 1460 CD1 PHE B 15 -31.268 -32.203 -35.966 1.00 30.43 C ATOM 1461 CD2 PHE B 15 -29.583 -31.537 -34.416 1.00 29.61 C ATOM 1462 CE1 PHE B 15 -32.234 -31.623 -35.169 1.00 30.32 C ATOM 1463 CE2 PHE B 15 -30.546 -30.957 -33.614 1.00 29.47 C ATOM 1464 CZ PHE B 15 -31.859 -30.970 -33.994 1.00 29.84 C ATOM 0 H PHE B 15 -30.591 -34.978 -35.605 1.00 31.19 H new ATOM 0 HA PHE B 15 -28.033 -34.685 -37.034 1.00 30.54 H new ATOM 0 HB2 PHE B 15 -27.926 -32.320 -36.281 1.00 30.31 H new ATOM 0 HB3 PHE B 15 -29.133 -32.615 -37.517 1.00 30.31 H new ATOM 0 HD1 PHE B 15 -31.557 -32.692 -36.884 1.00 30.43 H new ATOM 0 HD2 PHE B 15 -28.546 -31.501 -34.116 1.00 29.61 H new ATOM 0 HE1 PHE B 15 -33.275 -31.674 -35.453 1.00 30.32 H new ATOM 0 HE2 PHE B 15 -30.261 -30.491 -32.682 1.00 29.47 H new ATOM 0 HZ PHE B 15 -32.604 -30.477 -33.387 1.00 29.84 H new ATOM 1474 N GLY B 16 -29.007 -34.796 -33.914 1.00 29.61 N ATOM 1475 CA GLY B 16 -28.569 -35.145 -32.580 1.00 28.95 C ATOM 1476 C GLY B 16 -28.164 -33.932 -31.770 1.00 28.38 C ATOM 1477 O GLY B 16 -27.527 -33.016 -32.289 1.00 27.86 O ATOM 0 H GLY B 16 -30.017 -34.701 -34.020 1.00 29.61 H new ATOM 0 HA2 GLY B 16 -29.371 -35.672 -32.063 1.00 28.95 H new ATOM 0 HA3 GLY B 16 -27.726 -35.833 -32.646 1.00 28.95 H new ATOM 1481 N GLU B 17 -28.491 -33.944 -30.488 1.00 28.54 N ATOM 1482 CA GLU B 17 -28.114 -32.857 -29.596 1.00 28.12 C ATOM 1483 C GLU B 17 -26.918 -33.267 -28.749 1.00 27.58 C ATOM 1484 O GLU B 17 -26.938 -33.167 -27.521 1.00 27.25 O ATOM 1485 CB GLU B 17 -29.291 -32.470 -28.699 1.00 28.76 C ATOM 1486 CG GLU B 17 -29.770 -31.042 -28.902 1.00 28.83 C ATOM 1487 CD GLU B 17 -28.883 -30.023 -28.218 1.00 28.83 C ATOM 1488 OE1 GLU B 17 -27.654 -30.054 -28.437 1.00 28.71 O ATOM 1489 OE2 GLU B 17 -29.407 -29.177 -27.464 1.00 29.03 O ATOM 0 H GLU B 17 -29.017 -34.695 -30.040 1.00 28.54 H new ATOM 0 HA GLU B 17 -27.839 -31.991 -30.198 1.00 28.12 H new ATOM 0 HB2 GLU B 17 -30.120 -33.152 -28.888 1.00 28.76 H new ATOM 0 HB3 GLU B 17 -29.001 -32.602 -27.657 1.00 28.76 H new ATOM 0 HG2 GLU B 17 -29.809 -30.825 -29.969 1.00 28.83 H new ATOM 0 HG3 GLU B 17 -30.786 -30.947 -28.520 1.00 28.83 H new ATOM 1496 N ASN B 18 -25.890 -33.765 -29.419 1.00 27.58 N ATOM 1497 CA ASN B 18 -24.686 -34.232 -28.745 1.00 27.16 C ATOM 1498 C ASN B 18 -23.904 -33.068 -28.162 1.00 26.33 C ATOM 1499 O ASN B 18 -23.468 -33.125 -27.012 1.00 26.18 O ATOM 1500 CB ASN B 18 -23.797 -35.014 -29.714 1.00 27.37 C ATOM 1501 CG ASN B 18 -23.193 -36.248 -29.072 1.00 27.17 C ATOM 1502 OD1 ASN B 18 -22.193 -36.170 -28.363 1.00 26.74 O ATOM 1503 ND2 ASN B 18 -23.795 -37.395 -29.327 1.00 27.56 N ATOM 0 H ASN B 18 -25.865 -33.857 -30.435 1.00 27.58 H new ATOM 0 HA ASN B 18 -24.994 -34.890 -27.932 1.00 27.16 H new ATOM 0 HB2 ASN B 18 -24.384 -35.310 -30.584 1.00 27.37 H new ATOM 0 HB3 ASN B 18 -22.998 -34.366 -30.074 1.00 27.37 H new ATOM 0 HD21 ASN B 18 -23.431 -38.261 -28.930 1.00 27.56 H new ATOM 0 HD22 ASN B 18 -24.624 -37.415 -29.921 1.00 27.56 H new ATOM 1510 N ARG B 19 -23.730 -32.016 -28.964 1.00 25.86 N ATOM 1511 CA ARG B 19 -22.982 -30.829 -28.549 1.00 25.09 C ATOM 1512 C ARG B 19 -21.589 -31.220 -28.065 1.00 24.28 C ATOM 1513 O ARG B 19 -21.171 -30.857 -26.965 1.00 23.72 O ATOM 1514 CB ARG B 19 -23.736 -30.077 -27.449 1.00 24.95 C ATOM 1515 CG ARG B 19 -23.637 -28.564 -27.559 1.00 25.02 C ATOM 1516 CD ARG B 19 -24.679 -28.006 -28.516 1.00 25.65 C ATOM 1517 NE ARG B 19 -26.025 -28.026 -27.941 1.00 25.93 N ATOM 1518 CZ ARG B 19 -26.519 -27.082 -27.140 1.00 26.41 C ATOM 1519 NH1 ARG B 19 -25.795 -26.008 -26.841 1.00 26.67 N ATOM 1520 NH2 ARG B 19 -27.747 -27.206 -26.654 1.00 26.71 N ATOM 0 H ARG B 19 -24.101 -31.963 -29.913 1.00 25.86 H new ATOM 0 HA ARG B 19 -22.878 -30.169 -29.410 1.00 25.09 H new ATOM 0 HB2 ARG B 19 -24.787 -30.366 -27.479 1.00 24.95 H new ATOM 0 HB3 ARG B 19 -23.348 -30.387 -26.479 1.00 24.95 H new ATOM 0 HG2 ARG B 19 -23.770 -28.117 -26.574 1.00 25.02 H new ATOM 0 HG3 ARG B 19 -22.640 -28.287 -27.903 1.00 25.02 H new ATOM 0 HD2 ARG B 19 -24.415 -26.983 -28.782 1.00 25.65 H new ATOM 0 HD3 ARG B 19 -24.671 -28.587 -29.438 1.00 25.65 H new ATOM 0 HE ARG B 19 -26.627 -28.817 -28.169 1.00 25.93 H new ATOM 0 HH11 ARG B 19 -24.856 -25.903 -27.225 1.00 26.67 H new ATOM 0 HH12 ARG B 19 -26.179 -25.289 -26.227 1.00 26.67 H new ATOM 0 HH21 ARG B 19 -28.310 -28.022 -26.893 1.00 26.71 H new ATOM 0 HH22 ARG B 19 -28.128 -26.485 -26.041 1.00 26.71 H new ATOM 1534 N ASP B 20 -20.909 -32.032 -28.865 1.00 24.30 N ATOM 1535 CA ASP B 20 -19.597 -32.557 -28.506 1.00 23.61 C ATOM 1536 C ASP B 20 -18.512 -31.503 -28.700 1.00 22.79 C ATOM 1537 O ASP B 20 -17.662 -31.617 -29.582 1.00 22.56 O ATOM 1538 CB ASP B 20 -19.285 -33.804 -29.342 1.00 24.06 C ATOM 1539 CG ASP B 20 -17.964 -34.451 -28.972 1.00 23.62 C ATOM 1540 OD1 ASP B 20 -17.756 -34.755 -27.777 1.00 23.48 O ATOM 1541 OD2 ASP B 20 -17.126 -34.662 -29.876 1.00 23.49 O ATOM 0 H ASP B 20 -21.248 -32.344 -29.775 1.00 24.30 H new ATOM 0 HA ASP B 20 -19.614 -32.830 -27.451 1.00 23.61 H new ATOM 0 HB2 ASP B 20 -20.087 -34.531 -29.214 1.00 24.06 H new ATOM 0 HB3 ASP B 20 -19.267 -33.532 -30.397 1.00 24.06 H new ATOM 1546 N LEU B 21 -18.557 -30.466 -27.884 1.00 22.46 N ATOM 1547 CA LEU B 21 -17.579 -29.396 -27.963 1.00 21.76 C ATOM 1548 C LEU B 21 -17.073 -29.030 -26.576 1.00 20.84 C ATOM 1549 O LEU B 21 -17.294 -27.915 -26.094 1.00 20.32 O ATOM 1550 CB LEU B 21 -18.182 -28.168 -28.647 1.00 21.92 C ATOM 1551 CG LEU B 21 -17.230 -27.418 -29.582 1.00 22.37 C ATOM 1552 CD1 LEU B 21 -17.578 -27.699 -31.035 1.00 22.89 C ATOM 1553 CD2 LEU B 21 -17.278 -25.925 -29.304 1.00 22.42 C ATOM 0 H LEU B 21 -19.262 -30.342 -27.157 1.00 22.46 H new ATOM 0 HA LEU B 21 -16.736 -29.747 -28.558 1.00 21.76 H new ATOM 0 HB2 LEU B 21 -19.057 -28.481 -29.217 1.00 21.92 H new ATOM 0 HB3 LEU B 21 -18.532 -27.478 -27.879 1.00 21.92 H new ATOM 0 HG LEU B 21 -16.216 -27.772 -29.396 1.00 22.37 H new ATOM 0 HD11 LEU B 21 -16.891 -27.157 -31.685 1.00 22.89 H new ATOM 0 HD12 LEU B 21 -17.494 -28.768 -31.229 1.00 22.89 H new ATOM 0 HD13 LEU B 21 -18.599 -27.373 -31.234 1.00 22.89 H new ATOM 0 HD21 LEU B 21 -16.595 -25.407 -29.978 1.00 22.42 H new ATOM 0 HD22 LEU B 21 -18.292 -25.558 -29.462 1.00 22.42 H new ATOM 0 HD23 LEU B 21 -16.981 -25.737 -28.272 1.00 22.42 H new ATOM 1565 N GLU B 22 -16.369 -29.965 -25.949 1.00 20.72 N ATOM 1566 CA GLU B 22 -15.794 -29.735 -24.629 1.00 19.93 C ATOM 1567 C GLU B 22 -14.507 -28.928 -24.745 1.00 19.41 C ATOM 1568 O GLU B 22 -13.414 -29.438 -24.481 1.00 19.74 O ATOM 1569 CB GLU B 22 -15.503 -31.061 -23.927 1.00 20.20 C ATOM 1570 CG GLU B 22 -16.734 -31.910 -23.669 1.00 20.30 C ATOM 1571 CD GLU B 22 -16.380 -33.352 -23.379 1.00 19.89 C ATOM 1572 OE1 GLU B 22 -15.455 -33.591 -22.574 1.00 19.52 O ATOM 1573 OE2 GLU B 22 -17.032 -34.256 -23.946 1.00 20.02 O ATOM 0 H GLU B 22 -16.182 -30.891 -26.334 1.00 20.72 H new ATOM 0 HA GLU B 22 -16.519 -29.174 -24.039 1.00 19.93 H new ATOM 0 HB2 GLU B 22 -14.801 -31.634 -24.533 1.00 20.20 H new ATOM 0 HB3 GLU B 22 -15.011 -30.856 -22.976 1.00 20.20 H new ATOM 0 HG2 GLU B 22 -17.289 -31.497 -22.827 1.00 20.30 H new ATOM 0 HG3 GLU B 22 -17.392 -31.866 -24.537 1.00 20.30 H new ATOM 1580 N ARG B 23 -14.636 -27.678 -25.157 1.00 18.69 N ATOM 1581 CA ARG B 23 -13.483 -26.806 -25.323 1.00 18.19 C ATOM 1582 C ARG B 23 -13.091 -26.180 -23.991 1.00 17.33 C ATOM 1583 O ARG B 23 -13.080 -24.958 -23.842 1.00 17.06 O ATOM 1584 CB ARG B 23 -13.776 -25.718 -26.358 1.00 18.28 C ATOM 1585 CG ARG B 23 -12.640 -25.494 -27.344 1.00 18.65 C ATOM 1586 CD ARG B 23 -11.826 -24.258 -26.993 1.00 18.48 C ATOM 1587 NE ARG B 23 -10.457 -24.593 -26.605 1.00 18.13 N ATOM 1588 CZ ARG B 23 -9.403 -23.803 -26.812 1.00 17.91 C ATOM 1589 NH1 ARG B 23 -9.564 -22.609 -27.369 1.00 18.00 N ATOM 1590 NH2 ARG B 23 -8.192 -24.198 -26.446 1.00 17.74 N ATOM 0 H ARG B 23 -15.530 -27.242 -25.384 1.00 18.69 H new ATOM 0 HA ARG B 23 -12.648 -27.407 -25.682 1.00 18.19 H new ATOM 0 HB2 ARG B 23 -14.677 -25.986 -26.910 1.00 18.28 H new ATOM 0 HB3 ARG B 23 -13.986 -24.782 -25.840 1.00 18.28 H new ATOM 0 HG2 ARG B 23 -11.989 -26.368 -27.354 1.00 18.65 H new ATOM 0 HG3 ARG B 23 -13.047 -25.388 -28.350 1.00 18.65 H new ATOM 0 HD2 ARG B 23 -11.805 -23.583 -27.849 1.00 18.48 H new ATOM 0 HD3 ARG B 23 -12.313 -23.723 -26.177 1.00 18.48 H new ATOM 0 HE ARG B 23 -10.298 -25.490 -26.146 1.00 18.13 H new ATOM 0 HH11 ARG B 23 -10.496 -22.294 -27.640 1.00 18.00 H new ATOM 0 HH12 ARG B 23 -8.756 -22.006 -27.526 1.00 18.00 H new ATOM 0 HH21 ARG B 23 -8.064 -25.109 -26.005 1.00 17.74 H new ATOM 0 HH22 ARG B 23 -7.388 -23.591 -26.606 1.00 17.74 H new ATOM 1604 N VAL B 24 -12.752 -27.026 -23.032 1.00 17.00 N ATOM 1605 CA VAL B 24 -12.311 -26.567 -21.730 1.00 16.23 C ATOM 1606 C VAL B 24 -10.861 -26.103 -21.809 1.00 15.49 C ATOM 1607 O VAL B 24 -10.014 -26.774 -22.405 1.00 15.64 O ATOM 1608 CB VAL B 24 -12.467 -27.671 -20.652 1.00 16.53 C ATOM 1609 CG1 VAL B 24 -11.744 -28.946 -21.059 1.00 16.12 C ATOM 1610 CG2 VAL B 24 -11.972 -27.182 -19.298 1.00 17.37 C ATOM 0 H VAL B 24 -12.775 -28.041 -23.135 1.00 17.00 H new ATOM 0 HA VAL B 24 -12.943 -25.729 -21.435 1.00 16.23 H new ATOM 0 HB VAL B 24 -13.529 -27.901 -20.566 1.00 16.53 H new ATOM 0 HG11 VAL B 24 -11.872 -29.701 -20.283 1.00 16.12 H new ATOM 0 HG12 VAL B 24 -12.159 -29.316 -21.997 1.00 16.12 H new ATOM 0 HG13 VAL B 24 -10.682 -28.736 -21.189 1.00 16.12 H new ATOM 0 HG21 VAL B 24 -12.092 -27.974 -18.559 1.00 17.37 H new ATOM 0 HG22 VAL B 24 -10.919 -26.911 -19.372 1.00 17.37 H new ATOM 0 HG23 VAL B 24 -12.550 -26.310 -18.992 1.00 17.37 H new ATOM 1620 N VAL B 25 -10.605 -24.905 -21.318 1.00 14.81 N ATOM 1621 CA VAL B 25 -9.277 -24.320 -21.395 1.00 14.13 C ATOM 1622 C VAL B 25 -8.697 -24.140 -20.002 1.00 13.38 C ATOM 1623 O VAL B 25 -8.993 -23.157 -19.317 1.00 13.23 O ATOM 1624 CB VAL B 25 -9.280 -22.955 -22.123 1.00 14.18 C ATOM 1625 CG1 VAL B 25 -7.930 -22.695 -22.773 1.00 13.94 C ATOM 1626 CG2 VAL B 25 -10.390 -22.889 -23.163 1.00 14.46 C ATOM 0 H VAL B 25 -11.300 -24.316 -20.860 1.00 14.81 H new ATOM 0 HA VAL B 25 -8.661 -25.010 -21.971 1.00 14.13 H new ATOM 0 HB VAL B 25 -9.466 -22.179 -21.380 1.00 14.18 H new ATOM 0 HG11 VAL B 25 -7.950 -21.731 -23.281 1.00 13.94 H new ATOM 0 HG12 VAL B 25 -7.154 -22.686 -22.008 1.00 13.94 H new ATOM 0 HG13 VAL B 25 -7.717 -23.482 -23.497 1.00 13.94 H new ATOM 0 HG21 VAL B 25 -10.367 -21.918 -23.658 1.00 14.46 H new ATOM 0 HG22 VAL B 25 -10.244 -23.677 -23.902 1.00 14.46 H new ATOM 0 HG23 VAL B 25 -11.355 -23.025 -22.674 1.00 14.46 H new ATOM 1636 N THR B 26 -7.915 -25.115 -19.569 1.00 13.07 N ATOM 1637 CA THR B 26 -7.312 -25.078 -18.249 1.00 12.47 C ATOM 1638 C THR B 26 -6.172 -24.066 -18.201 1.00 11.78 C ATOM 1639 O THR B 26 -5.150 -24.239 -18.867 1.00 11.91 O ATOM 1640 CB THR B 26 -6.773 -26.465 -17.852 1.00 12.87 C ATOM 1641 OG1 THR B 26 -6.997 -27.395 -18.922 1.00 13.71 O ATOM 1642 CG2 THR B 26 -7.444 -26.971 -16.585 1.00 12.94 C ATOM 0 H THR B 26 -7.683 -25.944 -20.115 1.00 13.07 H new ATOM 0 HA THR B 26 -8.088 -24.779 -17.544 1.00 12.47 H new ATOM 0 HB THR B 26 -5.704 -26.375 -17.660 1.00 12.87 H new ATOM 0 HG1 THR B 26 -6.652 -28.276 -18.667 1.00 13.71 H new ATOM 0 HG21 THR B 26 -7.044 -27.952 -16.328 1.00 12.94 H new ATOM 0 HG22 THR B 26 -7.251 -26.275 -15.768 1.00 12.94 H new ATOM 0 HG23 THR B 26 -8.519 -27.049 -16.749 1.00 12.94 H new ATOM 1650 N ALA B 27 -6.351 -23.018 -17.410 1.00 11.17 N ATOM 1651 CA ALA B 27 -5.325 -21.997 -17.248 1.00 10.52 C ATOM 1652 C ALA B 27 -4.217 -22.508 -16.332 1.00 9.95 C ATOM 1653 O ALA B 27 -4.473 -23.308 -15.429 1.00 9.71 O ATOM 1654 CB ALA B 27 -5.931 -20.719 -16.690 1.00 10.28 C ATOM 0 H ALA B 27 -7.199 -22.852 -16.869 1.00 11.17 H new ATOM 0 HA ALA B 27 -4.895 -21.774 -18.225 1.00 10.52 H new ATOM 0 HB1 ALA B 27 -5.151 -19.966 -16.575 1.00 10.28 H new ATOM 0 HB2 ALA B 27 -6.694 -20.349 -17.375 1.00 10.28 H new ATOM 0 HB3 ALA B 27 -6.383 -20.924 -15.720 1.00 10.28 H new ATOM 1660 N PRO B 28 -2.963 -22.109 -16.583 1.00 9.96 N ATOM 1661 CA PRO B 28 -1.818 -22.548 -15.779 1.00 9.63 C ATOM 1662 C PRO B 28 -1.967 -22.139 -14.319 1.00 8.60 C ATOM 1663 O PRO B 28 -2.335 -21.002 -14.019 1.00 8.30 O ATOM 1664 CB PRO B 28 -0.622 -21.829 -16.415 1.00 10.21 C ATOM 1665 CG PRO B 28 -1.077 -21.456 -17.784 1.00 10.68 C ATOM 1666 CD PRO B 28 -2.555 -21.212 -17.674 1.00 10.54 C ATOM 0 HA PRO B 28 -1.715 -23.633 -15.774 1.00 9.63 H new ATOM 0 HB2 PRO B 28 -0.340 -20.947 -15.839 1.00 10.21 H new ATOM 0 HB3 PRO B 28 0.253 -22.478 -16.453 1.00 10.21 H new ATOM 0 HG2 PRO B 28 -0.559 -20.565 -18.138 1.00 10.68 H new ATOM 0 HG3 PRO B 28 -0.865 -22.253 -18.497 1.00 10.68 H new ATOM 0 HD2 PRO B 28 -2.775 -20.170 -17.442 1.00 10.54 H new ATOM 0 HD3 PRO B 28 -3.072 -21.448 -18.604 1.00 10.54 H new ATOM 1674 N VAL B 29 -1.722 -23.080 -13.417 1.00 8.25 N ATOM 1675 CA VAL B 29 -1.839 -22.815 -11.990 1.00 7.38 C ATOM 1676 C VAL B 29 -0.622 -22.039 -11.497 1.00 6.86 C ATOM 1677 O VAL B 29 0.329 -22.620 -10.965 1.00 6.83 O ATOM 1678 CB VAL B 29 -1.979 -24.123 -11.179 1.00 7.36 C ATOM 1679 CG1 VAL B 29 -2.452 -23.831 -9.763 1.00 7.30 C ATOM 1680 CG2 VAL B 29 -2.929 -25.087 -11.871 1.00 8.00 C ATOM 0 H VAL B 29 -1.441 -24.033 -13.648 1.00 8.25 H new ATOM 0 HA VAL B 29 -2.740 -22.221 -11.839 1.00 7.38 H new ATOM 0 HB VAL B 29 -0.997 -24.593 -11.122 1.00 7.36 H new ATOM 0 HG11 VAL B 29 -2.544 -24.766 -9.210 1.00 7.30 H new ATOM 0 HG12 VAL B 29 -1.730 -23.184 -9.265 1.00 7.30 H new ATOM 0 HG13 VAL B 29 -3.421 -23.334 -9.798 1.00 7.30 H new ATOM 0 HG21 VAL B 29 -3.012 -26.001 -11.283 1.00 8.00 H new ATOM 0 HG22 VAL B 29 -3.912 -24.625 -11.965 1.00 8.00 H new ATOM 0 HG23 VAL B 29 -2.545 -25.328 -12.862 1.00 8.00 H new ATOM 1690 N SER B 30 -0.616 -20.742 -11.773 1.00 6.76 N ATOM 1691 CA SER B 30 0.509 -19.888 -11.438 1.00 6.54 C ATOM 1692 C SER B 30 0.690 -19.784 -9.930 1.00 5.55 C ATOM 1693 O SER B 30 -0.251 -19.481 -9.194 1.00 5.55 O ATOM 1694 CB SER B 30 0.297 -18.497 -12.039 1.00 7.31 C ATOM 1695 OG SER B 30 -0.952 -18.423 -12.708 1.00 8.13 O ATOM 0 H SER B 30 -1.387 -20.257 -12.233 1.00 6.76 H new ATOM 0 HA SER B 30 1.413 -20.331 -11.856 1.00 6.54 H new ATOM 0 HB2 SER B 30 0.338 -17.745 -11.251 1.00 7.31 H new ATOM 0 HB3 SER B 30 1.103 -18.271 -12.737 1.00 7.31 H new ATOM 0 HG SER B 30 -1.069 -17.526 -13.084 1.00 8.13 H new ATOM 1701 N SER B 31 1.901 -20.050 -9.476 1.00 5.05 N ATOM 1702 CA SER B 31 2.228 -19.969 -8.066 1.00 4.38 C ATOM 1703 C SER B 31 2.518 -18.521 -7.674 1.00 3.76 C ATOM 1704 O SER B 31 2.682 -17.655 -8.539 1.00 4.12 O ATOM 1705 CB SER B 31 3.439 -20.856 -7.777 1.00 4.89 C ATOM 1706 OG SER B 31 3.662 -21.763 -8.850 1.00 5.76 O ATOM 0 H SER B 31 2.681 -20.327 -10.072 1.00 5.05 H new ATOM 0 HA SER B 31 1.381 -20.318 -7.476 1.00 4.38 H new ATOM 0 HB2 SER B 31 4.323 -20.236 -7.628 1.00 4.89 H new ATOM 0 HB3 SER B 31 3.278 -21.410 -6.852 1.00 4.89 H new ATOM 0 HG SER B 31 4.442 -22.322 -8.649 1.00 5.76 H new ATOM 1712 N GLY B 32 2.575 -18.261 -6.377 1.00 3.21 N ATOM 1713 CA GLY B 32 2.850 -16.923 -5.898 1.00 3.08 C ATOM 1714 C GLY B 32 4.218 -16.822 -5.261 1.00 2.11 C ATOM 1715 O GLY B 32 4.335 -16.622 -4.052 1.00 2.56 O ATOM 0 H GLY B 32 2.435 -18.957 -5.644 1.00 3.21 H new ATOM 0 HA2 GLY B 32 2.783 -16.219 -6.728 1.00 3.08 H new ATOM 0 HA3 GLY B 32 2.090 -16.634 -5.173 1.00 3.08 H new ATOM 1719 N LYS B 33 5.254 -16.941 -6.080 1.00 1.35 N ATOM 1720 CA LYS B 33 6.624 -16.841 -5.601 1.00 0.80 C ATOM 1721 C LYS B 33 7.037 -15.378 -5.492 1.00 0.59 C ATOM 1722 O LYS B 33 7.980 -15.032 -4.776 1.00 0.58 O ATOM 1723 CB LYS B 33 7.574 -17.596 -6.537 1.00 1.23 C ATOM 1724 CG LYS B 33 8.764 -18.223 -5.824 1.00 2.23 C ATOM 1725 CD LYS B 33 8.324 -19.192 -4.736 1.00 3.13 C ATOM 1726 CE LYS B 33 8.894 -18.804 -3.378 1.00 4.15 C ATOM 1727 NZ LYS B 33 8.994 -19.970 -2.457 1.00 4.99 N ATOM 0 H LYS B 33 5.170 -17.108 -7.083 1.00 1.35 H new ATOM 0 HA LYS B 33 6.682 -17.295 -4.612 1.00 0.80 H new ATOM 0 HB2 LYS B 33 7.017 -18.378 -7.052 1.00 1.23 H new ATOM 0 HB3 LYS B 33 7.940 -16.909 -7.301 1.00 1.23 H new ATOM 0 HG2 LYS B 33 9.387 -18.748 -6.548 1.00 2.23 H new ATOM 0 HG3 LYS B 33 9.379 -17.438 -5.385 1.00 2.23 H new ATOM 0 HD2 LYS B 33 7.235 -19.211 -4.683 1.00 3.13 H new ATOM 0 HD3 LYS B 33 8.648 -20.201 -4.993 1.00 3.13 H new ATOM 0 HE2 LYS B 33 9.882 -18.364 -3.513 1.00 4.15 H new ATOM 0 HE3 LYS B 33 8.263 -18.039 -2.926 1.00 4.15 H new ATOM 0 HZ1 LYS B 33 9.387 -19.660 -1.545 1.00 4.99 H new ATOM 0 HZ2 LYS B 33 8.048 -20.376 -2.307 1.00 4.99 H new ATOM 0 HZ3 LYS B 33 9.617 -20.690 -2.875 1.00 4.99 H new ATOM 1741 N ILE B 34 6.262 -14.518 -6.134 1.00 0.67 N ATOM 1742 CA ILE B 34 6.452 -13.082 -6.028 1.00 0.59 C ATOM 1743 C ILE B 34 5.152 -12.441 -5.571 1.00 0.57 C ATOM 1744 O ILE B 34 4.070 -12.951 -5.858 1.00 0.68 O ATOM 1745 CB ILE B 34 6.897 -12.438 -7.362 1.00 0.78 C ATOM 1746 CG1 ILE B 34 6.714 -13.411 -8.534 1.00 1.38 C ATOM 1747 CG2 ILE B 34 8.346 -11.977 -7.269 1.00 1.45 C ATOM 1748 CD1 ILE B 34 6.517 -12.724 -9.867 1.00 1.92 C ATOM 0 H ILE B 34 5.489 -14.794 -6.739 1.00 0.67 H new ATOM 0 HA ILE B 34 7.249 -12.910 -5.304 1.00 0.59 H new ATOM 0 HB ILE B 34 6.265 -11.569 -7.547 1.00 0.78 H new ATOM 0 HG12 ILE B 34 7.587 -14.061 -8.595 1.00 1.38 H new ATOM 0 HG13 ILE B 34 5.854 -14.050 -8.334 1.00 1.38 H new ATOM 0 HG21 ILE B 34 8.646 -11.526 -8.215 1.00 1.45 H new ATOM 0 HG22 ILE B 34 8.444 -11.242 -6.470 1.00 1.45 H new ATOM 0 HG23 ILE B 34 8.987 -12.832 -7.056 1.00 1.45 H new ATOM 0 HD11 ILE B 34 6.394 -13.474 -10.648 1.00 1.92 H new ATOM 0 HD12 ILE B 34 5.627 -12.096 -9.824 1.00 1.92 H new ATOM 0 HD13 ILE B 34 7.387 -12.107 -10.090 1.00 1.92 H new ATOM 1760 N LYS B 35 5.265 -11.384 -4.792 1.00 0.54 N ATOM 1761 CA LYS B 35 4.109 -10.717 -4.223 1.00 0.58 C ATOM 1762 C LYS B 35 3.930 -9.341 -4.847 1.00 0.59 C ATOM 1763 O LYS B 35 4.901 -8.722 -5.278 1.00 0.67 O ATOM 1764 CB LYS B 35 4.282 -10.593 -2.708 1.00 0.70 C ATOM 1765 CG LYS B 35 3.510 -11.640 -1.920 1.00 0.94 C ATOM 1766 CD LYS B 35 4.200 -12.994 -1.949 1.00 1.25 C ATOM 1767 CE LYS B 35 3.250 -14.087 -2.414 1.00 1.12 C ATOM 1768 NZ LYS B 35 2.877 -15.006 -1.307 1.00 1.30 N ATOM 0 H LYS B 35 6.158 -10.963 -4.535 1.00 0.54 H new ATOM 0 HA LYS B 35 3.218 -11.308 -4.434 1.00 0.58 H new ATOM 0 HB2 LYS B 35 5.341 -10.674 -2.464 1.00 0.70 H new ATOM 0 HB3 LYS B 35 3.957 -9.601 -2.393 1.00 0.70 H new ATOM 0 HG2 LYS B 35 3.402 -11.310 -0.887 1.00 0.94 H new ATOM 0 HG3 LYS B 35 2.505 -11.736 -2.331 1.00 0.94 H new ATOM 0 HD2 LYS B 35 5.062 -12.951 -2.614 1.00 1.25 H new ATOM 0 HD3 LYS B 35 4.576 -13.235 -0.955 1.00 1.25 H new ATOM 0 HE2 LYS B 35 2.350 -13.633 -2.828 1.00 1.12 H new ATOM 0 HE3 LYS B 35 3.718 -14.657 -3.217 1.00 1.12 H new ATOM 0 HZ1 LYS B 35 2.312 -15.793 -1.685 1.00 1.30 H new ATOM 0 HZ2 LYS B 35 3.739 -15.381 -0.862 1.00 1.30 H new ATOM 0 HZ3 LYS B 35 2.319 -14.488 -0.599 1.00 1.30 H new ATOM 1782 N ARG B 36 2.698 -8.865 -4.887 1.00 0.63 N ATOM 1783 CA ARG B 36 2.409 -7.564 -5.475 1.00 0.65 C ATOM 1784 C ARG B 36 2.163 -6.527 -4.388 1.00 0.63 C ATOM 1785 O ARG B 36 1.394 -6.756 -3.456 1.00 0.77 O ATOM 1786 CB ARG B 36 1.194 -7.653 -6.402 1.00 0.72 C ATOM 1787 CG ARG B 36 -0.020 -8.313 -5.767 1.00 1.52 C ATOM 1788 CD ARG B 36 -1.317 -7.724 -6.294 1.00 1.83 C ATOM 1789 NE ARG B 36 -1.578 -6.385 -5.767 1.00 2.61 N ATOM 1790 CZ ARG B 36 -1.656 -5.288 -6.522 1.00 3.31 C ATOM 1791 NH1 ARG B 36 -1.396 -5.348 -7.823 1.00 3.37 N ATOM 1792 NH2 ARG B 36 -1.969 -4.124 -5.972 1.00 4.33 N ATOM 0 H ARG B 36 1.882 -9.356 -4.521 1.00 0.63 H new ATOM 0 HA ARG B 36 3.275 -7.255 -6.061 1.00 0.65 H new ATOM 0 HB2 ARG B 36 0.921 -6.648 -6.725 1.00 0.72 H new ATOM 0 HB3 ARG B 36 1.472 -8.211 -7.296 1.00 0.72 H new ATOM 0 HG2 ARG B 36 0.001 -9.384 -5.967 1.00 1.52 H new ATOM 0 HG3 ARG B 36 0.023 -8.190 -4.685 1.00 1.52 H new ATOM 0 HD2 ARG B 36 -1.277 -7.681 -7.382 1.00 1.83 H new ATOM 0 HD3 ARG B 36 -2.145 -8.382 -6.031 1.00 1.83 H new ATOM 0 HE ARG B 36 -1.708 -6.284 -4.760 1.00 2.61 H new ATOM 0 HH11 ARG B 36 -1.135 -6.237 -8.250 1.00 3.37 H new ATOM 0 HH12 ARG B 36 -1.457 -4.506 -8.395 1.00 3.37 H new ATOM 0 HH21 ARG B 36 -2.151 -4.066 -4.970 1.00 4.33 H new ATOM 0 HH22 ARG B 36 -2.028 -3.286 -6.551 1.00 4.33 H new ATOM 1806 N VAL B 37 2.901 -5.432 -4.453 1.00 0.53 N ATOM 1807 CA VAL B 37 2.822 -4.398 -3.433 1.00 0.56 C ATOM 1808 C VAL B 37 2.445 -3.057 -4.047 1.00 0.49 C ATOM 1809 O VAL B 37 3.156 -2.539 -4.901 1.00 0.49 O ATOM 1810 CB VAL B 37 4.165 -4.231 -2.687 1.00 0.71 C ATOM 1811 CG1 VAL B 37 3.971 -3.451 -1.394 1.00 0.92 C ATOM 1812 CG2 VAL B 37 4.811 -5.584 -2.410 1.00 1.36 C ATOM 0 H VAL B 37 3.564 -5.235 -5.203 1.00 0.53 H new ATOM 0 HA VAL B 37 2.054 -4.714 -2.727 1.00 0.56 H new ATOM 0 HB VAL B 37 4.837 -3.664 -3.331 1.00 0.71 H new ATOM 0 HG11 VAL B 37 4.929 -3.346 -0.885 1.00 0.92 H new ATOM 0 HG12 VAL B 37 3.570 -2.463 -1.622 1.00 0.92 H new ATOM 0 HG13 VAL B 37 3.274 -3.985 -0.748 1.00 0.92 H new ATOM 0 HG21 VAL B 37 5.754 -5.436 -1.884 1.00 1.36 H new ATOM 0 HG22 VAL B 37 4.143 -6.187 -1.795 1.00 1.36 H new ATOM 0 HG23 VAL B 37 4.998 -6.098 -3.353 1.00 1.36 H new ATOM 1822 N ASN B 38 1.368 -2.465 -3.561 1.00 0.54 N ATOM 1823 CA ASN B 38 0.980 -1.131 -3.992 1.00 0.54 C ATOM 1824 C ASN B 38 1.320 -0.129 -2.897 1.00 0.52 C ATOM 1825 O ASN B 38 0.968 -0.329 -1.732 1.00 0.60 O ATOM 1826 CB ASN B 38 -0.518 -1.077 -4.323 1.00 0.66 C ATOM 1827 CG ASN B 38 -1.148 0.273 -4.004 1.00 0.92 C ATOM 1828 OD1 ASN B 38 -1.645 0.492 -2.900 1.00 1.67 O ATOM 1829 ND2 ASN B 38 -1.147 1.178 -4.972 1.00 1.37 N ATOM 0 H ASN B 38 0.747 -2.885 -2.869 1.00 0.54 H new ATOM 0 HA ASN B 38 1.530 -0.877 -4.898 1.00 0.54 H new ATOM 0 HB2 ASN B 38 -0.659 -1.297 -5.381 1.00 0.66 H new ATOM 0 HB3 ASN B 38 -1.037 -1.856 -3.764 1.00 0.66 H new ATOM 0 HD21 ASN B 38 -1.568 2.094 -4.815 1.00 1.37 H new ATOM 0 HD22 ASN B 38 -0.725 0.959 -5.874 1.00 1.37 H new ATOM 1836 N VAL B 39 2.084 0.892 -3.248 1.00 0.48 N ATOM 1837 CA VAL B 39 2.508 1.887 -2.274 1.00 0.49 C ATOM 1838 C VAL B 39 2.442 3.289 -2.858 1.00 0.46 C ATOM 1839 O VAL B 39 2.390 3.468 -4.079 1.00 0.48 O ATOM 1840 CB VAL B 39 3.939 1.633 -1.750 1.00 0.54 C ATOM 1841 CG1 VAL B 39 3.921 1.460 -0.240 1.00 0.77 C ATOM 1842 CG2 VAL B 39 4.576 0.426 -2.422 1.00 0.54 C ATOM 0 H VAL B 39 2.423 1.054 -4.196 1.00 0.48 H new ATOM 0 HA VAL B 39 1.815 1.800 -1.437 1.00 0.49 H new ATOM 0 HB VAL B 39 4.547 2.503 -1.999 1.00 0.54 H new ATOM 0 HG11 VAL B 39 4.935 1.282 0.118 1.00 0.77 H new ATOM 0 HG12 VAL B 39 3.526 2.363 0.225 1.00 0.77 H new ATOM 0 HG13 VAL B 39 3.289 0.611 0.021 1.00 0.77 H new ATOM 0 HG21 VAL B 39 5.582 0.279 -2.028 1.00 0.54 H new ATOM 0 HG22 VAL B 39 3.975 -0.461 -2.223 1.00 0.54 H new ATOM 0 HG23 VAL B 39 4.629 0.594 -3.498 1.00 0.54 H new ATOM 1852 N ASN B 40 2.452 4.277 -1.976 1.00 0.52 N ATOM 1853 CA ASN B 40 2.391 5.673 -2.379 1.00 0.57 C ATOM 1854 C ASN B 40 3.709 6.380 -2.076 1.00 0.56 C ATOM 1855 O ASN B 40 4.283 6.223 -0.995 1.00 0.72 O ATOM 1856 CB ASN B 40 1.229 6.385 -1.672 1.00 0.77 C ATOM 1857 CG ASN B 40 1.378 6.419 -0.157 1.00 1.47 C ATOM 1858 OD1 ASN B 40 1.923 7.370 0.407 1.00 2.28 O ATOM 1859 ND2 ASN B 40 0.880 5.389 0.511 1.00 1.99 N ATOM 0 H ASN B 40 2.502 4.135 -0.967 1.00 0.52 H new ATOM 0 HA ASN B 40 2.220 5.711 -3.455 1.00 0.57 H new ATOM 0 HB2 ASN B 40 1.156 7.406 -2.046 1.00 0.77 H new ATOM 0 HB3 ASN B 40 0.295 5.884 -1.927 1.00 0.77 H new ATOM 0 HD21 ASN B 40 0.940 5.364 1.529 1.00 1.99 H new ATOM 0 HD22 ASN B 40 0.436 4.621 0.007 1.00 1.99 H new ATOM 1866 N PHE B 41 4.197 7.127 -3.051 1.00 0.48 N ATOM 1867 CA PHE B 41 5.439 7.873 -2.918 1.00 0.55 C ATOM 1868 C PHE B 41 5.195 9.327 -3.299 1.00 0.60 C ATOM 1869 O PHE B 41 4.594 9.603 -4.333 1.00 0.76 O ATOM 1870 CB PHE B 41 6.532 7.273 -3.811 1.00 0.66 C ATOM 1871 CG PHE B 41 6.619 5.773 -3.747 1.00 0.67 C ATOM 1872 CD1 PHE B 41 7.328 5.148 -2.732 1.00 1.04 C ATOM 1873 CD2 PHE B 41 6.000 4.988 -4.705 1.00 1.12 C ATOM 1874 CE1 PHE B 41 7.419 3.770 -2.680 1.00 1.08 C ATOM 1875 CE2 PHE B 41 6.085 3.611 -4.653 1.00 1.26 C ATOM 1876 CZ PHE B 41 6.795 3.001 -3.640 1.00 0.93 C ATOM 0 H PHE B 41 3.744 7.234 -3.959 1.00 0.48 H new ATOM 0 HA PHE B 41 5.776 7.816 -1.883 1.00 0.55 H new ATOM 0 HB2 PHE B 41 6.349 7.572 -4.843 1.00 0.66 H new ATOM 0 HB3 PHE B 41 7.495 7.695 -3.523 1.00 0.66 H new ATOM 0 HD1 PHE B 41 7.814 5.745 -1.974 1.00 1.04 H new ATOM 0 HD2 PHE B 41 5.444 5.459 -5.502 1.00 1.12 H new ATOM 0 HE1 PHE B 41 7.979 3.295 -1.888 1.00 1.08 H new ATOM 0 HE2 PHE B 41 5.595 3.011 -5.406 1.00 1.26 H new ATOM 0 HZ PHE B 41 6.862 1.924 -3.599 1.00 0.93 H new ATOM 1886 N ASP B 42 5.554 10.243 -2.416 1.00 0.56 N ATOM 1887 CA ASP B 42 5.284 11.661 -2.636 1.00 0.59 C ATOM 1888 C ASP B 42 6.147 12.214 -3.773 1.00 0.54 C ATOM 1889 O ASP B 42 7.138 11.602 -4.162 1.00 0.51 O ATOM 1890 CB ASP B 42 5.508 12.442 -1.334 1.00 0.68 C ATOM 1891 CG ASP B 42 6.676 13.403 -1.400 1.00 1.22 C ATOM 1892 OD1 ASP B 42 7.809 12.989 -1.077 1.00 2.03 O ATOM 1893 OD2 ASP B 42 6.466 14.577 -1.766 1.00 1.66 O ATOM 0 H ASP B 42 6.033 10.035 -1.540 1.00 0.56 H new ATOM 0 HA ASP B 42 4.242 11.779 -2.934 1.00 0.59 H new ATOM 0 HB2 ASP B 42 4.603 12.999 -1.093 1.00 0.68 H new ATOM 0 HB3 ASP B 42 5.674 11.736 -0.520 1.00 0.68 H new ATOM 1898 N GLU B 43 5.702 13.319 -4.365 1.00 0.63 N ATOM 1899 CA GLU B 43 6.366 13.903 -5.527 1.00 0.67 C ATOM 1900 C GLU B 43 7.815 14.295 -5.229 1.00 0.56 C ATOM 1901 O GLU B 43 8.682 14.150 -6.090 1.00 0.60 O ATOM 1902 CB GLU B 43 5.583 15.117 -6.029 1.00 0.87 C ATOM 1903 CG GLU B 43 5.784 15.409 -7.506 1.00 1.09 C ATOM 1904 CD GLU B 43 5.452 14.220 -8.385 1.00 1.11 C ATOM 1905 OE1 GLU B 43 4.292 13.753 -8.344 1.00 1.73 O ATOM 1906 OE2 GLU B 43 6.351 13.732 -9.099 1.00 1.63 O ATOM 0 H GLU B 43 4.877 13.832 -4.056 1.00 0.63 H new ATOM 0 HA GLU B 43 6.389 13.140 -6.305 1.00 0.67 H new ATOM 0 HB2 GLU B 43 4.521 14.956 -5.841 1.00 0.87 H new ATOM 0 HB3 GLU B 43 5.879 15.993 -5.452 1.00 0.87 H new ATOM 0 HG2 GLU B 43 5.159 16.255 -7.794 1.00 1.09 H new ATOM 0 HG3 GLU B 43 6.819 15.705 -7.677 1.00 1.09 H new ATOM 1913 N GLU B 44 8.089 14.697 -3.989 1.00 0.52 N ATOM 1914 CA GLU B 44 9.457 14.997 -3.565 1.00 0.54 C ATOM 1915 C GLU B 44 10.287 13.725 -3.578 1.00 0.53 C ATOM 1916 O GLU B 44 11.369 13.668 -4.164 1.00 0.57 O ATOM 1917 CB GLU B 44 9.464 15.579 -2.155 1.00 0.62 C ATOM 1918 CG GLU B 44 9.365 17.094 -2.100 1.00 0.91 C ATOM 1919 CD GLU B 44 8.835 17.593 -0.769 1.00 1.74 C ATOM 1920 OE1 GLU B 44 8.905 16.841 0.227 1.00 2.36 O ATOM 1921 OE2 GLU B 44 8.338 18.738 -0.708 1.00 2.52 O ATOM 0 H GLU B 44 7.385 14.822 -3.262 1.00 0.52 H new ATOM 0 HA GLU B 44 9.880 15.726 -4.256 1.00 0.54 H new ATOM 0 HB2 GLU B 44 8.632 15.152 -1.595 1.00 0.62 H new ATOM 0 HB3 GLU B 44 10.380 15.269 -1.652 1.00 0.62 H new ATOM 0 HG2 GLU B 44 10.349 17.526 -2.281 1.00 0.91 H new ATOM 0 HG3 GLU B 44 8.712 17.442 -2.901 1.00 0.91 H new ATOM 1928 N LYS B 45 9.728 12.688 -2.984 1.00 0.52 N ATOM 1929 CA LYS B 45 10.340 11.374 -2.973 1.00 0.56 C ATOM 1930 C LYS B 45 10.476 10.846 -4.399 1.00 0.55 C ATOM 1931 O LYS B 45 11.397 10.098 -4.714 1.00 0.59 O ATOM 1932 CB LYS B 45 9.483 10.430 -2.124 1.00 0.61 C ATOM 1933 CG LYS B 45 9.769 8.956 -2.336 1.00 0.75 C ATOM 1934 CD LYS B 45 9.293 8.136 -1.156 1.00 0.96 C ATOM 1935 CE LYS B 45 10.308 8.144 -0.027 1.00 1.30 C ATOM 1936 NZ LYS B 45 9.845 8.960 1.128 1.00 1.74 N ATOM 0 H LYS B 45 8.834 12.734 -2.494 1.00 0.52 H new ATOM 0 HA LYS B 45 11.338 11.436 -2.540 1.00 0.56 H new ATOM 0 HB2 LYS B 45 9.636 10.669 -1.072 1.00 0.61 H new ATOM 0 HB3 LYS B 45 8.432 10.618 -2.344 1.00 0.61 H new ATOM 0 HG2 LYS B 45 9.275 8.613 -3.245 1.00 0.75 H new ATOM 0 HG3 LYS B 45 10.839 8.806 -2.479 1.00 0.75 H new ATOM 0 HD2 LYS B 45 8.344 8.532 -0.796 1.00 0.96 H new ATOM 0 HD3 LYS B 45 9.110 7.110 -1.475 1.00 0.96 H new ATOM 0 HE2 LYS B 45 10.494 7.121 0.302 1.00 1.30 H new ATOM 0 HE3 LYS B 45 11.256 8.538 -0.393 1.00 1.30 H new ATOM 0 HZ1 LYS B 45 10.663 9.238 1.707 1.00 1.74 H new ATOM 0 HZ2 LYS B 45 9.361 9.812 0.779 1.00 1.74 H new ATOM 0 HZ3 LYS B 45 9.186 8.400 1.707 1.00 1.74 H new ATOM 1950 N HIS B 46 9.575 11.287 -5.269 1.00 0.52 N ATOM 1951 CA HIS B 46 9.596 10.886 -6.671 1.00 0.55 C ATOM 1952 C HIS B 46 10.764 11.540 -7.408 1.00 0.56 C ATOM 1953 O HIS B 46 11.412 10.898 -8.232 1.00 0.58 O ATOM 1954 CB HIS B 46 8.265 11.235 -7.347 1.00 0.59 C ATOM 1955 CG HIS B 46 8.157 10.755 -8.765 1.00 0.70 C ATOM 1956 ND1 HIS B 46 7.478 11.449 -9.739 1.00 0.94 N ATOM 1957 CD2 HIS B 46 8.656 9.652 -9.374 1.00 0.81 C ATOM 1958 CE1 HIS B 46 7.560 10.796 -10.881 1.00 1.07 C ATOM 1959 NE2 HIS B 46 8.270 9.704 -10.690 1.00 0.99 N ATOM 0 H HIS B 46 8.817 11.925 -5.027 1.00 0.52 H new ATOM 0 HA HIS B 46 9.733 9.806 -6.715 1.00 0.55 H new ATOM 0 HB2 HIS B 46 7.450 10.805 -6.765 1.00 0.59 H new ATOM 0 HB3 HIS B 46 8.133 12.317 -7.329 1.00 0.59 H new ATOM 0 HD1 HIS B 46 6.987 12.332 -9.599 1.00 0.94 H new ATOM 0 HD2 HIS B 46 9.247 8.876 -8.910 1.00 0.81 H new ATOM 0 HE1 HIS B 46 7.119 11.105 -11.817 1.00 1.07 H new ATOM 1968 N THR B 47 11.076 12.788 -7.070 1.00 0.59 N ATOM 1969 CA THR B 47 12.219 13.464 -7.674 1.00 0.64 C ATOM 1970 C THR B 47 13.518 12.822 -7.200 1.00 0.62 C ATOM 1971 O THR B 47 14.442 12.604 -7.988 1.00 0.65 O ATOM 1972 CB THR B 47 12.245 14.968 -7.338 1.00 0.71 C ATOM 1973 OG1 THR B 47 11.195 15.282 -6.417 1.00 0.85 O ATOM 1974 CG2 THR B 47 12.088 15.810 -8.593 1.00 0.79 C ATOM 0 H THR B 47 10.560 13.346 -6.389 1.00 0.59 H new ATOM 0 HA THR B 47 12.121 13.359 -8.755 1.00 0.64 H new ATOM 0 HB THR B 47 13.210 15.197 -6.885 1.00 0.71 H new ATOM 0 HG1 THR B 47 11.349 14.810 -5.572 1.00 0.85 H new ATOM 0 HG21 THR B 47 12.110 16.867 -8.327 1.00 0.79 H new ATOM 0 HG22 THR B 47 12.904 15.592 -9.282 1.00 0.79 H new ATOM 0 HG23 THR B 47 11.137 15.576 -9.072 1.00 0.79 H new ATOM 1982 N ARG B 48 13.521 12.406 -5.939 1.00 0.59 N ATOM 1983 CA ARG B 48 14.644 11.668 -5.382 1.00 0.61 C ATOM 1984 C ARG B 48 14.735 10.293 -6.032 1.00 0.54 C ATOM 1985 O ARG B 48 15.816 9.830 -6.384 1.00 0.56 O ATOM 1986 CB ARG B 48 14.483 11.521 -3.869 1.00 0.66 C ATOM 1987 CG ARG B 48 15.457 12.368 -3.069 1.00 0.93 C ATOM 1988 CD ARG B 48 15.204 12.241 -1.575 1.00 1.46 C ATOM 1989 NE ARG B 48 16.452 12.190 -0.814 1.00 1.67 N ATOM 1990 CZ ARG B 48 16.739 12.995 0.210 1.00 1.70 C ATOM 1991 NH1 ARG B 48 15.836 13.854 0.666 1.00 1.82 N ATOM 1992 NH2 ARG B 48 17.923 12.919 0.797 1.00 2.26 N ATOM 0 H ARG B 48 12.756 12.568 -5.284 1.00 0.59 H new ATOM 0 HA ARG B 48 15.562 12.220 -5.584 1.00 0.61 H new ATOM 0 HB2 ARG B 48 13.465 11.794 -3.592 1.00 0.66 H new ATOM 0 HB3 ARG B 48 14.617 10.474 -3.598 1.00 0.66 H new ATOM 0 HG2 ARG B 48 16.478 12.061 -3.294 1.00 0.93 H new ATOM 0 HG3 ARG B 48 15.364 13.412 -3.368 1.00 0.93 H new ATOM 0 HD2 ARG B 48 14.605 13.086 -1.235 1.00 1.46 H new ATOM 0 HD3 ARG B 48 14.623 11.340 -1.380 1.00 1.46 H new ATOM 0 HE ARG B 48 17.147 11.494 -1.084 1.00 1.67 H new ATOM 0 HH11 ARG B 48 14.914 13.902 0.233 1.00 1.82 H new ATOM 0 HH12 ARG B 48 16.064 14.466 1.450 1.00 1.82 H new ATOM 0 HH21 ARG B 48 18.614 12.246 0.466 1.00 2.26 H new ATOM 0 HH22 ARG B 48 18.144 13.534 1.580 1.00 2.26 H new ATOM 2006 N PHE B 49 13.577 9.670 -6.229 1.00 0.49 N ATOM 2007 CA PHE B 49 13.496 8.364 -6.874 1.00 0.45 C ATOM 2008 C PHE B 49 14.031 8.431 -8.295 1.00 0.47 C ATOM 2009 O PHE B 49 14.795 7.564 -8.718 1.00 0.48 O ATOM 2010 CB PHE B 49 12.047 7.865 -6.888 1.00 0.48 C ATOM 2011 CG PHE B 49 11.849 6.542 -6.202 1.00 0.38 C ATOM 2012 CD1 PHE B 49 12.939 5.754 -5.866 1.00 0.83 C ATOM 2013 CD2 PHE B 49 10.576 6.084 -5.894 1.00 1.06 C ATOM 2014 CE1 PHE B 49 12.765 4.538 -5.234 1.00 0.87 C ATOM 2015 CE2 PHE B 49 10.398 4.866 -5.265 1.00 1.27 C ATOM 2016 CZ PHE B 49 11.472 4.098 -4.933 1.00 0.85 C ATOM 0 H PHE B 49 12.674 10.053 -5.948 1.00 0.49 H new ATOM 0 HA PHE B 49 14.108 7.666 -6.303 1.00 0.45 H new ATOM 0 HB2 PHE B 49 11.412 8.610 -6.408 1.00 0.48 H new ATOM 0 HB3 PHE B 49 11.713 7.780 -7.922 1.00 0.48 H new ATOM 0 HD1 PHE B 49 13.936 6.095 -6.101 1.00 0.83 H new ATOM 0 HD2 PHE B 49 9.716 6.685 -6.148 1.00 1.06 H new ATOM 0 HE1 PHE B 49 13.620 3.932 -4.974 1.00 0.87 H new ATOM 0 HE2 PHE B 49 9.401 4.521 -5.035 1.00 1.27 H new ATOM 0 HZ PHE B 49 11.326 3.150 -4.438 1.00 0.85 H new ATOM 2026 N LYS B 50 13.631 9.467 -9.020 1.00 0.50 N ATOM 2027 CA LYS B 50 14.069 9.664 -10.397 1.00 0.54 C ATOM 2028 C LYS B 50 15.588 9.758 -10.467 1.00 0.53 C ATOM 2029 O LYS B 50 16.230 9.096 -11.290 1.00 0.52 O ATOM 2030 CB LYS B 50 13.437 10.933 -10.974 1.00 0.63 C ATOM 2031 CG LYS B 50 12.551 10.683 -12.181 1.00 0.91 C ATOM 2032 CD LYS B 50 13.376 10.500 -13.444 1.00 1.54 C ATOM 2033 CE LYS B 50 12.503 10.173 -14.643 1.00 2.02 C ATOM 2034 NZ LYS B 50 12.169 11.390 -15.430 1.00 2.55 N ATOM 0 H LYS B 50 12.999 10.189 -8.675 1.00 0.50 H new ATOM 0 HA LYS B 50 13.747 8.807 -10.988 1.00 0.54 H new ATOM 0 HB2 LYS B 50 12.847 11.419 -10.197 1.00 0.63 H new ATOM 0 HB3 LYS B 50 14.229 11.627 -11.254 1.00 0.63 H new ATOM 0 HG2 LYS B 50 11.942 9.795 -12.010 1.00 0.91 H new ATOM 0 HG3 LYS B 50 11.865 11.520 -12.311 1.00 0.91 H new ATOM 0 HD2 LYS B 50 13.942 11.410 -13.644 1.00 1.54 H new ATOM 0 HD3 LYS B 50 14.101 9.700 -13.293 1.00 1.54 H new ATOM 0 HE2 LYS B 50 13.018 9.456 -15.283 1.00 2.02 H new ATOM 0 HE3 LYS B 50 11.584 9.695 -14.304 1.00 2.02 H new ATOM 0 HZ1 LYS B 50 11.572 11.127 -16.240 1.00 2.55 H new ATOM 0 HZ2 LYS B 50 11.656 12.064 -14.826 1.00 2.55 H new ATOM 0 HZ3 LYS B 50 13.045 11.832 -15.775 1.00 2.55 H new ATOM 2048 N ALA B 51 16.157 10.528 -9.547 1.00 0.56 N ATOM 2049 CA ALA B 51 17.601 10.679 -9.457 1.00 0.61 C ATOM 2050 C ALA B 51 18.260 9.362 -9.057 1.00 0.57 C ATOM 2051 O ALA B 51 19.284 8.975 -9.617 1.00 0.58 O ATOM 2052 CB ALA B 51 17.957 11.769 -8.465 1.00 0.71 C ATOM 0 H ALA B 51 15.635 11.059 -8.850 1.00 0.56 H new ATOM 0 HA ALA B 51 17.976 10.964 -10.440 1.00 0.61 H new ATOM 0 HB1 ALA B 51 19.041 11.870 -8.409 1.00 0.71 H new ATOM 0 HB2 ALA B 51 17.521 12.714 -8.790 1.00 0.71 H new ATOM 0 HB3 ALA B 51 17.565 11.508 -7.482 1.00 0.71 H new ATOM 2058 N ALA B 52 17.645 8.664 -8.109 1.00 0.55 N ATOM 2059 CA ALA B 52 18.149 7.379 -7.645 1.00 0.59 C ATOM 2060 C ALA B 52 18.177 6.362 -8.781 1.00 0.51 C ATOM 2061 O ALA B 52 19.166 5.650 -8.955 1.00 0.54 O ATOM 2062 CB ALA B 52 17.303 6.865 -6.489 1.00 0.67 C ATOM 0 H ALA B 52 16.790 8.970 -7.644 1.00 0.55 H new ATOM 0 HA ALA B 52 19.171 7.520 -7.293 1.00 0.59 H new ATOM 0 HB1 ALA B 52 17.692 5.904 -6.153 1.00 0.67 H new ATOM 0 HB2 ALA B 52 17.339 7.579 -5.666 1.00 0.67 H new ATOM 0 HB3 ALA B 52 16.271 6.744 -6.819 1.00 0.67 H new ATOM 2068 N CYS B 53 17.118 6.340 -9.587 1.00 0.48 N ATOM 2069 CA CYS B 53 17.045 5.441 -10.737 1.00 0.53 C ATOM 2070 C CYS B 53 18.146 5.761 -11.741 1.00 0.50 C ATOM 2071 O CYS B 53 18.739 4.861 -12.337 1.00 0.56 O ATOM 2072 CB CYS B 53 15.678 5.546 -11.418 1.00 0.68 C ATOM 2073 SG CYS B 53 14.274 5.222 -10.329 1.00 1.15 S ATOM 0 H CYS B 53 16.298 6.935 -9.465 1.00 0.48 H new ATOM 0 HA CYS B 53 17.183 4.422 -10.376 1.00 0.53 H new ATOM 0 HB2 CYS B 53 15.572 6.545 -11.840 1.00 0.68 H new ATOM 0 HB3 CYS B 53 15.646 4.843 -12.251 1.00 0.68 H new ATOM 0 HG CYS B 53 14.245 6.112 -9.382 1.00 1.15 H new ATOM 2079 N ALA B 54 18.434 7.047 -11.902 1.00 0.51 N ATOM 2080 CA ALA B 54 19.480 7.487 -12.814 1.00 0.59 C ATOM 2081 C ALA B 54 20.861 7.114 -12.285 1.00 0.59 C ATOM 2082 O ALA B 54 21.703 6.602 -13.023 1.00 0.70 O ATOM 2083 CB ALA B 54 19.385 8.991 -13.037 1.00 0.69 C ATOM 0 H ALA B 54 17.957 7.803 -11.412 1.00 0.51 H new ATOM 0 HA ALA B 54 19.336 6.979 -13.768 1.00 0.59 H new ATOM 0 HB1 ALA B 54 20.173 9.308 -13.721 1.00 0.69 H new ATOM 0 HB2 ALA B 54 18.413 9.235 -13.465 1.00 0.69 H new ATOM 0 HB3 ALA B 54 19.502 9.508 -12.085 1.00 0.69 H new ATOM 2089 N ARG B 55 21.087 7.388 -11.007 1.00 0.55 N ATOM 2090 CA ARG B 55 22.373 7.118 -10.375 1.00 0.64 C ATOM 2091 C ARG B 55 22.653 5.620 -10.320 1.00 0.59 C ATOM 2092 O ARG B 55 23.704 5.155 -10.772 1.00 0.76 O ATOM 2093 CB ARG B 55 22.405 7.704 -8.961 1.00 0.72 C ATOM 2094 CG ARG B 55 22.531 9.219 -8.933 1.00 1.03 C ATOM 2095 CD ARG B 55 22.478 9.753 -7.510 1.00 1.37 C ATOM 2096 NE ARG B 55 23.801 9.777 -6.883 1.00 1.97 N ATOM 2097 CZ ARG B 55 24.087 10.454 -5.768 1.00 2.64 C ATOM 2098 NH1 ARG B 55 23.154 11.184 -5.168 1.00 2.89 N ATOM 2099 NH2 ARG B 55 25.308 10.405 -5.251 1.00 3.60 N ATOM 0 H ARG B 55 20.392 7.800 -10.384 1.00 0.55 H new ATOM 0 HA ARG B 55 23.148 7.592 -10.977 1.00 0.64 H new ATOM 0 HB2 ARG B 55 21.495 7.414 -8.436 1.00 0.72 H new ATOM 0 HB3 ARG B 55 23.241 7.268 -8.415 1.00 0.72 H new ATOM 0 HG2 ARG B 55 23.470 9.516 -9.400 1.00 1.03 H new ATOM 0 HG3 ARG B 55 21.728 9.664 -9.520 1.00 1.03 H new ATOM 0 HD2 ARG B 55 22.062 10.760 -7.516 1.00 1.37 H new ATOM 0 HD3 ARG B 55 21.806 9.134 -6.915 1.00 1.37 H new ATOM 0 HE ARG B 55 24.550 9.244 -7.325 1.00 1.97 H new ATOM 0 HH11 ARG B 55 22.213 11.230 -5.559 1.00 2.89 H new ATOM 0 HH12 ARG B 55 23.379 11.699 -4.317 1.00 2.89 H new ATOM 0 HH21 ARG B 55 26.032 9.849 -5.705 1.00 3.60 H new ATOM 0 HH22 ARG B 55 25.522 10.924 -4.399 1.00 3.60 H new ATOM 2113 N LYS B 56 21.702 4.869 -9.776 1.00 0.47 N ATOM 2114 CA LYS B 56 21.846 3.425 -9.638 1.00 0.52 C ATOM 2115 C LYS B 56 21.834 2.742 -11.001 1.00 0.51 C ATOM 2116 O LYS B 56 22.534 1.752 -11.219 1.00 0.60 O ATOM 2117 CB LYS B 56 20.727 2.859 -8.757 1.00 0.61 C ATOM 2118 CG LYS B 56 20.786 3.336 -7.315 1.00 0.74 C ATOM 2119 CD LYS B 56 21.728 2.483 -6.480 1.00 0.91 C ATOM 2120 CE LYS B 56 22.370 3.290 -5.362 1.00 1.62 C ATOM 2121 NZ LYS B 56 23.396 2.506 -4.631 1.00 1.85 N ATOM 0 H LYS B 56 20.820 5.238 -9.422 1.00 0.47 H new ATOM 0 HA LYS B 56 22.807 3.226 -9.163 1.00 0.52 H new ATOM 0 HB2 LYS B 56 19.764 3.138 -9.184 1.00 0.61 H new ATOM 0 HB3 LYS B 56 20.779 1.770 -8.773 1.00 0.61 H new ATOM 0 HG2 LYS B 56 21.115 4.375 -7.288 1.00 0.74 H new ATOM 0 HG3 LYS B 56 19.787 3.307 -6.881 1.00 0.74 H new ATOM 0 HD2 LYS B 56 21.179 1.643 -6.054 1.00 0.91 H new ATOM 0 HD3 LYS B 56 22.505 2.064 -7.120 1.00 0.91 H new ATOM 0 HE2 LYS B 56 22.828 4.187 -5.779 1.00 1.62 H new ATOM 0 HE3 LYS B 56 21.600 3.620 -4.664 1.00 1.62 H new ATOM 0 HZ1 LYS B 56 23.809 3.092 -3.878 1.00 1.85 H new ATOM 0 HZ2 LYS B 56 22.955 1.663 -4.211 1.00 1.85 H new ATOM 0 HZ3 LYS B 56 24.144 2.213 -5.291 1.00 1.85 H new ATOM 2135 N GLY B 57 21.053 3.288 -11.922 1.00 0.46 N ATOM 2136 CA GLY B 57 20.955 2.715 -13.252 1.00 0.51 C ATOM 2137 C GLY B 57 19.996 1.546 -13.284 1.00 0.59 C ATOM 2138 O GLY B 57 20.406 0.400 -13.487 1.00 0.75 O ATOM 0 H GLY B 57 20.483 4.121 -11.773 1.00 0.46 H new ATOM 0 HA2 GLY B 57 20.622 3.479 -13.955 1.00 0.51 H new ATOM 0 HA3 GLY B 57 21.941 2.387 -13.581 1.00 0.51 H new ATOM 2142 N THR B 58 18.738 1.815 -12.972 1.00 0.63 N ATOM 2143 CA THR B 58 17.746 0.762 -12.864 1.00 0.77 C ATOM 2144 C THR B 58 16.325 1.340 -12.905 1.00 0.62 C ATOM 2145 O THR B 58 16.143 2.558 -12.975 1.00 0.57 O ATOM 2146 CB THR B 58 17.972 -0.053 -11.568 1.00 1.02 C ATOM 2147 OG1 THR B 58 17.445 -1.373 -11.711 1.00 1.92 O ATOM 2148 CG2 THR B 58 17.345 0.624 -10.360 1.00 0.92 C ATOM 0 H THR B 58 18.382 2.753 -12.790 1.00 0.63 H new ATOM 0 HA THR B 58 17.858 0.094 -13.718 1.00 0.77 H new ATOM 0 HB THR B 58 19.048 -0.109 -11.402 1.00 1.02 H new ATOM 0 HG1 THR B 58 17.712 -1.917 -10.941 1.00 1.92 H new ATOM 0 HG21 THR B 58 17.526 0.021 -9.470 1.00 0.92 H new ATOM 0 HG22 THR B 58 17.788 1.611 -10.225 1.00 0.92 H new ATOM 0 HG23 THR B 58 16.271 0.727 -10.517 1.00 0.92 H new ATOM 2156 N SER B 59 15.331 0.456 -12.918 1.00 0.66 N ATOM 2157 CA SER B 59 13.931 0.859 -12.997 1.00 0.66 C ATOM 2158 C SER B 59 13.427 1.350 -11.644 1.00 0.62 C ATOM 2159 O SER B 59 13.987 1.004 -10.604 1.00 0.66 O ATOM 2160 CB SER B 59 13.087 -0.321 -13.476 1.00 0.78 C ATOM 2161 OG SER B 59 13.896 -1.465 -13.702 1.00 0.87 O ATOM 0 H SER B 59 15.472 -0.553 -12.874 1.00 0.66 H new ATOM 0 HA SER B 59 13.844 1.681 -13.707 1.00 0.66 H new ATOM 0 HB2 SER B 59 12.323 -0.552 -12.733 1.00 0.78 H new ATOM 0 HB3 SER B 59 12.567 -0.052 -14.395 1.00 0.78 H new ATOM 0 HG SER B 59 14.074 -1.913 -12.849 1.00 0.87 H new ATOM 2167 N ILE B 60 12.377 2.166 -11.663 1.00 0.66 N ATOM 2168 CA ILE B 60 11.814 2.721 -10.437 1.00 0.73 C ATOM 2169 C ILE B 60 11.281 1.618 -9.520 1.00 0.76 C ATOM 2170 O ILE B 60 11.243 1.774 -8.306 1.00 0.85 O ATOM 2171 CB ILE B 60 10.696 3.751 -10.733 1.00 0.85 C ATOM 2172 CG1 ILE B 60 10.438 4.618 -9.497 1.00 0.97 C ATOM 2173 CG2 ILE B 60 9.415 3.058 -11.182 1.00 1.00 C ATOM 2174 CD1 ILE B 60 9.503 5.780 -9.750 1.00 0.91 C ATOM 0 H ILE B 60 11.899 2.458 -12.515 1.00 0.66 H new ATOM 0 HA ILE B 60 12.625 3.238 -9.925 1.00 0.73 H new ATOM 0 HB ILE B 60 11.029 4.393 -11.549 1.00 0.85 H new ATOM 0 HG12 ILE B 60 10.021 3.993 -8.707 1.00 0.97 H new ATOM 0 HG13 ILE B 60 11.389 5.003 -9.130 1.00 0.97 H new ATOM 0 HG21 ILE B 60 8.648 3.806 -11.383 1.00 1.00 H new ATOM 0 HG22 ILE B 60 9.610 2.485 -12.089 1.00 1.00 H new ATOM 0 HG23 ILE B 60 9.070 2.386 -10.396 1.00 1.00 H new ATOM 0 HD11 ILE B 60 9.369 6.347 -8.829 1.00 0.91 H new ATOM 0 HD12 ILE B 60 9.928 6.428 -10.516 1.00 0.91 H new ATOM 0 HD13 ILE B 60 8.537 5.403 -10.088 1.00 0.91 H new ATOM 2186 N THR B 61 10.927 0.481 -10.101 1.00 0.79 N ATOM 2187 CA THR B 61 10.458 -0.650 -9.325 1.00 0.85 C ATOM 2188 C THR B 61 11.625 -1.360 -8.638 1.00 0.77 C ATOM 2189 O THR B 61 11.520 -1.812 -7.493 1.00 0.75 O ATOM 2190 CB THR B 61 9.718 -1.646 -10.231 1.00 1.01 C ATOM 2191 OG1 THR B 61 9.774 -1.188 -11.590 1.00 1.12 O ATOM 2192 CG2 THR B 61 8.270 -1.795 -9.800 1.00 1.14 C ATOM 0 H THR B 61 10.957 0.320 -11.108 1.00 0.79 H new ATOM 0 HA THR B 61 9.775 -0.275 -8.563 1.00 0.85 H new ATOM 0 HB THR B 61 10.203 -2.619 -10.149 1.00 1.01 H new ATOM 0 HG1 THR B 61 9.304 -1.824 -12.169 1.00 1.12 H new ATOM 0 HG21 THR B 61 7.766 -2.505 -10.456 1.00 1.14 H new ATOM 0 HG22 THR B 61 8.232 -2.159 -8.773 1.00 1.14 H new ATOM 0 HG23 THR B 61 7.771 -0.828 -9.861 1.00 1.14 H new ATOM 2200 N ASP B 62 12.742 -1.434 -9.347 1.00 0.74 N ATOM 2201 CA ASP B 62 13.929 -2.105 -8.839 1.00 0.73 C ATOM 2202 C ASP B 62 14.518 -1.364 -7.646 1.00 0.62 C ATOM 2203 O ASP B 62 14.941 -1.984 -6.674 1.00 0.61 O ATOM 2204 CB ASP B 62 14.980 -2.244 -9.939 1.00 0.82 C ATOM 2205 CG ASP B 62 16.113 -3.163 -9.532 1.00 1.16 C ATOM 2206 OD1 ASP B 62 15.867 -4.375 -9.356 1.00 1.68 O ATOM 2207 OD2 ASP B 62 17.252 -2.676 -9.372 1.00 1.81 O ATOM 0 H ASP B 62 12.851 -1.036 -10.280 1.00 0.74 H new ATOM 0 HA ASP B 62 13.629 -3.099 -8.507 1.00 0.73 H new ATOM 0 HB2 ASP B 62 14.509 -2.629 -10.843 1.00 0.82 H new ATOM 0 HB3 ASP B 62 15.381 -1.260 -10.183 1.00 0.82 H new ATOM 2212 N VAL B 63 14.483 -0.036 -7.686 1.00 0.60 N ATOM 2213 CA VAL B 63 14.986 0.757 -6.567 1.00 0.57 C ATOM 2214 C VAL B 63 14.082 0.612 -5.345 1.00 0.56 C ATOM 2215 O VAL B 63 14.551 0.700 -4.214 1.00 0.59 O ATOM 2216 CB VAL B 63 15.160 2.255 -6.910 1.00 0.62 C ATOM 2217 CG1 VAL B 63 16.551 2.522 -7.462 1.00 0.81 C ATOM 2218 CG2 VAL B 63 14.103 2.724 -7.887 1.00 1.01 C ATOM 0 H VAL B 63 14.118 0.508 -8.468 1.00 0.60 H new ATOM 0 HA VAL B 63 15.976 0.360 -6.342 1.00 0.57 H new ATOM 0 HB VAL B 63 15.038 2.822 -5.987 1.00 0.62 H new ATOM 0 HG11 VAL B 63 16.652 3.582 -7.697 1.00 0.81 H new ATOM 0 HG12 VAL B 63 17.297 2.242 -6.719 1.00 0.81 H new ATOM 0 HG13 VAL B 63 16.702 1.934 -8.367 1.00 0.81 H new ATOM 0 HG21 VAL B 63 14.254 3.781 -8.107 1.00 1.01 H new ATOM 0 HG22 VAL B 63 14.178 2.147 -8.809 1.00 1.01 H new ATOM 0 HG23 VAL B 63 13.115 2.582 -7.450 1.00 1.01 H new ATOM 2228 N VAL B 64 12.828 0.223 -5.565 1.00 0.55 N ATOM 2229 CA VAL B 64 11.946 -0.106 -4.452 1.00 0.56 C ATOM 2230 C VAL B 64 12.399 -1.413 -3.811 1.00 0.55 C ATOM 2231 O VAL B 64 12.465 -1.536 -2.585 1.00 0.57 O ATOM 2232 CB VAL B 64 10.470 -0.238 -4.879 1.00 0.57 C ATOM 2233 CG1 VAL B 64 9.580 -0.454 -3.665 1.00 0.73 C ATOM 2234 CG2 VAL B 64 10.011 0.986 -5.649 1.00 0.67 C ATOM 0 H VAL B 64 12.406 0.129 -6.489 1.00 0.55 H new ATOM 0 HA VAL B 64 12.009 0.717 -3.740 1.00 0.56 H new ATOM 0 HB VAL B 64 10.390 -1.105 -5.535 1.00 0.57 H new ATOM 0 HG11 VAL B 64 8.542 -0.545 -3.986 1.00 0.73 H new ATOM 0 HG12 VAL B 64 9.882 -1.366 -3.150 1.00 0.73 H new ATOM 0 HG13 VAL B 64 9.677 0.394 -2.987 1.00 0.73 H new ATOM 0 HG21 VAL B 64 8.967 0.864 -5.937 1.00 0.67 H new ATOM 0 HG22 VAL B 64 10.113 1.871 -5.021 1.00 0.67 H new ATOM 0 HG23 VAL B 64 10.623 1.104 -6.544 1.00 0.67 H new ATOM 2244 N ASN B 65 12.826 -2.349 -4.650 1.00 0.55 N ATOM 2245 CA ASN B 65 13.399 -3.596 -4.160 1.00 0.56 C ATOM 2246 C ASN B 65 14.714 -3.317 -3.427 1.00 0.56 C ATOM 2247 O ASN B 65 15.102 -4.055 -2.522 1.00 0.56 O ATOM 2248 CB ASN B 65 13.633 -4.580 -5.312 1.00 0.58 C ATOM 2249 CG ASN B 65 14.156 -5.919 -4.826 1.00 0.77 C ATOM 2250 OD1 ASN B 65 13.606 -6.517 -3.899 1.00 0.86 O ATOM 2251 ND2 ASN B 65 15.220 -6.399 -5.447 1.00 1.46 N ATOM 0 H ASN B 65 12.787 -2.269 -5.666 1.00 0.55 H new ATOM 0 HA ASN B 65 12.693 -4.049 -3.464 1.00 0.56 H new ATOM 0 HB2 ASN B 65 12.699 -4.732 -5.853 1.00 0.58 H new ATOM 0 HB3 ASN B 65 14.344 -4.149 -6.017 1.00 0.58 H new ATOM 0 HD21 ASN B 65 15.615 -7.296 -5.163 1.00 1.46 H new ATOM 0 HD22 ASN B 65 15.646 -5.873 -6.210 1.00 1.46 H new ATOM 2258 N GLN B 66 15.367 -2.218 -3.790 1.00 0.58 N ATOM 2259 CA GLN B 66 16.617 -1.817 -3.154 1.00 0.60 C ATOM 2260 C GLN B 66 16.384 -1.357 -1.715 1.00 0.58 C ATOM 2261 O GLN B 66 17.119 -1.752 -0.807 1.00 0.61 O ATOM 2262 CB GLN B 66 17.294 -0.701 -3.952 1.00 0.65 C ATOM 2263 CG GLN B 66 18.530 -1.153 -4.704 1.00 0.84 C ATOM 2264 CD GLN B 66 18.304 -1.245 -6.199 1.00 1.25 C ATOM 2265 OE1 GLN B 66 18.490 -0.273 -6.932 1.00 2.01 O ATOM 2266 NE2 GLN B 66 17.919 -2.418 -6.667 1.00 1.70 N ATOM 0 H GLN B 66 15.049 -1.586 -4.525 1.00 0.58 H new ATOM 0 HA GLN B 66 17.271 -2.689 -3.135 1.00 0.60 H new ATOM 0 HB2 GLN B 66 16.578 -0.289 -4.663 1.00 0.65 H new ATOM 0 HB3 GLN B 66 17.568 0.105 -3.272 1.00 0.65 H new ATOM 0 HG2 GLN B 66 19.345 -0.457 -4.506 1.00 0.84 H new ATOM 0 HG3 GLN B 66 18.843 -2.127 -4.328 1.00 0.84 H new ATOM 0 HE21 GLN B 66 17.775 -3.200 -6.028 1.00 1.70 H new ATOM 0 HE22 GLN B 66 17.765 -2.542 -7.668 1.00 1.70 H new ATOM 2275 N LEU B 67 15.353 -0.543 -1.499 1.00 0.55 N ATOM 2276 CA LEU B 67 15.055 -0.059 -0.157 1.00 0.55 C ATOM 2277 C LEU B 67 14.654 -1.211 0.754 1.00 0.50 C ATOM 2278 O LEU B 67 15.139 -1.318 1.881 1.00 0.50 O ATOM 2279 CB LEU B 67 13.949 1.005 -0.147 1.00 0.57 C ATOM 2280 CG LEU B 67 13.274 1.308 -1.482 1.00 0.64 C ATOM 2281 CD1 LEU B 67 11.766 1.210 -1.341 1.00 0.97 C ATOM 2282 CD2 LEU B 67 13.664 2.690 -1.973 1.00 0.67 C ATOM 0 H LEU B 67 14.719 -0.210 -2.225 1.00 0.55 H new ATOM 0 HA LEU B 67 15.969 0.405 0.213 1.00 0.55 H new ATOM 0 HB2 LEU B 67 13.180 0.689 0.559 1.00 0.57 H new ATOM 0 HB3 LEU B 67 14.373 1.933 0.238 1.00 0.57 H new ATOM 0 HG LEU B 67 13.608 0.572 -2.214 1.00 0.64 H new ATOM 0 HD11 LEU B 67 11.296 1.428 -2.300 1.00 0.97 H new ATOM 0 HD12 LEU B 67 11.495 0.203 -1.025 1.00 0.97 H new ATOM 0 HD13 LEU B 67 11.423 1.929 -0.597 1.00 0.97 H new ATOM 0 HD21 LEU B 67 13.174 2.889 -2.926 1.00 0.67 H new ATOM 0 HD22 LEU B 67 13.354 3.437 -1.242 1.00 0.67 H new ATOM 0 HD23 LEU B 67 14.745 2.738 -2.104 1.00 0.67 H new ATOM 2294 N VAL B 68 13.806 -2.103 0.245 1.00 0.48 N ATOM 2295 CA VAL B 68 13.377 -3.261 1.018 1.00 0.45 C ATOM 2296 C VAL B 68 14.548 -4.213 1.247 1.00 0.42 C ATOM 2297 O VAL B 68 14.639 -4.859 2.287 1.00 0.40 O ATOM 2298 CB VAL B 68 12.200 -4.007 0.345 1.00 0.46 C ATOM 2299 CG1 VAL B 68 12.655 -4.840 -0.839 1.00 0.99 C ATOM 2300 CG2 VAL B 68 11.476 -4.877 1.355 1.00 1.07 C ATOM 0 H VAL B 68 13.407 -2.045 -0.692 1.00 0.48 H new ATOM 0 HA VAL B 68 13.022 -2.894 1.981 1.00 0.45 H new ATOM 0 HB VAL B 68 11.512 -3.251 -0.033 1.00 0.46 H new ATOM 0 HG11 VAL B 68 11.796 -5.345 -1.280 1.00 0.99 H new ATOM 0 HG12 VAL B 68 13.116 -4.192 -1.584 1.00 0.99 H new ATOM 0 HG13 VAL B 68 13.380 -5.582 -0.505 1.00 0.99 H new ATOM 0 HG21 VAL B 68 10.651 -5.394 0.865 1.00 1.07 H new ATOM 0 HG22 VAL B 68 12.170 -5.609 1.768 1.00 1.07 H new ATOM 0 HG23 VAL B 68 11.086 -4.253 2.159 1.00 1.07 H new ATOM 2310 N ASP B 69 15.485 -4.215 0.312 1.00 0.47 N ATOM 2311 CA ASP B 69 16.699 -5.013 0.435 1.00 0.49 C ATOM 2312 C ASP B 69 17.537 -4.528 1.606 1.00 0.48 C ATOM 2313 O ASP B 69 18.051 -5.323 2.396 1.00 0.49 O ATOM 2314 CB ASP B 69 17.526 -4.931 -0.847 1.00 0.60 C ATOM 2315 CG ASP B 69 18.339 -6.188 -1.086 1.00 0.84 C ATOM 2316 OD1 ASP B 69 17.734 -7.258 -1.316 1.00 1.09 O ATOM 2317 OD2 ASP B 69 19.583 -6.111 -1.060 1.00 1.46 O ATOM 0 H ASP B 69 15.429 -3.669 -0.548 1.00 0.47 H new ATOM 0 HA ASP B 69 16.406 -6.049 0.607 1.00 0.49 H new ATOM 0 HB2 ASP B 69 16.862 -4.763 -1.695 1.00 0.60 H new ATOM 0 HB3 ASP B 69 18.195 -4.073 -0.791 1.00 0.60 H new ATOM 2322 N ASN B 70 17.650 -3.214 1.722 1.00 0.55 N ATOM 2323 CA ASN B 70 18.406 -2.594 2.798 1.00 0.61 C ATOM 2324 C ASN B 70 17.702 -2.816 4.128 1.00 0.56 C ATOM 2325 O ASN B 70 18.324 -3.174 5.126 1.00 0.60 O ATOM 2326 CB ASN B 70 18.571 -1.093 2.536 1.00 0.74 C ATOM 2327 CG ASN B 70 19.758 -0.783 1.648 1.00 1.37 C ATOM 2328 OD1 ASN B 70 20.725 -0.157 2.080 1.00 1.88 O ATOM 2329 ND2 ASN B 70 19.685 -1.203 0.394 1.00 2.19 N ATOM 0 H ASN B 70 17.222 -2.550 1.076 1.00 0.55 H new ATOM 0 HA ASN B 70 19.394 -3.053 2.839 1.00 0.61 H new ATOM 0 HB2 ASN B 70 17.664 -0.707 2.071 1.00 0.74 H new ATOM 0 HB3 ASN B 70 18.688 -0.573 3.487 1.00 0.74 H new ATOM 0 HD21 ASN B 70 20.449 -1.010 -0.254 1.00 2.19 H new ATOM 0 HD22 ASN B 70 18.865 -1.719 0.076 1.00 2.19 H new ATOM 2336 N TRP B 71 16.394 -2.632 4.119 1.00 0.54 N ATOM 2337 CA TRP B 71 15.579 -2.821 5.308 1.00 0.54 C ATOM 2338 C TRP B 71 15.638 -4.267 5.792 1.00 0.47 C ATOM 2339 O TRP B 71 15.810 -4.530 6.980 1.00 0.53 O ATOM 2340 CB TRP B 71 14.134 -2.432 4.997 1.00 0.57 C ATOM 2341 CG TRP B 71 13.242 -2.396 6.200 1.00 0.64 C ATOM 2342 CD1 TRP B 71 13.026 -1.332 7.027 1.00 0.81 C ATOM 2343 CD2 TRP B 71 12.430 -3.469 6.698 1.00 0.61 C ATOM 2344 NE1 TRP B 71 12.134 -1.674 8.012 1.00 0.86 N ATOM 2345 CE2 TRP B 71 11.750 -2.980 7.830 1.00 0.75 C ATOM 2346 CE3 TRP B 71 12.211 -4.794 6.295 1.00 0.53 C ATOM 2347 CZ2 TRP B 71 10.871 -3.768 8.568 1.00 0.80 C ATOM 2348 CZ3 TRP B 71 11.336 -5.575 7.031 1.00 0.62 C ATOM 2349 CH2 TRP B 71 10.672 -5.056 8.154 1.00 0.74 C ATOM 0 H TRP B 71 15.868 -2.349 3.292 1.00 0.54 H new ATOM 0 HA TRP B 71 15.970 -2.185 6.103 1.00 0.54 H new ATOM 0 HB2 TRP B 71 14.127 -1.451 4.522 1.00 0.57 H new ATOM 0 HB3 TRP B 71 13.725 -3.139 4.275 1.00 0.57 H new ATOM 0 HD1 TRP B 71 13.490 -0.362 6.922 1.00 0.81 H new ATOM 0 HE1 TRP B 71 11.809 -1.059 8.758 1.00 0.86 H new ATOM 0 HE3 TRP B 71 12.714 -5.197 5.429 1.00 0.53 H new ATOM 0 HZ2 TRP B 71 10.364 -3.376 9.437 1.00 0.80 H new ATOM 0 HZ3 TRP B 71 11.162 -6.599 6.737 1.00 0.62 H new ATOM 0 HH2 TRP B 71 9.989 -5.688 8.703 1.00 0.74 H new ATOM 2360 N LEU B 72 15.402 -5.193 4.882 1.00 0.42 N ATOM 2361 CA LEU B 72 15.314 -6.604 5.228 1.00 0.44 C ATOM 2362 C LEU B 72 16.645 -7.164 5.713 1.00 0.55 C ATOM 2363 O LEU B 72 16.687 -7.909 6.686 1.00 0.65 O ATOM 2364 CB LEU B 72 14.839 -7.407 4.017 1.00 0.50 C ATOM 2365 CG LEU B 72 13.717 -8.403 4.296 1.00 0.47 C ATOM 2366 CD1 LEU B 72 12.385 -7.853 3.809 1.00 0.58 C ATOM 2367 CD2 LEU B 72 14.020 -9.735 3.630 1.00 0.60 C ATOM 0 H LEU B 72 15.267 -4.994 3.891 1.00 0.42 H new ATOM 0 HA LEU B 72 14.598 -6.692 6.045 1.00 0.44 H new ATOM 0 HB2 LEU B 72 14.502 -6.711 3.249 1.00 0.50 H new ATOM 0 HB3 LEU B 72 15.690 -7.949 3.604 1.00 0.50 H new ATOM 0 HG LEU B 72 13.650 -8.561 5.372 1.00 0.47 H new ATOM 0 HD11 LEU B 72 11.596 -8.576 4.016 1.00 0.58 H new ATOM 0 HD12 LEU B 72 12.166 -6.919 4.326 1.00 0.58 H new ATOM 0 HD13 LEU B 72 12.437 -7.670 2.736 1.00 0.58 H new ATOM 0 HD21 LEU B 72 13.212 -10.437 3.836 1.00 0.60 H new ATOM 0 HD22 LEU B 72 14.110 -9.591 2.553 1.00 0.60 H new ATOM 0 HD23 LEU B 72 14.956 -10.133 4.022 1.00 0.60 H new ATOM 2379 N LYS B 73 17.689 -6.961 4.926 1.00 0.63 N ATOM 2380 CA LYS B 73 18.952 -7.645 5.175 1.00 0.83 C ATOM 2381 C LYS B 73 19.916 -6.823 6.030 1.00 0.97 C ATOM 2382 O LYS B 73 20.691 -7.383 6.802 1.00 1.13 O ATOM 2383 CB LYS B 73 19.609 -8.008 3.845 1.00 0.96 C ATOM 2384 CG LYS B 73 18.636 -8.583 2.827 1.00 0.92 C ATOM 2385 CD LYS B 73 19.329 -8.904 1.515 1.00 1.16 C ATOM 2386 CE LYS B 73 18.591 -9.981 0.739 1.00 1.41 C ATOM 2387 NZ LYS B 73 18.700 -9.781 -0.731 1.00 1.79 N ATOM 0 H LYS B 73 17.691 -6.337 4.119 1.00 0.63 H new ATOM 0 HA LYS B 73 18.724 -8.548 5.741 1.00 0.83 H new ATOM 0 HB2 LYS B 73 20.078 -7.118 3.425 1.00 0.96 H new ATOM 0 HB3 LYS B 73 20.403 -8.732 4.026 1.00 0.96 H new ATOM 0 HG2 LYS B 73 18.179 -9.487 3.229 1.00 0.92 H new ATOM 0 HG3 LYS B 73 17.830 -7.871 2.649 1.00 0.92 H new ATOM 0 HD2 LYS B 73 19.397 -8.001 0.909 1.00 1.16 H new ATOM 0 HD3 LYS B 73 20.349 -9.233 1.713 1.00 1.16 H new ATOM 0 HE2 LYS B 73 18.994 -10.959 1.003 1.00 1.41 H new ATOM 0 HE3 LYS B 73 17.540 -9.981 1.028 1.00 1.41 H new ATOM 0 HZ1 LYS B 73 18.271 -10.590 -1.224 1.00 1.79 H new ATOM 0 HZ2 LYS B 73 18.203 -8.908 -1.000 1.00 1.79 H new ATOM 0 HZ3 LYS B 73 19.702 -9.705 -0.998 1.00 1.79 H new ATOM 2401 N GLU B 74 19.937 -5.513 5.830 1.00 0.99 N ATOM 2402 CA GLU B 74 20.902 -4.657 6.519 1.00 1.22 C ATOM 2403 C GLU B 74 20.311 -4.034 7.782 1.00 1.27 C ATOM 2404 O GLU B 74 20.999 -3.311 8.505 1.00 1.50 O ATOM 2405 CB GLU B 74 21.409 -3.563 5.579 1.00 1.37 C ATOM 2406 CG GLU B 74 21.513 -4.007 4.129 1.00 1.81 C ATOM 2407 CD GLU B 74 22.804 -3.565 3.478 1.00 2.23 C ATOM 2408 OE1 GLU B 74 23.099 -2.351 3.495 1.00 2.51 O ATOM 2409 OE2 GLU B 74 23.530 -4.423 2.936 1.00 2.78 O ATOM 0 H GLU B 74 19.303 -5.019 5.202 1.00 0.99 H new ATOM 0 HA GLU B 74 21.739 -5.287 6.822 1.00 1.22 H new ATOM 0 HB2 GLU B 74 20.740 -2.704 5.640 1.00 1.37 H new ATOM 0 HB3 GLU B 74 22.389 -3.229 5.919 1.00 1.37 H new ATOM 0 HG2 GLU B 74 21.438 -5.093 4.079 1.00 1.81 H new ATOM 0 HG3 GLU B 74 20.670 -3.603 3.568 1.00 1.81 H new ATOM 2416 N ASN B 75 19.028 -4.267 8.021 1.00 1.11 N ATOM 2417 CA ASN B 75 18.360 -3.682 9.181 1.00 1.21 C ATOM 2418 C ASN B 75 17.652 -4.755 10.011 1.00 1.14 C ATOM 2419 O ASN B 75 17.801 -4.806 11.233 1.00 1.29 O ATOM 2420 CB ASN B 75 17.380 -2.587 8.728 1.00 1.28 C ATOM 2421 CG ASN B 75 16.153 -2.465 9.615 1.00 1.61 C ATOM 2422 OD1 ASN B 75 16.187 -1.828 10.665 1.00 1.88 O ATOM 2423 ND2 ASN B 75 15.059 -3.058 9.181 1.00 1.97 N ATOM 0 H ASN B 75 18.431 -4.851 7.435 1.00 1.11 H new ATOM 0 HA ASN B 75 19.114 -3.225 9.822 1.00 1.21 H new ATOM 0 HB2 ASN B 75 17.901 -1.630 8.709 1.00 1.28 H new ATOM 0 HB3 ASN B 75 17.061 -2.796 7.707 1.00 1.28 H new ATOM 0 HD21 ASN B 75 14.197 -2.998 9.723 1.00 1.97 H new ATOM 0 HD22 ASN B 75 15.074 -3.577 8.303 1.00 1.97 H new ATOM 2430 N GLU B 76 16.911 -5.631 9.348 1.00 1.01 N ATOM 2431 CA GLU B 76 16.213 -6.711 10.033 1.00 1.08 C ATOM 2432 C GLU B 76 17.091 -7.957 10.105 1.00 1.38 C ATOM 2433 O GLU B 76 16.611 -8.996 10.602 1.00 1.93 O ATOM 2434 CB GLU B 76 14.896 -7.030 9.321 1.00 1.36 C ATOM 2435 CG GLU B 76 13.776 -6.041 9.613 1.00 1.88 C ATOM 2436 CD GLU B 76 13.795 -5.499 11.032 1.00 2.20 C ATOM 2437 OE1 GLU B 76 13.938 -6.305 11.977 1.00 2.52 O ATOM 2438 OE2 GLU B 76 13.675 -4.269 11.216 1.00 2.67 O ATOM 2439 OXT GLU B 76 18.255 -7.897 9.655 1.00 1.90 O ATOM 0 H GLU B 76 16.777 -5.616 8.337 1.00 1.01 H new ATOM 0 HA GLU B 76 15.991 -6.386 11.050 1.00 1.08 H new ATOM 0 HB2 GLU B 76 15.073 -7.054 8.246 1.00 1.36 H new ATOM 0 HB3 GLU B 76 14.570 -8.028 9.613 1.00 1.36 H new ATOM 0 HG2 GLU B 76 13.848 -5.208 8.914 1.00 1.88 H new ATOM 0 HG3 GLU B 76 12.817 -6.527 9.432 1.00 1.88 H new TER 2446 GLU B 76