USER MOD reduce.3.24.130724 H: found=0, std=0, add=1576, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1576 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 10 ASN : amide:sc= -1.01 K(o=-0.99,f=-4.1!) USER MOD Set 1.2: B 85 SER OG : rot 140:sc= 0.0283 USER MOD Set 2.1: B 81 GLN : amide:sc= -0.55 K(o=-0.68,f=-0.13) USER MOD Set 2.2: B 83 ASN : amide:sc= -0.13 K(o=-0.68,f=-3.4!) USER MOD Set 3.1: B 66 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Set 3.2: B 67 MET CE :methyl -172:sc= 0 (180deg=0) USER MOD Set 4.1: B 43 CYS SG : rot 23:sc= -2.22! USER MOD Set 4.2: B 52 SER OG : rot 32:sc= 0.705 USER MOD Set 5.1: A 19 ASN : amide:sc= -0.114 K(o=-0.95,f=-9.5!) USER MOD Set 5.2: B 37 ASN : amide:sc= -0.832 K(o=-0.95,f=-3!) USER MOD Set 6.1: A 37 ASN : amide:sc= -0.825 K(o=-0.7,f=-2.4) USER MOD Set 6.2: B 19 ASN : amide:sc= 0.125 K(o=-0.7,f=-8.3!) USER MOD Set 7.1: B 16 THR OG1 : rot 180:sc= 0 USER MOD Set 7.2: B 53 HIS : no HE2:sc= -0.475 K(o=-0.47,f=-1.1) USER MOD Set 8.1: B 4 GLN : amide:sc= -0.147 K(o=0.025,f=0.8) USER MOD Set 8.2: B 7 THR OG1 : rot -110:sc= 0.172 USER MOD Set 9.1: A 81 GLN : amide:sc= -0.688 K(o=-0.86,f=-0.18) USER MOD Set 9.2: A 83 ASN : amide:sc= -0.175 K(o=-0.86,f=-3.2!) USER MOD Set10.1: A 66 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Set10.2: A 67 MET CE :methyl -170:sc= 0 (180deg=0) USER MOD Set11.1: A 43 CYS SG : rot 24:sc= -2.44! USER MOD Set11.2: A 52 SER OG : rot 31:sc= 0.699 USER MOD Set12.1: A 28 CYS SG : rot -74:sc= -3.52! USER MOD Set12.2: B 25 THR OG1 : rot -7:sc= 1.7 USER MOD Set13.1: A 25 THR OG1 : rot 1:sc= 1.29! USER MOD Set13.2: B 28 CYS SG : rot -71:sc= -3.97! USER MOD Set14.1: A 16 THR OG1 : rot 180:sc= 0 USER MOD Set14.2: A 53 HIS : no HE2:sc= -0.572 K(o=-0.57,f=-1.2) USER MOD Set15.1: A 10 ASN : amide:sc= -1.39 K(o=-1.4,f=-4.9!) USER MOD Set15.2: A 85 SER OG : rot -92:sc= 0 USER MOD Set16.1: A 2 SER OG : rot 120:sc= 0.0442 USER MOD Set16.2: A 4 GLN : amide:sc= -0.847 K(o=-0.8,f=0.036) USER MOD Single : A 1 GLY N :NH3+ 171:sc= 0.688 (180deg=0.656) USER MOD Single : A 3 MET CE :methyl 166:sc= -0.0619 (180deg=-0.355) USER MOD Single : A 5 ASN : amide:sc= -0.0545 K(o=-0.055,f=-3.3!) USER MOD Single : A 6 THR OG1 : rot 51:sc= 0.0356 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= -0.205 X(o=-0.2,f=-0.59) USER MOD Single : A 20 HIS : no HD1:sc= -1.25 K(o=-1.3,f=-0.21) USER MOD Single : A 24 MET CE :methyl -167:sc= -0.0213 (180deg=-0.267) USER MOD Single : A 26 HIS : no HD1:sc= -0.0806 K(o=-0.081,f=-1.3) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0.645 K(o=0.64,f=-7.7!) USER MOD Single : A 62 GLN : amide:sc= -0.603 K(o=-0.6,f=0) USER MOD Single : A 69 SER OG : rot 76:sc= 0.854 USER MOD Single : A 70 GLN : amide:sc= -2.19 K(o=-2.2,f=-0.63) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.581 K(o=-0.58,f=0) USER MOD Single : A 88 THR OG1 : rot -12:sc= 0.868 USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 GLN : amide:sc= -2.12 K(o=-2.1,f=-4) USER MOD Single : B 1 GLY N :NH3+ -163:sc=-0.000901 (180deg=-0.321) USER MOD Single : B 2 SER OG : rot 180:sc= 0.0215 USER MOD Single : B 3 MET CE :methyl 167:sc= -0.0433 (180deg=-0.273) USER MOD Single : B 5 ASN : amide:sc= -0.302 K(o=-0.3,f=-4.2!) USER MOD Single : B 6 THR OG1 : rot 50:sc= 0.163 USER MOD Single : B 8 HIS : no HE2:sc= 0.156 K(o=0.16,f=-1.1) USER MOD Single : B 20 HIS : no HD1:sc= -1.24 K(o=-1.2,f=-0.19) USER MOD Single : B 24 MET CE :methyl -166:sc= -0.0381 (180deg=-0.3) USER MOD Single : B 26 HIS : no HD1:sc= -0.0538 K(o=-0.054,f=-1.4) USER MOD Single : B 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 ASN : amide:sc= 0.783 K(o=0.78,f=-7.4!) USER MOD Single : B 62 GLN : amide:sc= -0.519 K(o=-0.52,f=0) USER MOD Single : B 69 SER OG : rot 75:sc= 1.07 USER MOD Single : B 70 GLN : amide:sc= -1.98 K(o=-2,f=-0.58) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 GLN : amide:sc= -0.664 K(o=-0.66,f=0) USER MOD Single : B 88 THR OG1 : rot -16:sc= 0.905 USER MOD Single : B 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 91 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 GLN : amide:sc= -1.47 K(o=-1.5,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.551 0.293 -16.639 1.00 14.22 N ATOM 2 CA GLY A 1 6.720 0.053 -17.836 1.00 11.45 C ATOM 3 C GLY A 1 7.263 -1.052 -18.741 1.00 14.01 C ATOM 4 O GLY A 1 6.773 -1.226 -19.861 1.00 44.41 O ATOM 0 H1 GLY A 1 7.217 1.148 -16.150 1.00 14.22 H new ATOM 0 H2 GLY A 1 7.479 -0.522 -15.998 1.00 14.22 H new ATOM 0 H3 GLY A 1 8.542 0.423 -16.925 1.00 14.22 H new ATOM 0 HA2 GLY A 1 5.710 -0.209 -17.521 1.00 11.45 H new ATOM 0 HA3 GLY A 1 6.646 0.977 -18.409 1.00 11.45 H new ATOM 10 N SER A 2 8.275 -1.789 -18.269 1.00 73.45 N ATOM 11 CA SER A 2 8.864 -2.913 -19.011 1.00 65.34 C ATOM 12 C SER A 2 8.031 -4.176 -18.768 1.00 65.13 C ATOM 13 O SER A 2 7.567 -4.419 -17.644 1.00 44.40 O ATOM 14 CB SER A 2 10.330 -3.145 -18.570 1.00 34.30 C ATOM 15 OG SER A 2 10.978 -4.128 -19.367 1.00 11.50 O ATOM 0 H SER A 2 8.710 -1.624 -17.361 1.00 73.45 H new ATOM 0 HA SER A 2 8.861 -2.678 -20.075 1.00 65.34 H new ATOM 0 HB2 SER A 2 10.880 -2.206 -18.634 1.00 34.30 H new ATOM 0 HB3 SER A 2 10.349 -3.455 -17.525 1.00 34.30 H new ATOM 0 HG SER A 2 11.755 -3.729 -19.811 1.00 11.50 H new ATOM 21 N MET A 3 7.847 -4.965 -19.838 1.00 62.21 N ATOM 22 CA MET A 3 7.194 -6.288 -19.776 1.00 2.01 C ATOM 23 C MET A 3 8.150 -7.346 -19.197 1.00 3.11 C ATOM 24 O MET A 3 7.734 -8.461 -18.881 1.00 33.23 O ATOM 25 CB MET A 3 6.715 -6.705 -21.193 1.00 12.22 C ATOM 26 CG MET A 3 5.637 -5.786 -21.787 1.00 5.05 C ATOM 27 SD MET A 3 5.212 -6.204 -23.492 1.00 32.22 S ATOM 28 CE MET A 3 4.665 -7.905 -23.330 1.00 51.24 C ATOM 0 H MET A 3 8.148 -4.704 -20.777 1.00 62.21 H new ATOM 0 HA MET A 3 6.330 -6.219 -19.114 1.00 2.01 H new ATOM 0 HB2 MET A 3 7.573 -6.721 -21.865 1.00 12.22 H new ATOM 0 HB3 MET A 3 6.326 -7.722 -21.148 1.00 12.22 H new ATOM 0 HG2 MET A 3 4.740 -5.843 -21.171 1.00 5.05 H new ATOM 0 HG3 MET A 3 5.986 -4.754 -21.748 1.00 5.05 H new ATOM 0 HE1 MET A 3 4.146 -8.208 -24.239 1.00 51.24 H new ATOM 0 HE2 MET A 3 5.528 -8.551 -23.172 1.00 51.24 H new ATOM 0 HE3 MET A 3 3.988 -7.990 -22.480 1.00 51.24 H new ATOM 38 N GLN A 4 9.436 -6.966 -19.072 1.00 13.04 N ATOM 39 CA GLN A 4 10.495 -7.810 -18.498 1.00 43.51 C ATOM 40 C GLN A 4 10.417 -7.799 -16.961 1.00 63.51 C ATOM 41 O GLN A 4 9.597 -7.078 -16.372 1.00 70.13 O ATOM 42 CB GLN A 4 11.876 -7.280 -18.975 1.00 10.42 C ATOM 43 CG GLN A 4 12.026 -7.204 -20.509 1.00 4.24 C ATOM 44 CD GLN A 4 13.281 -6.454 -20.990 1.00 60.23 C ATOM 45 OE1 GLN A 4 13.844 -6.779 -22.035 1.00 4.13 O ATOM 46 NE2 GLN A 4 13.696 -5.418 -20.268 1.00 45.11 N ATOM 0 H GLN A 4 9.771 -6.050 -19.372 1.00 13.04 H new ATOM 0 HA GLN A 4 10.364 -8.838 -18.834 1.00 43.51 H new ATOM 0 HB2 GLN A 4 12.037 -6.287 -18.555 1.00 10.42 H new ATOM 0 HB3 GLN A 4 12.658 -7.925 -18.576 1.00 10.42 H new ATOM 0 HG2 GLN A 4 12.047 -8.217 -20.910 1.00 4.24 H new ATOM 0 HG3 GLN A 4 11.144 -6.715 -20.924 1.00 4.24 H new ATOM 0 HE21 GLN A 4 13.211 -5.170 -19.406 1.00 45.11 H new ATOM 0 HE22 GLN A 4 14.500 -4.871 -20.576 1.00 45.11 H new ATOM 55 N ASN A 5 11.286 -8.601 -16.326 1.00 50.12 N ATOM 56 CA ASN A 5 11.413 -8.650 -14.857 1.00 42.21 C ATOM 57 C ASN A 5 11.830 -7.265 -14.304 1.00 13.15 C ATOM 58 O ASN A 5 12.839 -6.691 -14.737 1.00 32.31 O ATOM 59 CB ASN A 5 12.429 -9.753 -14.429 1.00 2.23 C ATOM 60 CG ASN A 5 13.857 -9.579 -14.991 1.00 74.33 C ATOM 61 OD1 ASN A 5 14.058 -9.103 -16.112 1.00 64.20 O ATOM 62 ND2 ASN A 5 14.858 -9.934 -14.202 1.00 62.52 N ATOM 0 H ASN A 5 11.920 -9.234 -16.814 1.00 50.12 H new ATOM 0 HA ASN A 5 10.442 -8.906 -14.433 1.00 42.21 H new ATOM 0 HB2 ASN A 5 12.483 -9.773 -13.341 1.00 2.23 H new ATOM 0 HB3 ASN A 5 12.045 -10.722 -14.747 1.00 2.23 H new ATOM 0 HD21 ASN A 5 15.821 -9.816 -14.516 1.00 62.52 H new ATOM 0 HD22 ASN A 5 14.666 -10.325 -13.280 1.00 62.52 H new ATOM 69 N THR A 6 11.021 -6.725 -13.375 1.00 11.21 N ATOM 70 CA THR A 6 11.247 -5.404 -12.768 1.00 33.45 C ATOM 71 C THR A 6 12.437 -5.452 -11.779 1.00 74.21 C ATOM 72 O THR A 6 12.268 -5.668 -10.575 1.00 13.24 O ATOM 73 CB THR A 6 9.937 -4.878 -12.071 1.00 64.23 C ATOM 74 OG1 THR A 6 9.358 -5.913 -11.253 1.00 11.32 O ATOM 75 CG2 THR A 6 8.893 -4.388 -13.092 1.00 43.30 C ATOM 0 H THR A 6 10.188 -7.197 -13.023 1.00 11.21 H new ATOM 0 HA THR A 6 11.504 -4.700 -13.560 1.00 33.45 H new ATOM 0 HB THR A 6 10.223 -4.029 -11.450 1.00 64.23 H new ATOM 0 HG1 THR A 6 10.044 -6.283 -10.659 1.00 11.32 H new ATOM 0 HG21 THR A 6 8.007 -4.035 -12.565 1.00 43.30 H new ATOM 0 HG22 THR A 6 9.314 -3.573 -13.681 1.00 43.30 H new ATOM 0 HG23 THR A 6 8.618 -5.209 -13.754 1.00 43.30 H new ATOM 83 N THR A 7 13.651 -5.314 -12.341 1.00 10.11 N ATOM 84 CA THR A 7 14.903 -5.259 -11.577 1.00 54.25 C ATOM 85 C THR A 7 15.266 -3.788 -11.340 1.00 33.22 C ATOM 86 O THR A 7 15.538 -3.376 -10.219 1.00 33.02 O ATOM 87 CB THR A 7 16.054 -5.991 -12.347 1.00 1.41 C ATOM 88 OG1 THR A 7 15.604 -7.293 -12.757 1.00 32.11 O ATOM 89 CG2 THR A 7 17.329 -6.141 -11.490 1.00 63.44 C ATOM 0 H THR A 7 13.788 -5.237 -13.349 1.00 10.11 H new ATOM 0 HA THR A 7 14.771 -5.766 -10.621 1.00 54.25 H new ATOM 0 HB THR A 7 16.307 -5.381 -13.214 1.00 1.41 H new ATOM 0 HG1 THR A 7 16.323 -7.751 -13.240 1.00 32.11 H new ATOM 0 HG21 THR A 7 18.097 -6.654 -12.068 1.00 63.44 H new ATOM 0 HG22 THR A 7 17.691 -5.154 -11.201 1.00 63.44 H new ATOM 0 HG23 THR A 7 17.100 -6.720 -10.595 1.00 63.44 H new ATOM 97 N HIS A 8 15.250 -3.000 -12.430 1.00 34.44 N ATOM 98 CA HIS A 8 15.405 -1.538 -12.391 1.00 5.11 C ATOM 99 C HIS A 8 14.531 -0.927 -13.504 1.00 51.33 C ATOM 100 O HIS A 8 14.995 -0.545 -14.577 1.00 71.45 O ATOM 101 CB HIS A 8 16.897 -1.094 -12.473 1.00 52.22 C ATOM 102 CG HIS A 8 17.649 -1.502 -13.717 1.00 42.14 C ATOM 103 ND1 HIS A 8 17.874 -0.639 -14.776 1.00 44.13 N ATOM 104 CD2 HIS A 8 18.227 -2.671 -14.071 1.00 2.42 C ATOM 105 CE1 HIS A 8 18.550 -1.262 -15.713 1.00 54.23 C ATOM 106 NE2 HIS A 8 18.779 -2.495 -15.317 1.00 31.33 N ATOM 0 H HIS A 8 15.127 -3.367 -13.374 1.00 34.44 H new ATOM 0 HA HIS A 8 15.062 -1.162 -11.427 1.00 5.11 H new ATOM 0 HB2 HIS A 8 16.936 -0.008 -12.391 1.00 52.22 H new ATOM 0 HB3 HIS A 8 17.422 -1.498 -11.608 1.00 52.22 H new ATOM 0 HD2 HIS A 8 18.251 -3.577 -13.483 1.00 2.42 H new ATOM 0 HE1 HIS A 8 18.866 -0.833 -16.653 1.00 54.23 H new ATOM 0 HE2 HIS A 8 19.284 -3.205 -15.848 1.00 31.33 H new ATOM 115 N ASP A 9 13.233 -0.918 -13.241 1.00 24.42 N ATOM 116 CA ASP A 9 12.195 -0.414 -14.157 1.00 22.21 C ATOM 117 C ASP A 9 11.184 0.353 -13.316 1.00 33.52 C ATOM 118 O ASP A 9 10.844 1.511 -13.590 1.00 40.33 O ATOM 119 CB ASP A 9 11.525 -1.591 -14.908 1.00 13.02 C ATOM 120 CG ASP A 9 10.256 -1.170 -15.650 1.00 40.33 C ATOM 121 OD1 ASP A 9 10.340 -0.368 -16.605 1.00 34.21 O ATOM 122 OD2 ASP A 9 9.157 -1.623 -15.273 1.00 61.33 O ATOM 0 H ASP A 9 12.852 -1.269 -12.362 1.00 24.42 H new ATOM 0 HA ASP A 9 12.625 0.243 -14.913 1.00 22.21 H new ATOM 0 HB2 ASP A 9 12.234 -2.013 -15.620 1.00 13.02 H new ATOM 0 HB3 ASP A 9 11.280 -2.379 -14.196 1.00 13.02 H new ATOM 127 N ASN A 10 10.734 -0.333 -12.274 1.00 2.02 N ATOM 128 CA ASN A 10 10.091 0.287 -11.129 1.00 33.43 C ATOM 129 C ASN A 10 11.190 0.926 -10.257 1.00 25.14 C ATOM 130 O ASN A 10 12.378 0.579 -10.380 1.00 14.34 O ATOM 131 CB ASN A 10 9.296 -0.780 -10.321 1.00 12.33 C ATOM 132 CG ASN A 10 10.161 -1.931 -9.752 1.00 31.40 C ATOM 133 OD1 ASN A 10 11.230 -2.263 -10.284 1.00 62.43 O ATOM 134 ND2 ASN A 10 9.680 -2.592 -8.714 1.00 54.12 N ATOM 0 H ASN A 10 10.807 -1.348 -12.202 1.00 2.02 H new ATOM 0 HA ASN A 10 9.385 1.051 -11.453 1.00 33.43 H new ATOM 0 HB2 ASN A 10 8.784 -0.285 -9.496 1.00 12.33 H new ATOM 0 HB3 ASN A 10 8.526 -1.205 -10.965 1.00 12.33 H new ATOM 0 HD21 ASN A 10 10.190 -3.391 -8.337 1.00 54.12 H new ATOM 0 HD22 ASN A 10 8.798 -2.304 -8.290 1.00 54.12 H new ATOM 141 N VAL A 11 10.796 1.861 -9.400 1.00 4.11 N ATOM 142 CA VAL A 11 11.703 2.532 -8.456 1.00 3.31 C ATOM 143 C VAL A 11 11.090 2.427 -7.075 1.00 60.04 C ATOM 144 O VAL A 11 9.859 2.407 -6.932 1.00 61.41 O ATOM 145 CB VAL A 11 12.002 4.044 -8.814 1.00 11.41 C ATOM 146 CG1 VAL A 11 12.779 4.154 -10.144 1.00 13.33 C ATOM 147 CG2 VAL A 11 10.715 4.908 -8.847 1.00 3.12 C ATOM 0 H VAL A 11 9.830 2.183 -9.335 1.00 4.11 H new ATOM 0 HA VAL A 11 12.670 2.032 -8.507 1.00 3.31 H new ATOM 0 HB VAL A 11 12.629 4.442 -8.016 1.00 11.41 H new ATOM 0 HG11 VAL A 11 12.972 5.203 -10.367 1.00 13.33 H new ATOM 0 HG12 VAL A 11 13.726 3.622 -10.057 1.00 13.33 H new ATOM 0 HG13 VAL A 11 12.188 3.715 -10.948 1.00 13.33 H new ATOM 0 HG21 VAL A 11 10.974 5.937 -9.097 1.00 3.12 H new ATOM 0 HG22 VAL A 11 10.031 4.513 -9.598 1.00 3.12 H new ATOM 0 HG23 VAL A 11 10.234 4.882 -7.869 1.00 3.12 H new ATOM 157 N ILE A 12 11.949 2.344 -6.063 1.00 12.32 N ATOM 158 CA ILE A 12 11.532 2.106 -4.688 1.00 4.43 C ATOM 159 C ILE A 12 11.444 3.458 -3.968 1.00 55.10 C ATOM 160 O ILE A 12 12.409 3.930 -3.371 1.00 20.43 O ATOM 161 CB ILE A 12 12.555 1.133 -3.987 1.00 44.54 C ATOM 162 CG1 ILE A 12 12.799 -0.155 -4.826 1.00 34.25 C ATOM 163 CG2 ILE A 12 12.099 0.750 -2.584 1.00 13.24 C ATOM 164 CD1 ILE A 12 11.626 -1.109 -4.951 1.00 2.32 C ATOM 0 H ILE A 12 12.958 2.441 -6.176 1.00 12.32 H new ATOM 0 HA ILE A 12 10.552 1.629 -4.654 1.00 4.43 H new ATOM 0 HB ILE A 12 13.494 1.681 -3.912 1.00 44.54 H new ATOM 0 HG12 ILE A 12 13.106 0.143 -5.829 1.00 34.25 H new ATOM 0 HG13 ILE A 12 13.635 -0.697 -4.385 1.00 34.25 H new ATOM 0 HG21 ILE A 12 12.831 0.079 -2.134 1.00 13.24 H new ATOM 0 HG22 ILE A 12 12.007 1.648 -1.973 1.00 13.24 H new ATOM 0 HG23 ILE A 12 11.133 0.249 -2.640 1.00 13.24 H new ATOM 0 HD11 ILE A 12 11.918 -1.967 -5.557 1.00 2.32 H new ATOM 0 HD12 ILE A 12 11.327 -1.450 -3.960 1.00 2.32 H new ATOM 0 HD13 ILE A 12 10.789 -0.597 -5.426 1.00 2.32 H new ATOM 176 N LEU A 13 10.283 4.106 -4.075 1.00 35.01 N ATOM 177 CA LEU A 13 10.052 5.406 -3.446 1.00 23.01 C ATOM 178 C LEU A 13 9.550 5.184 -2.034 1.00 74.24 C ATOM 179 O LEU A 13 8.343 5.056 -1.813 1.00 61.34 O ATOM 180 CB LEU A 13 9.034 6.245 -4.258 1.00 72.13 C ATOM 181 CG LEU A 13 9.432 6.550 -5.724 1.00 44.12 C ATOM 182 CD1 LEU A 13 8.368 7.420 -6.413 1.00 31.34 C ATOM 183 CD2 LEU A 13 10.834 7.193 -5.808 1.00 22.22 C ATOM 0 H LEU A 13 9.483 3.748 -4.596 1.00 35.01 H new ATOM 0 HA LEU A 13 10.989 5.963 -3.421 1.00 23.01 H new ATOM 0 HB2 LEU A 13 8.079 5.719 -4.262 1.00 72.13 H new ATOM 0 HB3 LEU A 13 8.875 7.191 -3.740 1.00 72.13 H new ATOM 0 HG LEU A 13 9.482 5.602 -6.260 1.00 44.12 H new ATOM 0 HD11 LEU A 13 8.671 7.620 -7.441 1.00 31.34 H new ATOM 0 HD12 LEU A 13 7.413 6.895 -6.412 1.00 31.34 H new ATOM 0 HD13 LEU A 13 8.265 8.363 -5.875 1.00 31.34 H new ATOM 0 HD21 LEU A 13 11.081 7.393 -6.851 1.00 22.22 H new ATOM 0 HD22 LEU A 13 10.840 8.128 -5.248 1.00 22.22 H new ATOM 0 HD23 LEU A 13 11.573 6.512 -5.385 1.00 22.22 H new ATOM 195 N GLU A 14 10.481 5.088 -1.079 1.00 64.20 N ATOM 196 CA GLU A 14 10.097 4.859 0.312 1.00 1.23 C ATOM 197 C GLU A 14 9.902 6.194 0.986 1.00 3.32 C ATOM 198 O GLU A 14 10.630 7.149 0.730 1.00 72.23 O ATOM 199 CB GLU A 14 11.102 3.999 1.106 1.00 11.20 C ATOM 200 CG GLU A 14 12.467 4.629 1.419 1.00 4.42 C ATOM 201 CD GLU A 14 13.237 3.865 2.508 1.00 14.45 C ATOM 202 OE1 GLU A 14 13.970 2.913 2.183 1.00 54.50 O ATOM 203 OE2 GLU A 14 13.090 4.201 3.705 1.00 60.02 O ATOM 0 H GLU A 14 11.485 5.164 -1.241 1.00 64.20 H new ATOM 0 HA GLU A 14 9.169 4.287 0.301 1.00 1.23 H new ATOM 0 HB2 GLU A 14 10.635 3.718 2.050 1.00 11.20 H new ATOM 0 HB3 GLU A 14 11.274 3.078 0.548 1.00 11.20 H new ATOM 0 HG2 GLU A 14 13.066 4.659 0.509 1.00 4.42 H new ATOM 0 HG3 GLU A 14 12.322 5.661 1.739 1.00 4.42 H new ATOM 210 N LEU A 15 8.895 6.266 1.824 1.00 65.34 N ATOM 211 CA LEU A 15 8.633 7.439 2.630 1.00 53.52 C ATOM 212 C LEU A 15 8.294 6.975 4.041 1.00 12.31 C ATOM 213 O LEU A 15 7.457 6.085 4.244 1.00 43.41 O ATOM 214 CB LEU A 15 7.542 8.344 1.957 1.00 73.02 C ATOM 215 CG LEU A 15 6.489 7.625 1.050 1.00 11.30 C ATOM 216 CD1 LEU A 15 5.443 6.853 1.873 1.00 63.33 C ATOM 217 CD2 LEU A 15 5.830 8.610 0.061 1.00 64.21 C ATOM 0 H LEU A 15 8.228 5.508 1.968 1.00 65.34 H new ATOM 0 HA LEU A 15 9.511 8.081 2.701 1.00 53.52 H new ATOM 0 HB2 LEU A 15 7.006 8.873 2.745 1.00 73.02 H new ATOM 0 HB3 LEU A 15 8.050 9.098 1.355 1.00 73.02 H new ATOM 0 HG LEU A 15 7.029 6.884 0.461 1.00 11.30 H new ATOM 0 HD11 LEU A 15 4.734 6.371 1.200 1.00 63.33 H new ATOM 0 HD12 LEU A 15 5.942 6.096 2.477 1.00 63.33 H new ATOM 0 HD13 LEU A 15 4.911 7.545 2.526 1.00 63.33 H new ATOM 0 HD21 LEU A 15 5.104 8.078 -0.553 1.00 64.21 H new ATOM 0 HD22 LEU A 15 5.325 9.400 0.617 1.00 64.21 H new ATOM 0 HD23 LEU A 15 6.595 9.049 -0.580 1.00 64.21 H new ATOM 229 N THR A 16 9.015 7.550 4.992 1.00 35.22 N ATOM 230 CA THR A 16 8.855 7.277 6.398 1.00 41.44 C ATOM 231 C THR A 16 7.776 8.206 6.908 1.00 70.34 C ATOM 232 O THR A 16 7.942 9.424 6.863 1.00 24.13 O ATOM 233 CB THR A 16 10.184 7.518 7.174 1.00 12.42 C ATOM 234 OG1 THR A 16 11.217 6.680 6.638 1.00 21.05 O ATOM 235 CG2 THR A 16 10.004 7.239 8.673 1.00 63.54 C ATOM 0 H THR A 16 9.744 8.236 4.794 1.00 35.22 H new ATOM 0 HA THR A 16 8.582 6.233 6.551 1.00 41.44 H new ATOM 0 HB THR A 16 10.468 8.564 7.055 1.00 12.42 H new ATOM 0 HG1 THR A 16 12.051 6.835 7.128 1.00 21.05 H new ATOM 0 HG21 THR A 16 10.947 7.415 9.192 1.00 63.54 H new ATOM 0 HG22 THR A 16 9.238 7.901 9.077 1.00 63.54 H new ATOM 0 HG23 THR A 16 9.699 6.202 8.816 1.00 63.54 H new ATOM 243 N VAL A 17 6.642 7.637 7.310 1.00 63.32 N ATOM 244 CA VAL A 17 5.480 8.398 7.749 1.00 43.14 C ATOM 245 C VAL A 17 5.082 7.957 9.155 1.00 24.43 C ATOM 246 O VAL A 17 5.300 6.807 9.535 1.00 64.32 O ATOM 247 CB VAL A 17 4.265 8.215 6.753 1.00 52.11 C ATOM 248 CG1 VAL A 17 4.723 8.276 5.269 1.00 42.40 C ATOM 249 CG2 VAL A 17 3.426 6.934 7.030 1.00 41.42 C ATOM 0 H VAL A 17 6.505 6.627 7.340 1.00 63.32 H new ATOM 0 HA VAL A 17 5.744 9.456 7.760 1.00 43.14 H new ATOM 0 HB VAL A 17 3.603 9.060 6.939 1.00 52.11 H new ATOM 0 HG11 VAL A 17 3.860 8.146 4.616 1.00 42.40 H new ATOM 0 HG12 VAL A 17 5.186 9.243 5.071 1.00 42.40 H new ATOM 0 HG13 VAL A 17 5.445 7.482 5.078 1.00 42.40 H new ATOM 0 HG21 VAL A 17 2.610 6.871 6.311 1.00 41.42 H new ATOM 0 HG22 VAL A 17 4.063 6.054 6.934 1.00 41.42 H new ATOM 0 HG23 VAL A 17 3.017 6.978 8.040 1.00 41.42 H new ATOM 259 N ARG A 18 4.508 8.878 9.920 1.00 52.24 N ATOM 260 CA ARG A 18 3.815 8.555 11.173 1.00 31.54 C ATOM 261 C ARG A 18 2.312 8.491 10.855 1.00 63.00 C ATOM 262 O ARG A 18 1.829 9.279 10.026 1.00 12.22 O ATOM 263 CB ARG A 18 4.166 9.587 12.282 1.00 11.04 C ATOM 264 CG ARG A 18 4.021 11.068 11.871 1.00 43.24 C ATOM 265 CD ARG A 18 4.542 12.036 12.946 1.00 41.41 C ATOM 266 NE ARG A 18 3.819 11.907 14.226 1.00 11.02 N ATOM 267 CZ ARG A 18 3.300 12.923 14.941 1.00 32.31 C ATOM 268 NH1 ARG A 18 3.408 14.183 14.521 1.00 12.55 N ATOM 269 NH2 ARG A 18 2.695 12.667 16.089 1.00 10.23 N ATOM 0 H ARG A 18 4.507 9.873 9.694 1.00 52.24 H new ATOM 0 HA ARG A 18 4.135 7.592 11.570 1.00 31.54 H new ATOM 0 HB2 ARG A 18 3.526 9.401 13.144 1.00 11.04 H new ATOM 0 HB3 ARG A 18 5.193 9.415 12.604 1.00 11.04 H new ATOM 0 HG2 ARG A 18 4.564 11.238 10.941 1.00 43.24 H new ATOM 0 HG3 ARG A 18 2.972 11.284 11.671 1.00 43.24 H new ATOM 0 HD2 ARG A 18 5.603 11.851 13.112 1.00 41.41 H new ATOM 0 HD3 ARG A 18 4.450 13.060 12.583 1.00 41.41 H new ATOM 0 HE ARG A 18 3.702 10.966 14.602 1.00 11.02 H new ATOM 0 HH11 ARG A 18 3.890 14.389 13.646 1.00 12.55 H new ATOM 0 HH12 ARG A 18 3.009 14.941 15.075 1.00 12.55 H new ATOM 0 HH21 ARG A 18 2.625 11.707 16.425 1.00 10.23 H new ATOM 0 HH22 ARG A 18 2.299 13.430 16.638 1.00 10.23 H new ATOM 283 N ASN A 19 1.602 7.542 11.492 1.00 71.34 N ATOM 284 CA ASN A 19 0.255 7.108 11.074 1.00 0.55 C ATOM 285 C ASN A 19 -0.804 8.206 11.342 1.00 12.30 C ATOM 286 O ASN A 19 -1.422 8.276 12.413 1.00 32.43 O ATOM 287 CB ASN A 19 -0.124 5.747 11.750 1.00 71.42 C ATOM 288 CG ASN A 19 -1.308 5.025 11.070 1.00 63.55 C ATOM 289 OD1 ASN A 19 -2.181 5.651 10.484 1.00 22.33 O ATOM 290 ND2 ASN A 19 -1.336 3.698 11.133 1.00 45.42 N ATOM 0 H ASN A 19 1.948 7.051 12.316 1.00 71.34 H new ATOM 0 HA ASN A 19 0.271 6.945 9.996 1.00 0.55 H new ATOM 0 HB2 ASN A 19 0.746 5.090 11.738 1.00 71.42 H new ATOM 0 HB3 ASN A 19 -0.372 5.928 12.796 1.00 71.42 H new ATOM 0 HD21 ASN A 19 -2.095 3.182 10.688 1.00 45.42 H new ATOM 0 HD22 ASN A 19 -0.598 3.195 11.626 1.00 45.42 H new ATOM 297 N HIS A 20 -0.911 9.105 10.355 1.00 32.53 N ATOM 298 CA HIS A 20 -1.975 10.117 10.226 1.00 63.23 C ATOM 299 C HIS A 20 -3.140 9.539 9.383 1.00 1.13 C ATOM 300 O HIS A 20 -2.946 8.524 8.700 1.00 72.14 O ATOM 301 CB HIS A 20 -1.390 11.408 9.568 1.00 53.53 C ATOM 302 CG HIS A 20 -0.588 12.264 10.508 1.00 11.23 C ATOM 303 ND1 HIS A 20 -1.147 13.271 11.260 1.00 20.21 N ATOM 304 CD2 HIS A 20 0.723 12.243 10.832 1.00 64.32 C ATOM 305 CE1 HIS A 20 -0.217 13.831 12.005 1.00 1.43 C ATOM 306 NE2 HIS A 20 0.930 13.226 11.767 1.00 74.45 N ATOM 0 H HIS A 20 -0.234 9.152 9.593 1.00 32.53 H new ATOM 0 HA HIS A 20 -2.362 10.379 11.211 1.00 63.23 H new ATOM 0 HB2 HIS A 20 -0.759 11.121 8.727 1.00 53.53 H new ATOM 0 HB3 HIS A 20 -2.210 12.001 9.163 1.00 53.53 H new ATOM 0 HD2 HIS A 20 1.471 11.576 10.429 1.00 64.32 H new ATOM 0 HE1 HIS A 20 -0.368 14.648 12.695 1.00 1.43 H new ATOM 0 HE2 HIS A 20 1.823 13.451 12.205 1.00 74.45 H new ATOM 315 N PRO A 21 -4.381 10.151 9.452 1.00 72.42 N ATOM 316 CA PRO A 21 -5.559 9.708 8.653 1.00 75.50 C ATOM 317 C PRO A 21 -5.251 9.437 7.157 1.00 54.51 C ATOM 318 O PRO A 21 -5.121 10.369 6.349 1.00 51.53 O ATOM 319 CB PRO A 21 -6.552 10.879 8.842 1.00 61.01 C ATOM 320 CG PRO A 21 -6.252 11.401 10.215 1.00 21.54 C ATOM 321 CD PRO A 21 -4.751 11.273 10.370 1.00 45.40 C ATOM 0 HA PRO A 21 -5.939 8.743 8.989 1.00 75.50 H new ATOM 0 HB2 PRO A 21 -6.408 11.649 8.084 1.00 61.01 H new ATOM 0 HB3 PRO A 21 -7.585 10.541 8.762 1.00 61.01 H new ATOM 0 HG2 PRO A 21 -6.572 12.438 10.321 1.00 21.54 H new ATOM 0 HG3 PRO A 21 -6.777 10.826 10.978 1.00 21.54 H new ATOM 0 HD2 PRO A 21 -4.242 12.197 10.095 1.00 45.40 H new ATOM 0 HD3 PRO A 21 -4.475 11.052 11.401 1.00 45.40 H new ATOM 329 N GLY A 22 -5.087 8.129 6.844 1.00 34.12 N ATOM 330 CA GLY A 22 -4.864 7.641 5.484 1.00 4.43 C ATOM 331 C GLY A 22 -3.669 8.276 4.780 1.00 60.51 C ATOM 332 O GLY A 22 -3.839 8.902 3.730 1.00 70.55 O ATOM 0 H GLY A 22 -5.108 7.386 7.543 1.00 34.12 H new ATOM 0 HA2 GLY A 22 -4.720 6.561 5.516 1.00 4.43 H new ATOM 0 HA3 GLY A 22 -5.760 7.826 4.892 1.00 4.43 H new ATOM 336 N VAL A 23 -2.461 8.140 5.360 1.00 1.33 N ATOM 337 CA VAL A 23 -1.225 8.666 4.732 1.00 20.21 C ATOM 338 C VAL A 23 -0.953 7.936 3.409 1.00 31.53 C ATOM 339 O VAL A 23 -0.626 8.545 2.400 1.00 1.55 O ATOM 340 CB VAL A 23 0.050 8.513 5.633 1.00 53.41 C ATOM 341 CG1 VAL A 23 1.237 9.271 5.005 1.00 64.43 C ATOM 342 CG2 VAL A 23 -0.203 8.977 7.070 1.00 1.31 C ATOM 0 H VAL A 23 -2.311 7.675 6.255 1.00 1.33 H new ATOM 0 HA VAL A 23 -1.404 9.730 4.576 1.00 20.21 H new ATOM 0 HB VAL A 23 0.298 7.453 5.684 1.00 53.41 H new ATOM 0 HG11 VAL A 23 2.117 9.158 5.638 1.00 64.43 H new ATOM 0 HG12 VAL A 23 1.447 8.863 4.016 1.00 64.43 H new ATOM 0 HG13 VAL A 23 0.987 10.328 4.916 1.00 64.43 H new ATOM 0 HG21 VAL A 23 0.707 8.853 7.658 1.00 1.31 H new ATOM 0 HG22 VAL A 23 -0.493 10.028 7.067 1.00 1.31 H new ATOM 0 HG23 VAL A 23 -1.003 8.381 7.509 1.00 1.31 H new ATOM 352 N MET A 24 -1.100 6.609 3.459 1.00 15.22 N ATOM 353 CA MET A 24 -0.952 5.719 2.297 1.00 53.51 C ATOM 354 C MET A 24 -1.957 6.072 1.158 1.00 42.34 C ATOM 355 O MET A 24 -1.674 5.814 -0.027 1.00 35.10 O ATOM 356 CB MET A 24 -1.032 4.234 2.742 1.00 1.12 C ATOM 357 CG MET A 24 -2.300 3.838 3.506 1.00 41.41 C ATOM 358 SD MET A 24 -2.476 4.630 5.132 1.00 51.23 S ATOM 359 CE MET A 24 -1.086 3.946 6.036 1.00 72.22 C ATOM 0 H MET A 24 -1.329 6.112 4.320 1.00 15.22 H new ATOM 0 HA MET A 24 0.037 5.875 1.867 1.00 53.51 H new ATOM 0 HB2 MET A 24 -0.951 3.603 1.857 1.00 1.12 H new ATOM 0 HB3 MET A 24 -0.168 4.015 3.369 1.00 1.12 H new ATOM 0 HG2 MET A 24 -3.169 4.088 2.898 1.00 41.41 H new ATOM 0 HG3 MET A 24 -2.306 2.756 3.640 1.00 41.41 H new ATOM 0 HE1 MET A 24 -1.202 4.160 7.098 1.00 72.22 H new ATOM 0 HE2 MET A 24 -1.049 2.867 5.885 1.00 72.22 H new ATOM 0 HE3 MET A 24 -0.161 4.395 5.675 1.00 72.22 H new ATOM 369 N THR A 25 -3.118 6.674 1.517 1.00 43.34 N ATOM 370 CA THR A 25 -4.060 7.245 0.528 1.00 73.24 C ATOM 371 C THR A 25 -3.383 8.426 -0.220 1.00 44.05 C ATOM 372 O THR A 25 -3.497 8.535 -1.449 1.00 14.45 O ATOM 373 CB THR A 25 -5.385 7.748 1.204 1.00 61.41 C ATOM 374 OG1 THR A 25 -5.852 6.785 2.155 1.00 11.22 O ATOM 375 CG2 THR A 25 -6.506 8.015 0.178 1.00 3.12 C ATOM 0 H THR A 25 -3.423 6.776 2.485 1.00 43.34 H new ATOM 0 HA THR A 25 -4.320 6.453 -0.175 1.00 73.24 H new ATOM 0 HB THR A 25 -5.145 8.689 1.699 1.00 61.41 H new ATOM 0 HG1 THR A 25 -5.229 6.030 2.189 1.00 11.22 H new ATOM 0 HG21 THR A 25 -7.400 8.361 0.697 1.00 3.12 H new ATOM 0 HG22 THR A 25 -6.179 8.778 -0.528 1.00 3.12 H new ATOM 0 HG23 THR A 25 -6.732 7.095 -0.361 1.00 3.12 H new ATOM 383 N HIS A 26 -2.658 9.284 0.544 1.00 52.22 N ATOM 384 CA HIS A 26 -1.941 10.470 -0.001 1.00 32.40 C ATOM 385 C HIS A 26 -0.853 10.020 -0.994 1.00 25.14 C ATOM 386 O HIS A 26 -0.743 10.569 -2.098 1.00 23.55 O ATOM 387 CB HIS A 26 -1.250 11.321 1.119 1.00 64.31 C ATOM 388 CG HIS A 26 -2.113 11.748 2.283 1.00 74.01 C ATOM 389 ND1 HIS A 26 -1.582 12.323 3.419 1.00 62.15 N ATOM 390 CD2 HIS A 26 -3.449 11.669 2.505 1.00 75.22 C ATOM 391 CE1 HIS A 26 -2.545 12.573 4.284 1.00 1.04 C ATOM 392 NE2 HIS A 26 -3.687 12.187 3.757 1.00 34.01 N ATOM 0 H HIS A 26 -2.553 9.175 1.553 1.00 52.22 H new ATOM 0 HA HIS A 26 -2.693 11.086 -0.493 1.00 32.40 H new ATOM 0 HB2 HIS A 26 -0.410 10.747 1.512 1.00 64.31 H new ATOM 0 HB3 HIS A 26 -0.836 12.217 0.657 1.00 64.31 H new ATOM 0 HD2 HIS A 26 -4.189 11.273 1.825 1.00 75.22 H new ATOM 0 HE1 HIS A 26 -2.418 13.019 5.259 1.00 1.04 H new ATOM 0 HE2 HIS A 26 -4.601 12.260 4.204 1.00 34.01 H new ATOM 401 N VAL A 27 -0.068 8.995 -0.583 1.00 12.45 N ATOM 402 CA VAL A 27 1.132 8.557 -1.323 1.00 25.43 C ATOM 403 C VAL A 27 0.749 8.004 -2.708 1.00 1.12 C ATOM 404 O VAL A 27 1.313 8.418 -3.739 1.00 74.41 O ATOM 405 CB VAL A 27 2.023 7.535 -0.490 1.00 13.13 C ATOM 406 CG1 VAL A 27 2.200 8.025 0.967 1.00 71.10 C ATOM 407 CG2 VAL A 27 1.501 6.080 -0.515 1.00 10.35 C ATOM 0 H VAL A 27 -0.249 8.455 0.263 1.00 12.45 H new ATOM 0 HA VAL A 27 1.758 9.436 -1.479 1.00 25.43 H new ATOM 0 HB VAL A 27 2.993 7.513 -0.988 1.00 13.13 H new ATOM 0 HG11 VAL A 27 2.812 7.312 1.519 1.00 71.10 H new ATOM 0 HG12 VAL A 27 2.689 8.999 0.966 1.00 71.10 H new ATOM 0 HG13 VAL A 27 1.223 8.110 1.444 1.00 71.10 H new ATOM 0 HG21 VAL A 27 2.163 5.446 0.075 1.00 10.35 H new ATOM 0 HG22 VAL A 27 0.496 6.047 -0.094 1.00 10.35 H new ATOM 0 HG23 VAL A 27 1.476 5.720 -1.544 1.00 10.35 H new ATOM 417 N CYS A 28 -0.285 7.137 -2.733 1.00 52.34 N ATOM 418 CA CYS A 28 -0.791 6.566 -3.982 1.00 31.12 C ATOM 419 C CYS A 28 -1.493 7.639 -4.821 1.00 70.04 C ATOM 420 O CYS A 28 -1.475 7.568 -6.048 1.00 64.24 O ATOM 421 CB CYS A 28 -1.753 5.410 -3.719 1.00 61.01 C ATOM 422 SG CYS A 28 -2.417 4.704 -5.237 1.00 43.45 S ATOM 0 H CYS A 28 -0.780 6.822 -1.899 1.00 52.34 H new ATOM 0 HA CYS A 28 0.066 6.181 -4.534 1.00 31.12 H new ATOM 0 HB2 CYS A 28 -1.236 4.632 -3.157 1.00 61.01 H new ATOM 0 HB3 CYS A 28 -2.575 5.761 -3.096 1.00 61.01 H new ATOM 0 HG CYS A 28 -3.301 5.513 -5.742 1.00 43.45 H new ATOM 428 N GLY A 29 -2.097 8.636 -4.134 1.00 43.31 N ATOM 429 CA GLY A 29 -2.782 9.752 -4.790 1.00 53.31 C ATOM 430 C GLY A 29 -1.865 10.517 -5.740 1.00 63.31 C ATOM 431 O GLY A 29 -2.236 10.773 -6.886 1.00 34.52 O ATOM 0 H GLY A 29 -2.118 8.681 -3.115 1.00 43.31 H new ATOM 0 HA2 GLY A 29 -3.641 9.373 -5.344 1.00 53.31 H new ATOM 0 HA3 GLY A 29 -3.167 10.434 -4.033 1.00 53.31 H new ATOM 435 N LEU A 30 -0.640 10.818 -5.261 1.00 71.11 N ATOM 436 CA LEU A 30 0.391 11.518 -6.052 1.00 43.53 C ATOM 437 C LEU A 30 0.881 10.651 -7.234 1.00 35.51 C ATOM 438 O LEU A 30 0.800 11.061 -8.402 1.00 31.52 O ATOM 439 CB LEU A 30 1.600 11.964 -5.156 1.00 33.05 C ATOM 440 CG LEU A 30 1.456 13.352 -4.440 1.00 23.52 C ATOM 441 CD1 LEU A 30 1.193 14.488 -5.468 1.00 52.23 C ATOM 442 CD2 LEU A 30 0.375 13.324 -3.330 1.00 21.34 C ATOM 0 H LEU A 30 -0.339 10.582 -4.315 1.00 71.11 H new ATOM 0 HA LEU A 30 -0.074 12.415 -6.461 1.00 43.53 H new ATOM 0 HB2 LEU A 30 1.762 11.201 -4.395 1.00 33.05 H new ATOM 0 HB3 LEU A 30 2.495 11.990 -5.777 1.00 33.05 H new ATOM 0 HG LEU A 30 2.405 13.563 -3.948 1.00 23.52 H new ATOM 0 HD11 LEU A 30 1.097 15.439 -4.943 1.00 52.23 H new ATOM 0 HD12 LEU A 30 2.025 14.543 -6.170 1.00 52.23 H new ATOM 0 HD13 LEU A 30 0.272 14.280 -6.012 1.00 52.23 H new ATOM 0 HD21 LEU A 30 0.309 14.306 -2.861 1.00 21.34 H new ATOM 0 HD22 LEU A 30 -0.589 13.066 -3.768 1.00 21.34 H new ATOM 0 HD23 LEU A 30 0.643 12.581 -2.579 1.00 21.34 H new ATOM 454 N PHE A 31 1.365 9.443 -6.920 1.00 31.25 N ATOM 455 CA PHE A 31 2.047 8.575 -7.913 1.00 31.55 C ATOM 456 C PHE A 31 1.093 8.081 -9.026 1.00 12.10 C ATOM 457 O PHE A 31 1.534 7.852 -10.163 1.00 73.41 O ATOM 458 CB PHE A 31 2.772 7.408 -7.190 1.00 23.42 C ATOM 459 CG PHE A 31 3.786 7.895 -6.132 1.00 64.15 C ATOM 460 CD1 PHE A 31 4.597 9.016 -6.369 1.00 43.32 C ATOM 461 CD2 PHE A 31 3.895 7.270 -4.891 1.00 51.21 C ATOM 462 CE1 PHE A 31 5.487 9.474 -5.410 1.00 0.14 C ATOM 463 CE2 PHE A 31 4.785 7.735 -3.931 1.00 23.40 C ATOM 464 CZ PHE A 31 5.573 8.837 -4.188 1.00 71.43 C ATOM 0 H PHE A 31 1.301 9.036 -5.987 1.00 31.25 H new ATOM 0 HA PHE A 31 2.799 9.175 -8.425 1.00 31.55 H new ATOM 0 HB2 PHE A 31 2.031 6.769 -6.709 1.00 23.42 H new ATOM 0 HB3 PHE A 31 3.290 6.796 -7.928 1.00 23.42 H new ATOM 0 HD1 PHE A 31 4.526 9.531 -7.316 1.00 43.32 H new ATOM 0 HD2 PHE A 31 3.278 6.411 -4.672 1.00 51.21 H new ATOM 0 HE1 PHE A 31 6.113 10.329 -5.619 1.00 0.14 H new ATOM 0 HE2 PHE A 31 4.860 7.231 -2.979 1.00 23.40 H new ATOM 0 HZ PHE A 31 6.256 9.201 -3.435 1.00 71.43 H new ATOM 474 N ALA A 32 -0.208 7.959 -8.694 1.00 74.35 N ATOM 475 CA ALA A 32 -1.269 7.578 -9.657 1.00 63.13 C ATOM 476 C ALA A 32 -1.614 8.747 -10.611 1.00 61.25 C ATOM 477 O ALA A 32 -1.643 8.561 -11.838 1.00 33.44 O ATOM 478 CB ALA A 32 -2.531 7.112 -8.910 1.00 54.14 C ATOM 0 H ALA A 32 -0.557 8.122 -7.749 1.00 74.35 H new ATOM 0 HA ALA A 32 -0.888 6.753 -10.260 1.00 63.13 H new ATOM 0 HB1 ALA A 32 -3.300 6.836 -9.632 1.00 54.14 H new ATOM 0 HB2 ALA A 32 -2.289 6.249 -8.290 1.00 54.14 H new ATOM 0 HB3 ALA A 32 -2.899 7.920 -8.279 1.00 54.14 H new ATOM 484 N ARG A 33 -1.843 9.959 -10.032 1.00 72.13 N ATOM 485 CA ARG A 33 -2.273 11.165 -10.808 1.00 33.51 C ATOM 486 C ARG A 33 -1.153 11.693 -11.727 1.00 70.23 C ATOM 487 O ARG A 33 -1.396 12.569 -12.566 1.00 43.14 O ATOM 488 CB ARG A 33 -2.759 12.309 -9.867 1.00 34.33 C ATOM 489 CG ARG A 33 -1.651 12.984 -9.020 1.00 35.31 C ATOM 490 CD ARG A 33 -2.179 14.110 -8.114 1.00 62.30 C ATOM 491 NE ARG A 33 -2.657 15.265 -8.897 1.00 65.15 N ATOM 492 CZ ARG A 33 -3.220 16.382 -8.404 1.00 63.32 C ATOM 493 NH1 ARG A 33 -3.406 16.542 -7.094 1.00 44.14 N ATOM 494 NH2 ARG A 33 -3.589 17.348 -9.236 1.00 13.12 N ATOM 0 H ARG A 33 -1.738 10.130 -9.032 1.00 72.13 H new ATOM 0 HA ARG A 33 -3.106 10.844 -11.433 1.00 33.51 H new ATOM 0 HB2 ARG A 33 -3.247 13.073 -10.473 1.00 34.33 H new ATOM 0 HB3 ARG A 33 -3.515 11.906 -9.193 1.00 34.33 H new ATOM 0 HG2 ARG A 33 -1.164 12.229 -8.403 1.00 35.31 H new ATOM 0 HG3 ARG A 33 -0.890 13.390 -9.687 1.00 35.31 H new ATOM 0 HD2 ARG A 33 -2.992 13.728 -7.496 1.00 62.30 H new ATOM 0 HD3 ARG A 33 -1.388 14.432 -7.437 1.00 62.30 H new ATOM 0 HE ARG A 33 -2.550 15.211 -9.910 1.00 65.15 H new ATOM 0 HH11 ARG A 33 -3.119 15.809 -6.445 1.00 44.14 H new ATOM 0 HH12 ARG A 33 -3.835 17.397 -6.741 1.00 44.14 H new ATOM 0 HH21 ARG A 33 -3.445 17.239 -10.240 1.00 13.12 H new ATOM 0 HH22 ARG A 33 -4.017 18.199 -8.872 1.00 13.12 H new ATOM 508 N ARG A 34 0.064 11.159 -11.537 1.00 2.42 N ATOM 509 CA ARG A 34 1.231 11.480 -12.347 1.00 3.22 C ATOM 510 C ARG A 34 0.983 11.053 -13.803 1.00 24.44 C ATOM 511 O ARG A 34 0.973 11.895 -14.705 1.00 1.44 O ATOM 512 CB ARG A 34 2.469 10.790 -11.697 1.00 1.34 C ATOM 513 CG ARG A 34 3.823 10.882 -12.452 1.00 43.34 C ATOM 514 CD ARG A 34 4.057 9.721 -13.438 1.00 74.24 C ATOM 515 NE ARG A 34 3.858 8.403 -12.797 1.00 73.51 N ATOM 516 CZ ARG A 34 4.455 7.260 -13.167 1.00 14.11 C ATOM 517 NH1 ARG A 34 5.312 7.223 -14.173 1.00 54.22 N ATOM 518 NH2 ARG A 34 4.148 6.147 -12.548 1.00 72.55 N ATOM 0 H ARG A 34 0.259 10.481 -10.801 1.00 2.42 H new ATOM 0 HA ARG A 34 1.423 12.552 -12.377 1.00 3.22 H new ATOM 0 HB2 ARG A 34 2.609 11.217 -10.704 1.00 1.34 H new ATOM 0 HB3 ARG A 34 2.232 9.735 -11.560 1.00 1.34 H new ATOM 0 HG2 ARG A 34 3.863 11.825 -12.997 1.00 43.34 H new ATOM 0 HG3 ARG A 34 4.635 10.900 -11.725 1.00 43.34 H new ATOM 0 HD2 ARG A 34 3.376 9.820 -14.283 1.00 74.24 H new ATOM 0 HD3 ARG A 34 5.070 9.782 -13.836 1.00 74.24 H new ATOM 0 HE ARG A 34 3.213 8.359 -12.008 1.00 73.51 H new ATOM 0 HH11 ARG A 34 5.532 8.076 -14.687 1.00 54.22 H new ATOM 0 HH12 ARG A 34 5.753 6.341 -14.435 1.00 54.22 H new ATOM 0 HH21 ARG A 34 3.462 6.156 -11.794 1.00 72.55 H new ATOM 0 HH22 ARG A 34 4.595 5.272 -12.821 1.00 72.55 H new ATOM 532 N ALA A 35 0.725 9.744 -13.999 1.00 51.14 N ATOM 533 CA ALA A 35 0.464 9.147 -15.324 1.00 24.25 C ATOM 534 C ALA A 35 0.135 7.665 -15.167 1.00 65.40 C ATOM 535 O ALA A 35 -0.964 7.217 -15.506 1.00 63.04 O ATOM 536 CB ALA A 35 1.667 9.319 -16.272 1.00 2.02 C ATOM 0 H ALA A 35 0.692 9.067 -13.237 1.00 51.14 H new ATOM 0 HA ALA A 35 -0.386 9.668 -15.765 1.00 24.25 H new ATOM 0 HB1 ALA A 35 1.437 8.867 -17.237 1.00 2.02 H new ATOM 0 HB2 ALA A 35 1.874 10.380 -16.408 1.00 2.02 H new ATOM 0 HB3 ALA A 35 2.542 8.831 -15.842 1.00 2.02 H new ATOM 542 N PHE A 36 1.110 6.917 -14.638 1.00 24.02 N ATOM 543 CA PHE A 36 0.999 5.465 -14.444 1.00 32.31 C ATOM 544 C PHE A 36 0.765 5.180 -12.955 1.00 13.42 C ATOM 545 O PHE A 36 1.292 5.892 -12.096 1.00 13.11 O ATOM 546 CB PHE A 36 2.287 4.757 -14.951 1.00 51.45 C ATOM 547 CG PHE A 36 2.239 3.222 -14.892 1.00 71.33 C ATOM 548 CD1 PHE A 36 1.388 2.506 -15.736 1.00 55.13 C ATOM 549 CD2 PHE A 36 3.033 2.502 -13.997 1.00 73.02 C ATOM 550 CE1 PHE A 36 1.337 1.124 -15.685 1.00 54.23 C ATOM 551 CE2 PHE A 36 2.982 1.122 -13.947 1.00 14.32 C ATOM 552 CZ PHE A 36 2.132 0.432 -14.790 1.00 23.55 C ATOM 0 H PHE A 36 2.003 7.303 -14.331 1.00 24.02 H new ATOM 0 HA PHE A 36 0.158 5.076 -15.018 1.00 32.31 H new ATOM 0 HB2 PHE A 36 2.472 5.062 -15.981 1.00 51.45 H new ATOM 0 HB3 PHE A 36 3.134 5.104 -14.359 1.00 51.45 H new ATOM 0 HD1 PHE A 36 0.762 3.037 -16.437 1.00 55.13 H new ATOM 0 HD2 PHE A 36 3.698 3.033 -13.332 1.00 73.02 H new ATOM 0 HE1 PHE A 36 0.675 0.585 -16.346 1.00 54.23 H new ATOM 0 HE2 PHE A 36 3.606 0.583 -13.249 1.00 14.32 H new ATOM 0 HZ PHE A 36 2.089 -0.646 -14.750 1.00 23.55 H new ATOM 562 N ASN A 37 -0.004 4.122 -12.675 1.00 62.42 N ATOM 563 CA ASN A 37 -0.389 3.722 -11.308 1.00 61.13 C ATOM 564 C ASN A 37 0.778 3.018 -10.594 1.00 31.41 C ATOM 565 O ASN A 37 1.848 2.807 -11.177 1.00 53.23 O ATOM 566 CB ASN A 37 -1.614 2.774 -11.372 1.00 72.12 C ATOM 567 CG ASN A 37 -2.793 3.352 -12.157 1.00 4.32 C ATOM 568 OD1 ASN A 37 -3.053 4.558 -12.126 1.00 45.13 O ATOM 569 ND2 ASN A 37 -3.501 2.501 -12.888 1.00 32.30 N ATOM 0 H ASN A 37 -0.383 3.509 -13.397 1.00 62.42 H new ATOM 0 HA ASN A 37 -0.646 4.618 -10.743 1.00 61.13 H new ATOM 0 HB2 ASN A 37 -1.311 1.832 -11.829 1.00 72.12 H new ATOM 0 HB3 ASN A 37 -1.940 2.546 -10.357 1.00 72.12 H new ATOM 0 HD21 ASN A 37 -4.286 2.838 -13.446 1.00 32.30 H new ATOM 0 HD22 ASN A 37 -3.261 1.510 -12.892 1.00 32.30 H new ATOM 576 N VAL A 38 0.560 2.647 -9.326 1.00 22.32 N ATOM 577 CA VAL A 38 1.552 1.893 -8.542 1.00 73.32 C ATOM 578 C VAL A 38 1.487 0.396 -8.928 1.00 41.32 C ATOM 579 O VAL A 38 0.398 -0.154 -9.120 1.00 72.52 O ATOM 580 CB VAL A 38 1.330 2.079 -6.989 1.00 4.34 C ATOM 581 CG1 VAL A 38 2.480 1.440 -6.184 1.00 1.43 C ATOM 582 CG2 VAL A 38 1.174 3.572 -6.615 1.00 33.21 C ATOM 0 H VAL A 38 -0.299 2.857 -8.817 1.00 22.32 H new ATOM 0 HA VAL A 38 2.543 2.284 -8.775 1.00 73.32 H new ATOM 0 HB VAL A 38 0.403 1.568 -6.730 1.00 4.34 H new ATOM 0 HG11 VAL A 38 2.301 1.583 -5.118 1.00 1.43 H new ATOM 0 HG12 VAL A 38 2.529 0.374 -6.404 1.00 1.43 H new ATOM 0 HG13 VAL A 38 3.423 1.911 -6.460 1.00 1.43 H new ATOM 0 HG21 VAL A 38 1.023 3.664 -5.539 1.00 33.21 H new ATOM 0 HG22 VAL A 38 2.074 4.115 -6.903 1.00 33.21 H new ATOM 0 HG23 VAL A 38 0.315 3.991 -7.139 1.00 33.21 H new ATOM 592 N GLU A 39 2.667 -0.226 -9.079 1.00 22.13 N ATOM 593 CA GLU A 39 2.818 -1.647 -9.444 1.00 1.03 C ATOM 594 C GLU A 39 2.811 -2.522 -8.176 1.00 72.01 C ATOM 595 O GLU A 39 2.108 -3.547 -8.107 1.00 14.51 O ATOM 596 CB GLU A 39 4.132 -1.803 -10.286 1.00 63.30 C ATOM 597 CG GLU A 39 4.692 -3.247 -10.475 1.00 11.43 C ATOM 598 CD GLU A 39 5.804 -3.618 -9.459 1.00 1.34 C ATOM 599 OE1 GLU A 39 6.934 -3.115 -9.612 1.00 64.30 O ATOM 600 OE2 GLU A 39 5.553 -4.395 -8.511 1.00 31.25 O ATOM 0 H GLU A 39 3.559 0.251 -8.949 1.00 22.13 H new ATOM 0 HA GLU A 39 1.981 -1.986 -10.055 1.00 1.03 H new ATOM 0 HB2 GLU A 39 3.952 -1.379 -11.274 1.00 63.30 H new ATOM 0 HB3 GLU A 39 4.908 -1.199 -9.816 1.00 63.30 H new ATOM 0 HG2 GLU A 39 3.873 -3.961 -10.382 1.00 11.43 H new ATOM 0 HG3 GLU A 39 5.087 -3.345 -11.486 1.00 11.43 H new ATOM 607 N GLY A 40 3.575 -2.079 -7.166 1.00 51.22 N ATOM 608 CA GLY A 40 3.751 -2.818 -5.914 1.00 14.02 C ATOM 609 C GLY A 40 3.912 -1.884 -4.732 1.00 75.01 C ATOM 610 O GLY A 40 4.349 -0.748 -4.894 1.00 15.33 O ATOM 0 H GLY A 40 4.087 -1.197 -7.198 1.00 51.22 H new ATOM 0 HA2 GLY A 40 2.891 -3.468 -5.750 1.00 14.02 H new ATOM 0 HA3 GLY A 40 4.627 -3.462 -5.991 1.00 14.02 H new ATOM 614 N ILE A 41 3.521 -2.339 -3.539 1.00 24.22 N ATOM 615 CA ILE A 41 3.627 -1.556 -2.292 1.00 72.50 C ATOM 616 C ILE A 41 4.161 -2.473 -1.195 1.00 5.54 C ATOM 617 O ILE A 41 3.868 -3.670 -1.173 1.00 15.04 O ATOM 618 CB ILE A 41 2.232 -0.947 -1.825 1.00 25.44 C ATOM 619 CG1 ILE A 41 1.583 -0.084 -2.950 1.00 51.35 C ATOM 620 CG2 ILE A 41 2.378 -0.111 -0.516 1.00 12.30 C ATOM 621 CD1 ILE A 41 0.237 0.522 -2.597 1.00 4.12 C ATOM 0 H ILE A 41 3.118 -3.266 -3.404 1.00 24.22 H new ATOM 0 HA ILE A 41 4.297 -0.717 -2.480 1.00 72.50 H new ATOM 0 HB ILE A 41 1.572 -1.789 -1.616 1.00 25.44 H new ATOM 0 HG12 ILE A 41 2.270 0.721 -3.212 1.00 51.35 H new ATOM 0 HG13 ILE A 41 1.464 -0.703 -3.839 1.00 51.35 H new ATOM 0 HG21 ILE A 41 1.405 0.288 -0.229 1.00 12.30 H new ATOM 0 HG22 ILE A 41 2.759 -0.748 0.282 1.00 12.30 H new ATOM 0 HG23 ILE A 41 3.072 0.712 -0.685 1.00 12.30 H new ATOM 0 HD11 ILE A 41 -0.133 1.103 -3.441 1.00 4.12 H new ATOM 0 HD12 ILE A 41 -0.471 -0.274 -2.366 1.00 4.12 H new ATOM 0 HD13 ILE A 41 0.347 1.172 -1.729 1.00 4.12 H new ATOM 633 N LEU A 42 4.956 -1.906 -0.298 1.00 3.30 N ATOM 634 CA LEU A 42 5.344 -2.557 0.950 1.00 62.24 C ATOM 635 C LEU A 42 5.252 -1.509 2.053 1.00 44.44 C ATOM 636 O LEU A 42 5.693 -0.390 1.870 1.00 32.33 O ATOM 637 CB LEU A 42 6.767 -3.167 0.836 1.00 22.25 C ATOM 638 CG LEU A 42 7.302 -3.908 2.101 1.00 34.31 C ATOM 639 CD1 LEU A 42 6.290 -4.931 2.646 1.00 11.25 C ATOM 640 CD2 LEU A 42 8.661 -4.575 1.812 1.00 54.14 C ATOM 0 H LEU A 42 5.354 -0.974 -0.415 1.00 3.30 H new ATOM 0 HA LEU A 42 4.680 -3.390 1.180 1.00 62.24 H new ATOM 0 HB2 LEU A 42 6.774 -3.867 0.000 1.00 22.25 H new ATOM 0 HB3 LEU A 42 7.464 -2.367 0.587 1.00 22.25 H new ATOM 0 HG LEU A 42 7.445 -3.157 2.878 1.00 34.31 H new ATOM 0 HD11 LEU A 42 6.706 -5.421 3.526 1.00 11.25 H new ATOM 0 HD12 LEU A 42 5.367 -4.420 2.918 1.00 11.25 H new ATOM 0 HD13 LEU A 42 6.079 -5.678 1.880 1.00 11.25 H new ATOM 0 HD21 LEU A 42 9.014 -5.085 2.708 1.00 54.14 H new ATOM 0 HD22 LEU A 42 8.547 -5.298 1.004 1.00 54.14 H new ATOM 0 HD23 LEU A 42 9.385 -3.814 1.519 1.00 54.14 H new ATOM 652 N CYS A 43 4.635 -1.875 3.167 1.00 62.12 N ATOM 653 CA CYS A 43 4.425 -0.991 4.312 1.00 41.44 C ATOM 654 C CYS A 43 4.463 -1.839 5.569 1.00 74.41 C ATOM 655 O CYS A 43 3.718 -2.822 5.678 1.00 41.43 O ATOM 656 CB CYS A 43 3.072 -0.255 4.204 1.00 1.50 C ATOM 657 SG CYS A 43 2.600 0.686 5.678 1.00 14.54 S ATOM 0 H CYS A 43 4.258 -2.812 3.306 1.00 62.12 H new ATOM 0 HA CYS A 43 5.207 -0.232 4.339 1.00 41.44 H new ATOM 0 HB2 CYS A 43 3.111 0.425 3.353 1.00 1.50 H new ATOM 0 HB3 CYS A 43 2.292 -0.987 3.992 1.00 1.50 H new ATOM 0 HG CYS A 43 3.665 0.989 6.359 1.00 14.54 H new ATOM 663 N LEU A 44 5.348 -1.475 6.496 1.00 54.32 N ATOM 664 CA LEU A 44 5.484 -2.170 7.782 1.00 61.40 C ATOM 665 C LEU A 44 5.943 -1.167 8.853 1.00 21.42 C ATOM 666 O LEU A 44 6.750 -0.262 8.551 1.00 23.14 O ATOM 667 CB LEU A 44 6.425 -3.420 7.642 1.00 0.42 C ATOM 668 CG LEU A 44 7.717 -3.250 6.771 1.00 40.15 C ATOM 669 CD1 LEU A 44 8.847 -2.496 7.506 1.00 51.53 C ATOM 670 CD2 LEU A 44 8.207 -4.609 6.225 1.00 1.54 C ATOM 0 H LEU A 44 5.991 -0.692 6.380 1.00 54.32 H new ATOM 0 HA LEU A 44 4.520 -2.565 8.103 1.00 61.40 H new ATOM 0 HB2 LEU A 44 6.730 -3.727 8.642 1.00 0.42 H new ATOM 0 HB3 LEU A 44 5.840 -4.238 7.222 1.00 0.42 H new ATOM 0 HG LEU A 44 7.436 -2.625 5.923 1.00 40.15 H new ATOM 0 HD11 LEU A 44 9.714 -2.411 6.851 1.00 51.53 H new ATOM 0 HD12 LEU A 44 8.501 -1.500 7.781 1.00 51.53 H new ATOM 0 HD13 LEU A 44 9.125 -3.045 8.406 1.00 51.53 H new ATOM 0 HD21 LEU A 44 9.104 -4.458 5.625 1.00 1.54 H new ATOM 0 HD22 LEU A 44 8.435 -5.275 7.057 1.00 1.54 H new ATOM 0 HD23 LEU A 44 7.428 -5.055 5.607 1.00 1.54 H new ATOM 682 N PRO A 45 5.411 -1.285 10.112 1.00 31.52 N ATOM 683 CA PRO A 45 5.709 -0.330 11.182 1.00 24.32 C ATOM 684 C PRO A 45 7.119 -0.541 11.768 1.00 43.13 C ATOM 685 O PRO A 45 7.697 -1.636 11.695 1.00 74.13 O ATOM 686 CB PRO A 45 4.601 -0.612 12.225 1.00 1.23 C ATOM 687 CG PRO A 45 4.301 -2.066 12.068 1.00 63.05 C ATOM 688 CD PRO A 45 4.483 -2.358 10.590 1.00 4.33 C ATOM 0 HA PRO A 45 5.714 0.704 10.837 1.00 24.32 H new ATOM 0 HB2 PRO A 45 4.940 -0.384 13.236 1.00 1.23 H new ATOM 0 HB3 PRO A 45 3.717 -0.002 12.040 1.00 1.23 H new ATOM 0 HG2 PRO A 45 4.973 -2.673 12.674 1.00 63.05 H new ATOM 0 HG3 PRO A 45 3.286 -2.295 12.392 1.00 63.05 H new ATOM 0 HD2 PRO A 45 4.906 -3.350 10.430 1.00 4.33 H new ATOM 0 HD3 PRO A 45 3.532 -2.327 10.058 1.00 4.33 H new ATOM 696 N ILE A 46 7.654 0.537 12.321 1.00 25.31 N ATOM 697 CA ILE A 46 8.935 0.546 13.012 1.00 12.10 C ATOM 698 C ILE A 46 8.690 0.186 14.474 1.00 23.31 C ATOM 699 O ILE A 46 7.857 0.819 15.128 1.00 10.03 O ATOM 700 CB ILE A 46 9.589 1.968 12.868 1.00 0.04 C ATOM 701 CG1 ILE A 46 9.860 2.289 11.360 1.00 72.22 C ATOM 702 CG2 ILE A 46 10.869 2.111 13.707 1.00 44.50 C ATOM 703 CD1 ILE A 46 10.691 1.243 10.624 1.00 33.43 C ATOM 0 H ILE A 46 7.200 1.450 12.302 1.00 25.31 H new ATOM 0 HA ILE A 46 9.622 -0.182 12.581 1.00 12.10 H new ATOM 0 HB ILE A 46 8.880 2.697 13.260 1.00 0.04 H new ATOM 0 HG12 ILE A 46 8.904 2.399 10.849 1.00 72.22 H new ATOM 0 HG13 ILE A 46 10.369 3.250 11.293 1.00 72.22 H new ATOM 0 HG21 ILE A 46 11.282 3.111 13.573 1.00 44.50 H new ATOM 0 HG22 ILE A 46 10.634 1.954 14.760 1.00 44.50 H new ATOM 0 HG23 ILE A 46 11.600 1.370 13.384 1.00 44.50 H new ATOM 0 HD11 ILE A 46 10.827 1.550 9.587 1.00 33.43 H new ATOM 0 HD12 ILE A 46 11.664 1.147 11.105 1.00 33.43 H new ATOM 0 HD13 ILE A 46 10.176 0.283 10.653 1.00 33.43 H new ATOM 715 N GLN A 47 9.389 -0.846 14.977 1.00 33.12 N ATOM 716 CA GLN A 47 9.187 -1.333 16.354 1.00 70.12 C ATOM 717 C GLN A 47 9.699 -0.308 17.381 1.00 71.03 C ATOM 718 O GLN A 47 9.085 -0.111 18.425 1.00 21.41 O ATOM 719 CB GLN A 47 9.870 -2.712 16.594 1.00 11.43 C ATOM 720 CG GLN A 47 11.404 -2.722 16.425 1.00 31.24 C ATOM 721 CD GLN A 47 12.066 -3.990 16.970 1.00 51.42 C ATOM 722 OE1 GLN A 47 12.497 -4.036 18.123 1.00 24.13 O ATOM 723 NE2 GLN A 47 12.093 -5.035 16.169 1.00 12.03 N ATOM 0 H GLN A 47 10.098 -1.359 14.452 1.00 33.12 H new ATOM 0 HA GLN A 47 8.113 -1.464 16.487 1.00 70.12 H new ATOM 0 HB2 GLN A 47 9.629 -3.049 17.602 1.00 11.43 H new ATOM 0 HB3 GLN A 47 9.439 -3.438 15.904 1.00 11.43 H new ATOM 0 HG2 GLN A 47 11.646 -2.620 15.367 1.00 31.24 H new ATOM 0 HG3 GLN A 47 11.824 -1.854 16.933 1.00 31.24 H new ATOM 0 HE21 GLN A 47 11.727 -4.960 15.220 1.00 12.03 H new ATOM 0 HE22 GLN A 47 12.480 -5.920 16.498 1.00 12.03 H new ATOM 732 N ASP A 48 10.812 0.354 17.053 1.00 3.45 N ATOM 733 CA ASP A 48 11.522 1.233 17.996 1.00 4.42 C ATOM 734 C ASP A 48 10.840 2.611 18.131 1.00 10.44 C ATOM 735 O ASP A 48 10.893 3.234 19.195 1.00 64.24 O ATOM 736 CB ASP A 48 12.998 1.382 17.552 1.00 13.11 C ATOM 737 CG ASP A 48 13.834 2.268 18.498 1.00 61.42 C ATOM 738 OD1 ASP A 48 13.998 1.897 19.680 1.00 21.52 O ATOM 739 OD2 ASP A 48 14.316 3.341 18.069 1.00 32.50 O ATOM 0 H ASP A 48 11.247 0.299 16.132 1.00 3.45 H new ATOM 0 HA ASP A 48 11.488 0.773 18.983 1.00 4.42 H new ATOM 0 HB2 ASP A 48 13.454 0.394 17.494 1.00 13.11 H new ATOM 0 HB3 ASP A 48 13.027 1.806 16.548 1.00 13.11 H new ATOM 744 N SER A 49 10.174 3.062 17.061 1.00 42.40 N ATOM 745 CA SER A 49 9.629 4.432 16.966 1.00 60.22 C ATOM 746 C SER A 49 8.230 4.415 16.317 1.00 73.12 C ATOM 747 O SER A 49 7.938 3.542 15.494 1.00 74.24 O ATOM 748 CB SER A 49 10.598 5.312 16.143 1.00 1.32 C ATOM 749 OG SER A 49 11.911 5.307 16.691 1.00 43.30 O ATOM 0 H SER A 49 9.995 2.492 16.234 1.00 42.40 H new ATOM 0 HA SER A 49 9.529 4.848 17.968 1.00 60.22 H new ATOM 0 HB2 SER A 49 10.632 4.952 15.115 1.00 1.32 H new ATOM 0 HB3 SER A 49 10.222 6.334 16.110 1.00 1.32 H new ATOM 0 HG SER A 49 12.496 5.872 16.144 1.00 43.30 H new ATOM 755 N ASP A 50 7.377 5.396 16.687 1.00 43.41 N ATOM 756 CA ASP A 50 5.989 5.503 16.176 1.00 44.50 C ATOM 757 C ASP A 50 5.976 6.065 14.750 1.00 74.54 C ATOM 758 O ASP A 50 5.733 7.268 14.532 1.00 65.32 O ATOM 759 CB ASP A 50 5.121 6.382 17.109 1.00 11.42 C ATOM 760 CG ASP A 50 4.965 5.786 18.510 1.00 73.33 C ATOM 761 OD1 ASP A 50 4.123 4.884 18.689 1.00 32.01 O ATOM 762 OD2 ASP A 50 5.692 6.205 19.439 1.00 72.43 O ATOM 0 H ASP A 50 7.628 6.134 17.345 1.00 43.41 H new ATOM 0 HA ASP A 50 5.562 4.500 16.156 1.00 44.50 H new ATOM 0 HB2 ASP A 50 5.569 7.372 17.188 1.00 11.42 H new ATOM 0 HB3 ASP A 50 4.135 6.513 16.663 1.00 11.42 H new ATOM 767 N LYS A 51 6.263 5.182 13.788 1.00 31.50 N ATOM 768 CA LYS A 51 6.304 5.500 12.357 1.00 62.22 C ATOM 769 C LYS A 51 6.290 4.197 11.533 1.00 43.34 C ATOM 770 O LYS A 51 6.194 3.102 12.098 1.00 73.23 O ATOM 771 CB LYS A 51 7.549 6.386 12.039 1.00 13.40 C ATOM 772 CG LYS A 51 8.908 5.765 12.442 1.00 30.50 C ATOM 773 CD LYS A 51 10.086 6.746 12.264 1.00 15.35 C ATOM 774 CE LYS A 51 11.444 6.102 12.567 1.00 35.32 C ATOM 775 NZ LYS A 51 12.569 7.056 12.379 1.00 5.42 N ATOM 0 H LYS A 51 6.478 4.205 13.987 1.00 31.50 H new ATOM 0 HA LYS A 51 5.420 6.075 12.081 1.00 62.22 H new ATOM 0 HB2 LYS A 51 7.564 6.596 10.969 1.00 13.40 H new ATOM 0 HB3 LYS A 51 7.437 7.342 12.550 1.00 13.40 H new ATOM 0 HG2 LYS A 51 8.862 5.444 13.483 1.00 30.50 H new ATOM 0 HG3 LYS A 51 9.088 4.874 11.841 1.00 30.50 H new ATOM 0 HD2 LYS A 51 10.088 7.123 11.241 1.00 15.35 H new ATOM 0 HD3 LYS A 51 9.941 7.604 12.920 1.00 15.35 H new ATOM 0 HE2 LYS A 51 11.449 5.733 13.593 1.00 35.32 H new ATOM 0 HE3 LYS A 51 11.589 5.239 11.917 1.00 35.32 H new ATOM 0 HZ1 LYS A 51 13.468 6.579 12.594 1.00 5.42 H new ATOM 0 HZ2 LYS A 51 12.581 7.389 11.394 1.00 5.42 H new ATOM 0 HZ3 LYS A 51 12.446 7.868 13.017 1.00 5.42 H new ATOM 789 N SER A 52 6.381 4.328 10.210 1.00 72.43 N ATOM 790 CA SER A 52 6.322 3.210 9.261 1.00 44.51 C ATOM 791 C SER A 52 7.071 3.611 7.987 1.00 32.11 C ATOM 792 O SER A 52 7.145 4.798 7.661 1.00 14.11 O ATOM 793 CB SER A 52 4.846 2.866 8.928 1.00 51.05 C ATOM 794 OG SER A 52 4.754 1.808 7.983 1.00 22.54 O ATOM 0 H SER A 52 6.500 5.233 9.755 1.00 72.43 H new ATOM 0 HA SER A 52 6.786 2.327 9.701 1.00 44.51 H new ATOM 0 HB2 SER A 52 4.323 2.585 9.842 1.00 51.05 H new ATOM 0 HB3 SER A 52 4.346 3.751 8.534 1.00 51.05 H new ATOM 0 HG SER A 52 5.515 1.201 8.097 1.00 22.54 H new ATOM 800 N HIS A 53 7.651 2.634 7.283 1.00 4.01 N ATOM 801 CA HIS A 53 8.263 2.863 5.959 1.00 41.34 C ATOM 802 C HIS A 53 7.368 2.206 4.904 1.00 2.10 C ATOM 803 O HIS A 53 7.015 1.022 5.039 1.00 23.05 O ATOM 804 CB HIS A 53 9.701 2.290 5.885 1.00 54.22 C ATOM 805 CG HIS A 53 10.747 3.027 6.689 1.00 35.35 C ATOM 806 ND1 HIS A 53 12.018 3.259 6.220 1.00 52.34 N ATOM 807 CD2 HIS A 53 10.721 3.530 7.944 1.00 74.41 C ATOM 808 CE1 HIS A 53 12.728 3.867 7.147 1.00 42.31 C ATOM 809 NE2 HIS A 53 11.964 4.044 8.206 1.00 22.52 N ATOM 0 H HIS A 53 7.712 1.668 7.606 1.00 4.01 H new ATOM 0 HA HIS A 53 8.343 3.935 5.779 1.00 41.34 H new ATOM 0 HB2 HIS A 53 9.676 1.253 6.221 1.00 54.22 H new ATOM 0 HB3 HIS A 53 10.014 2.279 4.841 1.00 54.22 H new ATOM 0 HD1 HIS A 53 12.359 3.000 5.294 1.00 52.34 H new ATOM 0 HD2 HIS A 53 9.876 3.527 8.616 1.00 74.41 H new ATOM 0 HE1 HIS A 53 13.761 4.169 7.055 1.00 42.31 H new ATOM 818 N ILE A 54 6.963 2.998 3.893 1.00 55.43 N ATOM 819 CA ILE A 54 6.133 2.524 2.780 1.00 74.31 C ATOM 820 C ILE A 54 6.953 2.658 1.481 1.00 23.43 C ATOM 821 O ILE A 54 7.190 3.774 1.020 1.00 71.25 O ATOM 822 CB ILE A 54 4.750 3.305 2.627 1.00 32.54 C ATOM 823 CG1 ILE A 54 3.902 3.324 3.948 1.00 34.13 C ATOM 824 CG2 ILE A 54 3.911 2.694 1.474 1.00 5.32 C ATOM 825 CD1 ILE A 54 4.412 4.237 5.053 1.00 63.33 C ATOM 0 H ILE A 54 7.205 3.987 3.829 1.00 55.43 H new ATOM 0 HA ILE A 54 5.867 1.487 2.987 1.00 74.31 H new ATOM 0 HB ILE A 54 5.004 4.340 2.396 1.00 32.54 H new ATOM 0 HG12 ILE A 54 2.884 3.622 3.699 1.00 34.13 H new ATOM 0 HG13 ILE A 54 3.850 2.308 4.338 1.00 34.13 H new ATOM 0 HG21 ILE A 54 2.970 3.237 1.381 1.00 5.32 H new ATOM 0 HG22 ILE A 54 4.467 2.770 0.540 1.00 5.32 H new ATOM 0 HG23 ILE A 54 3.705 1.646 1.690 1.00 5.32 H new ATOM 0 HD11 ILE A 54 3.749 4.169 5.916 1.00 63.33 H new ATOM 0 HD12 ILE A 54 5.417 3.931 5.343 1.00 63.33 H new ATOM 0 HD13 ILE A 54 4.435 5.266 4.693 1.00 63.33 H new ATOM 837 N TRP A 55 7.408 1.520 0.937 1.00 24.22 N ATOM 838 CA TRP A 55 8.149 1.455 -0.328 1.00 13.22 C ATOM 839 C TRP A 55 7.152 1.344 -1.498 1.00 61.42 C ATOM 840 O TRP A 55 6.494 0.306 -1.657 1.00 24.20 O ATOM 841 CB TRP A 55 9.108 0.226 -0.322 1.00 71.54 C ATOM 842 CG TRP A 55 10.149 0.252 0.789 1.00 3.33 C ATOM 843 CD1 TRP A 55 11.431 0.716 0.709 1.00 4.12 C ATOM 844 CD2 TRP A 55 10.003 -0.223 2.127 1.00 41.02 C ATOM 845 NE1 TRP A 55 12.060 0.598 1.910 1.00 1.11 N ATOM 846 CE2 TRP A 55 11.219 0.006 2.792 1.00 72.13 C ATOM 847 CE3 TRP A 55 8.968 -0.817 2.829 1.00 23.41 C ATOM 848 CZ2 TRP A 55 11.423 -0.329 4.115 1.00 64.23 C ATOM 849 CZ3 TRP A 55 9.171 -1.163 4.142 1.00 41.42 C ATOM 850 CH2 TRP A 55 10.393 -0.919 4.776 1.00 43.31 C ATOM 0 H TRP A 55 7.269 0.607 1.370 1.00 24.22 H new ATOM 0 HA TRP A 55 8.744 2.360 -0.446 1.00 13.22 H new ATOM 0 HB2 TRP A 55 8.514 -0.683 -0.227 1.00 71.54 H new ATOM 0 HB3 TRP A 55 9.620 0.174 -1.283 1.00 71.54 H new ATOM 0 HD1 TRP A 55 11.883 1.121 -0.184 1.00 4.12 H new ATOM 0 HE1 TRP A 55 13.011 0.906 2.113 1.00 1.11 H new ATOM 0 HE3 TRP A 55 8.017 -1.005 2.352 1.00 23.41 H new ATOM 0 HZ2 TRP A 55 12.364 -0.130 4.606 1.00 64.23 H new ATOM 0 HZ3 TRP A 55 8.371 -1.633 4.696 1.00 41.42 H new ATOM 0 HH2 TRP A 55 10.520 -1.205 5.810 1.00 43.31 H new ATOM 861 N LEU A 56 7.007 2.430 -2.276 1.00 13.41 N ATOM 862 CA LEU A 56 6.134 2.462 -3.463 1.00 31.40 C ATOM 863 C LEU A 56 6.938 2.075 -4.709 1.00 45.53 C ATOM 864 O LEU A 56 7.835 2.807 -5.127 1.00 4.14 O ATOM 865 CB LEU A 56 5.477 3.865 -3.674 1.00 21.35 C ATOM 866 CG LEU A 56 4.430 4.329 -2.602 1.00 61.15 C ATOM 867 CD1 LEU A 56 3.355 3.246 -2.348 1.00 51.33 C ATOM 868 CD2 LEU A 56 5.111 4.796 -1.295 1.00 5.41 C ATOM 0 H LEU A 56 7.491 3.310 -2.100 1.00 13.41 H new ATOM 0 HA LEU A 56 5.331 1.744 -3.299 1.00 31.40 H new ATOM 0 HB2 LEU A 56 6.273 4.609 -3.715 1.00 21.35 H new ATOM 0 HB3 LEU A 56 4.988 3.867 -4.648 1.00 21.35 H new ATOM 0 HG LEU A 56 3.913 5.197 -3.010 1.00 61.15 H new ATOM 0 HD11 LEU A 56 2.648 3.604 -1.600 1.00 51.33 H new ATOM 0 HD12 LEU A 56 2.825 3.035 -3.277 1.00 51.33 H new ATOM 0 HD13 LEU A 56 3.834 2.335 -1.988 1.00 51.33 H new ATOM 0 HD21 LEU A 56 4.350 5.109 -0.580 1.00 5.41 H new ATOM 0 HD22 LEU A 56 5.690 3.975 -0.873 1.00 5.41 H new ATOM 0 HD23 LEU A 56 5.774 5.634 -1.509 1.00 5.41 H new ATOM 880 N LEU A 57 6.592 0.923 -5.279 1.00 63.54 N ATOM 881 CA LEU A 57 7.184 0.400 -6.517 1.00 64.13 C ATOM 882 C LEU A 57 6.380 0.958 -7.687 1.00 74.03 C ATOM 883 O LEU A 57 5.262 0.508 -7.950 1.00 33.11 O ATOM 884 CB LEU A 57 7.149 -1.157 -6.540 1.00 0.41 C ATOM 885 CG LEU A 57 8.171 -1.923 -5.640 1.00 50.42 C ATOM 886 CD1 LEU A 57 8.116 -1.497 -4.157 1.00 41.13 C ATOM 887 CD2 LEU A 57 7.979 -3.448 -5.802 1.00 13.31 C ATOM 0 H LEU A 57 5.877 0.310 -4.887 1.00 63.54 H new ATOM 0 HA LEU A 57 8.228 0.704 -6.584 1.00 64.13 H new ATOM 0 HB2 LEU A 57 6.146 -1.474 -6.252 1.00 0.41 H new ATOM 0 HB3 LEU A 57 7.302 -1.480 -7.570 1.00 0.41 H new ATOM 0 HG LEU A 57 9.170 -1.652 -5.983 1.00 50.42 H new ATOM 0 HD11 LEU A 57 8.850 -2.067 -3.587 1.00 41.13 H new ATOM 0 HD12 LEU A 57 8.339 -0.433 -4.075 1.00 41.13 H new ATOM 0 HD13 LEU A 57 7.119 -1.690 -3.760 1.00 41.13 H new ATOM 0 HD21 LEU A 57 8.696 -3.974 -5.171 1.00 13.31 H new ATOM 0 HD22 LEU A 57 6.966 -3.721 -5.506 1.00 13.31 H new ATOM 0 HD23 LEU A 57 8.140 -3.726 -6.844 1.00 13.31 H new ATOM 899 N VAL A 58 6.935 1.971 -8.341 1.00 53.01 N ATOM 900 CA VAL A 58 6.288 2.662 -9.463 1.00 23.33 C ATOM 901 C VAL A 58 7.374 3.053 -10.466 1.00 4.03 C ATOM 902 O VAL A 58 8.503 3.273 -10.055 1.00 34.43 O ATOM 903 CB VAL A 58 5.498 3.932 -8.942 1.00 31.02 C ATOM 904 CG1 VAL A 58 6.432 5.065 -8.455 1.00 53.42 C ATOM 905 CG2 VAL A 58 4.475 4.435 -9.978 1.00 54.05 C ATOM 0 H VAL A 58 7.856 2.344 -8.110 1.00 53.01 H new ATOM 0 HA VAL A 58 5.563 2.009 -9.949 1.00 23.33 H new ATOM 0 HB VAL A 58 4.939 3.604 -8.066 1.00 31.02 H new ATOM 0 HG11 VAL A 58 5.833 5.908 -8.110 1.00 53.42 H new ATOM 0 HG12 VAL A 58 7.050 4.700 -7.635 1.00 53.42 H new ATOM 0 HG13 VAL A 58 7.072 5.387 -9.276 1.00 53.42 H new ATOM 0 HG21 VAL A 58 3.955 5.307 -9.582 1.00 54.05 H new ATOM 0 HG22 VAL A 58 4.993 4.708 -10.898 1.00 54.05 H new ATOM 0 HG23 VAL A 58 3.753 3.646 -10.189 1.00 54.05 H new ATOM 915 N ASN A 59 7.074 3.125 -11.768 1.00 11.33 N ATOM 916 CA ASN A 59 8.108 3.483 -12.764 1.00 62.54 C ATOM 917 C ASN A 59 8.379 5.004 -12.711 1.00 70.31 C ATOM 918 O ASN A 59 7.439 5.807 -12.600 1.00 54.01 O ATOM 919 CB ASN A 59 7.713 3.007 -14.190 1.00 3.10 C ATOM 920 CG ASN A 59 6.520 3.738 -14.811 1.00 41.32 C ATOM 921 OD1 ASN A 59 5.611 4.187 -14.115 1.00 74.02 O ATOM 922 ND2 ASN A 59 6.519 3.870 -16.127 1.00 21.13 N ATOM 0 H ASN A 59 6.148 2.946 -12.157 1.00 11.33 H new ATOM 0 HA ASN A 59 9.034 2.964 -12.514 1.00 62.54 H new ATOM 0 HB2 ASN A 59 8.574 3.126 -14.847 1.00 3.10 H new ATOM 0 HB3 ASN A 59 7.486 1.942 -14.151 1.00 3.10 H new ATOM 0 HD21 ASN A 59 5.750 4.355 -16.590 1.00 21.13 H new ATOM 0 HD22 ASN A 59 7.287 3.487 -16.679 1.00 21.13 H new ATOM 929 N ASP A 60 9.669 5.385 -12.744 1.00 33.42 N ATOM 930 CA ASP A 60 10.089 6.795 -12.658 1.00 74.34 C ATOM 931 C ASP A 60 9.736 7.549 -13.944 1.00 52.23 C ATOM 932 O ASP A 60 9.811 7.000 -15.050 1.00 5.32 O ATOM 933 CB ASP A 60 11.599 6.939 -12.332 1.00 2.30 C ATOM 934 CG ASP A 60 12.529 6.432 -13.445 1.00 52.41 C ATOM 935 OD1 ASP A 60 12.759 5.214 -13.519 1.00 24.55 O ATOM 936 OD2 ASP A 60 13.032 7.253 -14.254 1.00 21.41 O ATOM 0 H ASP A 60 10.445 4.729 -12.830 1.00 33.42 H new ATOM 0 HA ASP A 60 9.538 7.242 -11.831 1.00 74.34 H new ATOM 0 HB2 ASP A 60 11.820 7.989 -12.138 1.00 2.30 H new ATOM 0 HB3 ASP A 60 11.816 6.393 -11.414 1.00 2.30 H new ATOM 941 N ASP A 61 9.324 8.801 -13.765 1.00 2.21 N ATOM 942 CA ASP A 61 8.918 9.695 -14.851 1.00 4.22 C ATOM 943 C ASP A 61 9.397 11.111 -14.515 1.00 34.43 C ATOM 944 O ASP A 61 9.713 11.400 -13.348 1.00 55.00 O ATOM 945 CB ASP A 61 7.381 9.622 -14.999 1.00 4.13 C ATOM 946 CG ASP A 61 6.813 10.494 -16.121 1.00 4.41 C ATOM 947 OD1 ASP A 61 6.966 10.132 -17.299 1.00 12.14 O ATOM 948 OD2 ASP A 61 6.215 11.543 -15.828 1.00 52.45 O ATOM 0 H ASP A 61 9.261 9.233 -12.843 1.00 2.21 H new ATOM 0 HA ASP A 61 9.362 9.402 -15.802 1.00 4.22 H new ATOM 0 HB2 ASP A 61 7.094 8.586 -15.180 1.00 4.13 H new ATOM 0 HB3 ASP A 61 6.923 9.920 -14.056 1.00 4.13 H new ATOM 953 N GLN A 62 9.461 11.987 -15.534 1.00 35.42 N ATOM 954 CA GLN A 62 9.844 13.402 -15.360 1.00 64.53 C ATOM 955 C GLN A 62 8.913 14.095 -14.339 1.00 52.45 C ATOM 956 O GLN A 62 9.382 14.780 -13.430 1.00 33.25 O ATOM 957 CB GLN A 62 9.787 14.151 -16.716 1.00 44.12 C ATOM 958 CG GLN A 62 10.778 13.633 -17.789 1.00 31.35 C ATOM 959 CD GLN A 62 10.656 14.341 -19.153 1.00 14.42 C ATOM 960 OE1 GLN A 62 11.640 14.508 -19.872 1.00 32.42 O ATOM 961 NE2 GLN A 62 9.447 14.721 -19.542 1.00 4.52 N ATOM 0 H GLN A 62 9.249 11.736 -16.500 1.00 35.42 H new ATOM 0 HA GLN A 62 10.866 13.433 -14.982 1.00 64.53 H new ATOM 0 HB2 GLN A 62 8.774 14.078 -17.112 1.00 44.12 H new ATOM 0 HB3 GLN A 62 9.985 15.208 -16.539 1.00 44.12 H new ATOM 0 HG2 GLN A 62 11.795 13.756 -17.418 1.00 31.35 H new ATOM 0 HG3 GLN A 62 10.617 12.564 -17.931 1.00 31.35 H new ATOM 0 HE21 GLN A 62 8.644 14.573 -18.930 1.00 4.52 H new ATOM 0 HE22 GLN A 62 9.319 15.161 -20.453 1.00 4.52 H new ATOM 970 N ARG A 63 7.600 13.853 -14.481 1.00 15.35 N ATOM 971 CA ARG A 63 6.560 14.470 -13.630 1.00 24.44 C ATOM 972 C ARG A 63 6.542 13.823 -12.234 1.00 31.05 C ATOM 973 O ARG A 63 6.182 14.481 -11.258 1.00 32.54 O ATOM 974 CB ARG A 63 5.159 14.353 -14.300 1.00 43.33 C ATOM 975 CG ARG A 63 4.001 14.981 -13.482 1.00 43.30 C ATOM 976 CD ARG A 63 2.632 14.824 -14.153 1.00 25.41 C ATOM 977 NE ARG A 63 2.554 15.554 -15.432 1.00 14.24 N ATOM 978 CZ ARG A 63 1.783 15.216 -16.478 1.00 14.44 C ATOM 979 NH1 ARG A 63 1.005 14.141 -16.428 1.00 12.15 N ATOM 980 NH2 ARG A 63 1.804 15.956 -17.575 1.00 3.42 N ATOM 0 H ARG A 63 7.225 13.223 -15.190 1.00 15.35 H new ATOM 0 HA ARG A 63 6.801 15.527 -13.516 1.00 24.44 H new ATOM 0 HB2 ARG A 63 5.197 14.832 -15.279 1.00 43.33 H new ATOM 0 HB3 ARG A 63 4.938 13.299 -14.469 1.00 43.33 H new ATOM 0 HG2 ARG A 63 3.970 14.519 -12.495 1.00 43.30 H new ATOM 0 HG3 ARG A 63 4.205 16.041 -13.331 1.00 43.30 H new ATOM 0 HD2 ARG A 63 2.433 13.766 -14.327 1.00 25.41 H new ATOM 0 HD3 ARG A 63 1.855 15.188 -13.480 1.00 25.41 H new ATOM 0 HE ARG A 63 3.135 16.386 -15.530 1.00 14.24 H new ATOM 0 HH11 ARG A 63 0.989 13.562 -15.589 1.00 12.15 H new ATOM 0 HH12 ARG A 63 0.424 13.894 -17.229 1.00 12.15 H new ATOM 0 HH21 ARG A 63 2.404 16.779 -17.623 1.00 3.42 H new ATOM 0 HH22 ARG A 63 1.220 15.703 -18.372 1.00 3.42 H new ATOM 994 N LEU A 64 6.943 12.533 -12.149 1.00 32.22 N ATOM 995 CA LEU A 64 6.943 11.768 -10.877 1.00 1.45 C ATOM 996 C LEU A 64 7.757 12.491 -9.788 1.00 63.34 C ATOM 997 O LEU A 64 7.383 12.476 -8.617 1.00 32.30 O ATOM 998 CB LEU A 64 7.496 10.333 -11.086 1.00 30.14 C ATOM 999 CG LEU A 64 7.252 9.329 -9.907 1.00 31.13 C ATOM 1000 CD1 LEU A 64 5.786 8.851 -9.852 1.00 12.33 C ATOM 1001 CD2 LEU A 64 8.205 8.129 -9.981 1.00 31.32 C ATOM 0 H LEU A 64 7.273 11.996 -12.951 1.00 32.22 H new ATOM 0 HA LEU A 64 5.907 11.697 -10.544 1.00 1.45 H new ATOM 0 HB2 LEU A 64 7.048 9.919 -11.989 1.00 30.14 H new ATOM 0 HB3 LEU A 64 8.569 10.400 -11.265 1.00 30.14 H new ATOM 0 HG LEU A 64 7.461 9.873 -8.986 1.00 31.13 H new ATOM 0 HD11 LEU A 64 5.661 8.157 -9.021 1.00 12.33 H new ATOM 0 HD12 LEU A 64 5.129 9.709 -9.711 1.00 12.33 H new ATOM 0 HD13 LEU A 64 5.532 8.349 -10.785 1.00 12.33 H new ATOM 0 HD21 LEU A 64 8.006 7.455 -9.148 1.00 31.32 H new ATOM 0 HD22 LEU A 64 8.051 7.599 -10.921 1.00 31.32 H new ATOM 0 HD23 LEU A 64 9.236 8.479 -9.927 1.00 31.32 H new ATOM 1013 N GLU A 65 8.846 13.152 -10.215 1.00 61.13 N ATOM 1014 CA GLU A 65 9.739 13.926 -9.327 1.00 72.41 C ATOM 1015 C GLU A 65 9.000 15.104 -8.660 1.00 50.15 C ATOM 1016 O GLU A 65 9.276 15.438 -7.500 1.00 13.31 O ATOM 1017 CB GLU A 65 10.960 14.435 -10.126 1.00 44.34 C ATOM 1018 CG GLU A 65 11.778 13.307 -10.784 1.00 43.42 C ATOM 1019 CD GLU A 65 12.997 13.820 -11.566 1.00 61.54 C ATOM 1020 OE1 GLU A 65 14.024 14.150 -10.938 1.00 63.13 O ATOM 1021 OE2 GLU A 65 12.930 13.905 -12.808 1.00 51.24 O ATOM 0 H GLU A 65 9.136 13.166 -11.193 1.00 61.13 H new ATOM 0 HA GLU A 65 10.080 13.264 -8.531 1.00 72.41 H new ATOM 0 HB2 GLU A 65 10.617 15.123 -10.899 1.00 44.34 H new ATOM 0 HB3 GLU A 65 11.609 15.003 -9.459 1.00 44.34 H new ATOM 0 HG2 GLU A 65 12.115 12.614 -10.013 1.00 43.42 H new ATOM 0 HG3 GLU A 65 11.132 12.745 -11.458 1.00 43.42 H new ATOM 1028 N GLN A 66 8.063 15.714 -9.407 1.00 30.34 N ATOM 1029 CA GLN A 66 7.193 16.800 -8.905 1.00 52.20 C ATOM 1030 C GLN A 66 6.264 16.261 -7.803 1.00 54.00 C ATOM 1031 O GLN A 66 6.078 16.907 -6.765 1.00 54.22 O ATOM 1032 CB GLN A 66 6.353 17.404 -10.066 1.00 21.14 C ATOM 1033 CG GLN A 66 5.493 18.628 -9.685 1.00 62.11 C ATOM 1034 CD GLN A 66 4.571 19.107 -10.816 1.00 41.13 C ATOM 1035 OE1 GLN A 66 4.109 18.318 -11.641 1.00 55.42 O ATOM 1036 NE2 GLN A 66 4.291 20.401 -10.859 1.00 5.32 N ATOM 0 H GLN A 66 7.885 15.469 -10.381 1.00 30.34 H new ATOM 0 HA GLN A 66 7.821 17.587 -8.487 1.00 52.20 H new ATOM 0 HB2 GLN A 66 7.029 17.691 -10.871 1.00 21.14 H new ATOM 0 HB3 GLN A 66 5.698 16.628 -10.461 1.00 21.14 H new ATOM 0 HG2 GLN A 66 4.887 18.379 -8.814 1.00 62.11 H new ATOM 0 HG3 GLN A 66 6.150 19.447 -9.392 1.00 62.11 H new ATOM 0 HE21 GLN A 66 4.688 21.032 -10.163 1.00 5.32 H new ATOM 0 HE22 GLN A 66 3.679 20.766 -11.588 1.00 5.32 H new ATOM 1045 N MET A 67 5.695 15.064 -8.043 1.00 63.44 N ATOM 1046 CA MET A 67 4.833 14.357 -7.067 1.00 14.52 C ATOM 1047 C MET A 67 5.602 14.059 -5.759 1.00 55.42 C ATOM 1048 O MET A 67 5.061 14.251 -4.666 1.00 11.34 O ATOM 1049 CB MET A 67 4.272 13.045 -7.684 1.00 44.30 C ATOM 1050 CG MET A 67 3.122 13.220 -8.696 1.00 11.12 C ATOM 1051 SD MET A 67 3.521 14.250 -10.124 1.00 31.13 S ATOM 1052 CE MET A 67 2.654 15.783 -9.767 1.00 62.34 C ATOM 0 H MET A 67 5.818 14.557 -8.919 1.00 63.44 H new ATOM 0 HA MET A 67 3.995 15.010 -6.822 1.00 14.52 H new ATOM 0 HB2 MET A 67 5.089 12.519 -8.178 1.00 44.30 H new ATOM 0 HB3 MET A 67 3.924 12.404 -6.874 1.00 44.30 H new ATOM 0 HG2 MET A 67 2.815 12.236 -9.050 1.00 11.12 H new ATOM 0 HG3 MET A 67 2.266 13.654 -8.180 1.00 11.12 H new ATOM 0 HE1 MET A 67 2.675 16.426 -10.647 1.00 62.34 H new ATOM 0 HE2 MET A 67 1.620 15.563 -9.503 1.00 62.34 H new ATOM 0 HE3 MET A 67 3.141 16.291 -8.934 1.00 62.34 H new ATOM 1062 N ILE A 68 6.866 13.607 -5.904 1.00 65.11 N ATOM 1063 CA ILE A 68 7.779 13.304 -4.775 1.00 21.53 C ATOM 1064 C ILE A 68 8.074 14.575 -3.951 1.00 35.41 C ATOM 1065 O ILE A 68 8.044 14.548 -2.717 1.00 3.11 O ATOM 1066 CB ILE A 68 9.130 12.669 -5.308 1.00 13.44 C ATOM 1067 CG1 ILE A 68 8.848 11.334 -6.075 1.00 51.00 C ATOM 1068 CG2 ILE A 68 10.161 12.440 -4.169 1.00 30.42 C ATOM 1069 CD1 ILE A 68 10.031 10.793 -6.862 1.00 0.44 C ATOM 0 H ILE A 68 7.288 13.440 -6.817 1.00 65.11 H new ATOM 0 HA ILE A 68 7.286 12.581 -4.125 1.00 21.53 H new ATOM 0 HB ILE A 68 9.571 13.386 -6.001 1.00 13.44 H new ATOM 0 HG12 ILE A 68 8.530 10.578 -5.357 1.00 51.00 H new ATOM 0 HG13 ILE A 68 8.015 11.493 -6.760 1.00 51.00 H new ATOM 0 HG21 ILE A 68 11.070 12.004 -4.583 1.00 30.42 H new ATOM 0 HG22 ILE A 68 10.399 13.393 -3.696 1.00 30.42 H new ATOM 0 HG23 ILE A 68 9.739 11.762 -3.427 1.00 30.42 H new ATOM 0 HD11 ILE A 68 9.744 9.867 -7.360 1.00 0.44 H new ATOM 0 HD12 ILE A 68 10.338 11.526 -7.608 1.00 0.44 H new ATOM 0 HD13 ILE A 68 10.861 10.597 -6.183 1.00 0.44 H new ATOM 1081 N SER A 69 8.323 15.688 -4.658 1.00 4.31 N ATOM 1082 CA SER A 69 8.656 16.985 -4.036 1.00 5.04 C ATOM 1083 C SER A 69 7.433 17.599 -3.321 1.00 63.01 C ATOM 1084 O SER A 69 7.581 18.239 -2.277 1.00 43.34 O ATOM 1085 CB SER A 69 9.193 17.954 -5.110 1.00 1.02 C ATOM 1086 OG SER A 69 10.345 17.425 -5.745 1.00 3.14 O ATOM 0 H SER A 69 8.300 15.717 -5.677 1.00 4.31 H new ATOM 0 HA SER A 69 9.426 16.816 -3.283 1.00 5.04 H new ATOM 0 HB2 SER A 69 8.419 18.143 -5.853 1.00 1.02 H new ATOM 0 HB3 SER A 69 9.435 18.913 -4.651 1.00 1.02 H new ATOM 0 HG SER A 69 10.078 16.723 -6.375 1.00 3.14 H new ATOM 1092 N GLN A 70 6.234 17.371 -3.888 1.00 61.42 N ATOM 1093 CA GLN A 70 4.966 17.917 -3.357 1.00 61.25 C ATOM 1094 C GLN A 70 4.601 17.193 -2.052 1.00 63.00 C ATOM 1095 O GLN A 70 4.297 17.834 -1.045 1.00 4.53 O ATOM 1096 CB GLN A 70 3.832 17.762 -4.430 1.00 61.41 C ATOM 1097 CG GLN A 70 2.490 18.500 -4.149 1.00 21.04 C ATOM 1098 CD GLN A 70 1.595 17.893 -3.046 1.00 12.33 C ATOM 1099 OE1 GLN A 70 0.883 18.614 -2.356 1.00 34.23 O ATOM 1100 NE2 GLN A 70 1.605 16.574 -2.892 1.00 74.13 N ATOM 0 H GLN A 70 6.114 16.804 -4.727 1.00 61.42 H new ATOM 0 HA GLN A 70 5.083 18.978 -3.138 1.00 61.25 H new ATOM 0 HB2 GLN A 70 4.219 18.115 -5.386 1.00 61.41 H new ATOM 0 HB3 GLN A 70 3.617 16.700 -4.545 1.00 61.41 H new ATOM 0 HG2 GLN A 70 2.717 19.531 -3.877 1.00 21.04 H new ATOM 0 HG3 GLN A 70 1.917 18.533 -5.076 1.00 21.04 H new ATOM 0 HE21 GLN A 70 2.207 15.997 -3.479 1.00 74.13 H new ATOM 0 HE22 GLN A 70 1.011 16.138 -2.187 1.00 74.13 H new ATOM 1109 N ILE A 71 4.623 15.849 -2.106 1.00 1.32 N ATOM 1110 CA ILE A 71 4.227 14.997 -0.969 1.00 23.40 C ATOM 1111 C ILE A 71 5.234 15.132 0.197 1.00 12.13 C ATOM 1112 O ILE A 71 4.870 14.972 1.368 1.00 65.12 O ATOM 1113 CB ILE A 71 4.048 13.493 -1.381 1.00 20.22 C ATOM 1114 CG1 ILE A 71 3.336 12.712 -0.234 1.00 24.14 C ATOM 1115 CG2 ILE A 71 5.400 12.835 -1.772 1.00 74.35 C ATOM 1116 CD1 ILE A 71 3.261 11.227 -0.442 1.00 2.12 C ATOM 0 H ILE A 71 4.913 15.326 -2.932 1.00 1.32 H new ATOM 0 HA ILE A 71 3.253 15.351 -0.631 1.00 23.40 H new ATOM 0 HB ILE A 71 3.419 13.453 -2.270 1.00 20.22 H new ATOM 0 HG12 ILE A 71 3.860 12.909 0.701 1.00 24.14 H new ATOM 0 HG13 ILE A 71 2.324 13.101 -0.121 1.00 24.14 H new ATOM 0 HG21 ILE A 71 5.231 11.795 -2.050 1.00 74.35 H new ATOM 0 HG22 ILE A 71 5.835 13.371 -2.616 1.00 74.35 H new ATOM 0 HG23 ILE A 71 6.084 12.877 -0.924 1.00 74.35 H new ATOM 0 HD11 ILE A 71 2.750 10.766 0.404 1.00 2.12 H new ATOM 0 HD12 ILE A 71 2.709 11.015 -1.358 1.00 2.12 H new ATOM 0 HD13 ILE A 71 4.269 10.820 -0.523 1.00 2.12 H new ATOM 1128 N ASP A 72 6.496 15.451 -0.148 1.00 15.22 N ATOM 1129 CA ASP A 72 7.565 15.729 0.828 1.00 44.11 C ATOM 1130 C ASP A 72 7.185 16.905 1.764 1.00 43.54 C ATOM 1131 O ASP A 72 7.581 16.937 2.931 1.00 64.33 O ATOM 1132 CB ASP A 72 8.882 16.044 0.069 1.00 60.22 C ATOM 1133 CG ASP A 72 10.028 16.524 0.979 1.00 34.30 C ATOM 1134 OD1 ASP A 72 10.531 15.719 1.795 1.00 20.43 O ATOM 1135 OD2 ASP A 72 10.423 17.714 0.896 1.00 20.30 O ATOM 0 H ASP A 72 6.804 15.523 -1.118 1.00 15.22 H new ATOM 0 HA ASP A 72 7.704 14.847 1.453 1.00 44.11 H new ATOM 0 HB2 ASP A 72 9.205 15.150 -0.464 1.00 60.22 H new ATOM 0 HB3 ASP A 72 8.683 16.809 -0.682 1.00 60.22 H new ATOM 1140 N LYS A 73 6.390 17.854 1.235 1.00 14.15 N ATOM 1141 CA LYS A 73 5.960 19.054 1.984 1.00 52.45 C ATOM 1142 C LYS A 73 4.867 18.705 3.018 1.00 40.11 C ATOM 1143 O LYS A 73 4.629 19.477 3.956 1.00 55.10 O ATOM 1144 CB LYS A 73 5.442 20.163 1.018 1.00 62.12 C ATOM 1145 CG LYS A 73 6.311 20.414 -0.243 1.00 13.40 C ATOM 1146 CD LYS A 73 7.812 20.618 0.055 1.00 23.41 C ATOM 1147 CE LYS A 73 8.102 21.863 0.897 1.00 1.51 C ATOM 1148 NZ LYS A 73 9.538 21.935 1.302 1.00 41.31 N ATOM 0 H LYS A 73 6.028 17.813 0.282 1.00 14.15 H new ATOM 0 HA LYS A 73 6.832 19.434 2.516 1.00 52.45 H new ATOM 0 HB2 LYS A 73 4.435 19.898 0.696 1.00 62.12 H new ATOM 0 HB3 LYS A 73 5.363 21.097 1.575 1.00 62.12 H new ATOM 0 HG2 LYS A 73 6.198 19.569 -0.923 1.00 13.40 H new ATOM 0 HG3 LYS A 73 5.932 21.294 -0.763 1.00 13.40 H new ATOM 0 HD2 LYS A 73 8.194 19.740 0.575 1.00 23.41 H new ATOM 0 HD3 LYS A 73 8.355 20.691 -0.887 1.00 23.41 H new ATOM 0 HE2 LYS A 73 7.839 22.755 0.329 1.00 1.51 H new ATOM 0 HE3 LYS A 73 7.473 21.855 1.787 1.00 1.51 H new ATOM 0 HZ1 LYS A 73 9.696 22.791 1.871 1.00 41.31 H new ATOM 0 HZ2 LYS A 73 9.782 21.096 1.865 1.00 41.31 H new ATOM 0 HZ3 LYS A 73 10.137 21.968 0.453 1.00 41.31 H new ATOM 1162 N LEU A 74 4.205 17.544 2.824 1.00 61.21 N ATOM 1163 CA LEU A 74 3.164 17.043 3.739 1.00 21.10 C ATOM 1164 C LEU A 74 3.806 16.514 5.035 1.00 4.24 C ATOM 1165 O LEU A 74 4.827 15.825 4.998 1.00 41.34 O ATOM 1166 CB LEU A 74 2.281 15.954 3.051 1.00 22.34 C ATOM 1167 CG LEU A 74 1.141 16.471 2.101 1.00 72.43 C ATOM 1168 CD1 LEU A 74 0.135 17.365 2.868 1.00 44.25 C ATOM 1169 CD2 LEU A 74 1.703 17.207 0.859 1.00 51.33 C ATOM 0 H LEU A 74 4.379 16.930 2.028 1.00 61.21 H new ATOM 0 HA LEU A 74 2.505 17.871 3.999 1.00 21.10 H new ATOM 0 HB2 LEU A 74 2.935 15.300 2.474 1.00 22.34 H new ATOM 0 HB3 LEU A 74 1.825 15.343 3.830 1.00 22.34 H new ATOM 0 HG LEU A 74 0.608 15.592 1.739 1.00 72.43 H new ATOM 0 HD11 LEU A 74 -0.642 17.708 2.185 1.00 44.25 H new ATOM 0 HD12 LEU A 74 -0.319 16.791 3.676 1.00 44.25 H new ATOM 0 HD13 LEU A 74 0.658 18.226 3.284 1.00 44.25 H new ATOM 0 HD21 LEU A 74 0.878 17.546 0.233 1.00 51.33 H new ATOM 0 HD22 LEU A 74 2.291 18.067 1.181 1.00 51.33 H new ATOM 0 HD23 LEU A 74 2.336 16.527 0.289 1.00 51.33 H new ATOM 1181 N GLU A 75 3.178 16.859 6.172 1.00 13.33 N ATOM 1182 CA GLU A 75 3.721 16.609 7.526 1.00 11.33 C ATOM 1183 C GLU A 75 3.562 15.137 7.962 1.00 23.33 C ATOM 1184 O GLU A 75 4.323 14.647 8.807 1.00 41.42 O ATOM 1185 CB GLU A 75 3.068 17.609 8.533 1.00 51.30 C ATOM 1186 CG GLU A 75 1.519 17.656 8.540 1.00 64.02 C ATOM 1187 CD GLU A 75 0.844 16.484 9.279 1.00 42.32 C ATOM 1188 OE1 GLU A 75 1.029 16.375 10.508 1.00 3.55 O ATOM 1189 OE2 GLU A 75 0.119 15.686 8.645 1.00 63.50 O ATOM 0 H GLU A 75 2.270 17.324 6.181 1.00 13.33 H new ATOM 0 HA GLU A 75 4.797 16.784 7.511 1.00 11.33 H new ATOM 0 HB2 GLU A 75 3.408 17.356 9.537 1.00 51.30 H new ATOM 0 HB3 GLU A 75 3.441 18.609 8.313 1.00 51.30 H new ATOM 0 HG2 GLU A 75 1.199 18.591 9.000 1.00 64.02 H new ATOM 0 HG3 GLU A 75 1.165 17.671 7.509 1.00 64.02 H new ATOM 1196 N ASP A 76 2.553 14.462 7.389 1.00 54.44 N ATOM 1197 CA ASP A 76 2.320 13.015 7.575 1.00 52.20 C ATOM 1198 C ASP A 76 3.549 12.204 7.132 1.00 34.22 C ATOM 1199 O ASP A 76 3.995 11.292 7.841 1.00 72.54 O ATOM 1200 CB ASP A 76 1.031 12.572 6.821 1.00 42.11 C ATOM 1201 CG ASP A 76 0.913 13.162 5.398 1.00 43.21 C ATOM 1202 OD1 ASP A 76 0.339 14.263 5.251 1.00 71.14 O ATOM 1203 OD2 ASP A 76 1.383 12.537 4.426 1.00 21.53 O ATOM 0 H ASP A 76 1.868 14.906 6.778 1.00 54.44 H new ATOM 0 HA ASP A 76 2.167 12.817 8.636 1.00 52.20 H new ATOM 0 HB2 ASP A 76 1.014 11.484 6.757 1.00 42.11 H new ATOM 0 HB3 ASP A 76 0.159 12.871 7.403 1.00 42.11 H new ATOM 1208 N VAL A 77 4.094 12.574 5.965 1.00 62.21 N ATOM 1209 CA VAL A 77 5.386 12.080 5.486 1.00 50.04 C ATOM 1210 C VAL A 77 6.505 12.793 6.270 1.00 4.55 C ATOM 1211 O VAL A 77 6.744 13.984 6.083 1.00 44.42 O ATOM 1212 CB VAL A 77 5.531 12.296 3.923 1.00 22.12 C ATOM 1213 CG1 VAL A 77 6.976 12.061 3.422 1.00 2.20 C ATOM 1214 CG2 VAL A 77 4.551 11.377 3.162 1.00 32.45 C ATOM 0 H VAL A 77 3.645 13.229 5.325 1.00 62.21 H new ATOM 0 HA VAL A 77 5.461 11.006 5.659 1.00 50.04 H new ATOM 0 HB VAL A 77 5.286 13.339 3.723 1.00 22.12 H new ATOM 0 HG11 VAL A 77 7.018 12.222 2.345 1.00 2.20 H new ATOM 0 HG12 VAL A 77 7.651 12.757 3.920 1.00 2.20 H new ATOM 0 HG13 VAL A 77 7.278 11.038 3.648 1.00 2.20 H new ATOM 0 HG21 VAL A 77 4.662 11.536 2.089 1.00 32.45 H new ATOM 0 HG22 VAL A 77 4.770 10.336 3.399 1.00 32.45 H new ATOM 0 HG23 VAL A 77 3.529 11.609 3.460 1.00 32.45 H new ATOM 1224 N VAL A 78 7.129 12.050 7.196 1.00 71.22 N ATOM 1225 CA VAL A 78 8.259 12.540 8.008 1.00 22.11 C ATOM 1226 C VAL A 78 9.469 12.815 7.093 1.00 75.43 C ATOM 1227 O VAL A 78 10.089 13.885 7.156 1.00 12.10 O ATOM 1228 CB VAL A 78 8.639 11.487 9.125 1.00 74.32 C ATOM 1229 CG1 VAL A 78 9.787 11.988 10.031 1.00 34.44 C ATOM 1230 CG2 VAL A 78 7.395 11.085 9.956 1.00 42.23 C ATOM 0 H VAL A 78 6.865 11.087 7.406 1.00 71.22 H new ATOM 0 HA VAL A 78 7.966 13.466 8.502 1.00 22.11 H new ATOM 0 HB VAL A 78 9.006 10.595 8.617 1.00 74.32 H new ATOM 0 HG11 VAL A 78 10.013 11.232 10.783 1.00 34.44 H new ATOM 0 HG12 VAL A 78 10.674 12.174 9.425 1.00 34.44 H new ATOM 0 HG13 VAL A 78 9.484 12.911 10.525 1.00 34.44 H new ATOM 0 HG21 VAL A 78 7.684 10.360 10.717 1.00 42.23 H new ATOM 0 HG22 VAL A 78 6.978 11.969 10.437 1.00 42.23 H new ATOM 0 HG23 VAL A 78 6.646 10.642 9.299 1.00 42.23 H new ATOM 1240 N LYS A 79 9.774 11.825 6.231 1.00 15.12 N ATOM 1241 CA LYS A 79 10.836 11.905 5.202 1.00 34.32 C ATOM 1242 C LYS A 79 10.396 11.134 3.955 1.00 14.41 C ATOM 1243 O LYS A 79 9.658 10.155 4.066 1.00 60.15 O ATOM 1244 CB LYS A 79 12.182 11.298 5.709 1.00 3.43 C ATOM 1245 CG LYS A 79 12.863 12.082 6.849 1.00 40.54 C ATOM 1246 CD LYS A 79 14.193 11.439 7.307 1.00 0.14 C ATOM 1247 CE LYS A 79 14.023 9.994 7.799 1.00 72.01 C ATOM 1248 NZ LYS A 79 15.315 9.418 8.251 1.00 22.45 N ATOM 0 H LYS A 79 9.282 10.931 6.228 1.00 15.12 H new ATOM 0 HA LYS A 79 10.995 12.959 4.974 1.00 34.32 H new ATOM 0 HB2 LYS A 79 11.998 10.279 6.049 1.00 3.43 H new ATOM 0 HB3 LYS A 79 12.874 11.234 4.869 1.00 3.43 H new ATOM 0 HG2 LYS A 79 13.053 13.103 6.519 1.00 40.54 H new ATOM 0 HG3 LYS A 79 12.183 12.143 7.699 1.00 40.54 H new ATOM 0 HD2 LYS A 79 14.902 11.454 6.479 1.00 0.14 H new ATOM 0 HD3 LYS A 79 14.625 12.041 8.107 1.00 0.14 H new ATOM 0 HE2 LYS A 79 13.306 9.970 8.619 1.00 72.01 H new ATOM 0 HE3 LYS A 79 13.611 9.381 6.997 1.00 72.01 H new ATOM 0 HZ1 LYS A 79 15.165 8.442 8.577 1.00 22.45 H new ATOM 0 HZ2 LYS A 79 15.991 9.419 7.461 1.00 22.45 H new ATOM 0 HZ3 LYS A 79 15.695 9.989 9.033 1.00 22.45 H new ATOM 1262 N VAL A 80 10.846 11.586 2.776 1.00 22.34 N ATOM 1263 CA VAL A 80 10.686 10.846 1.505 1.00 73.23 C ATOM 1264 C VAL A 80 12.090 10.485 0.969 1.00 54.12 C ATOM 1265 O VAL A 80 13.070 11.203 1.229 1.00 74.12 O ATOM 1266 CB VAL A 80 9.865 11.666 0.429 1.00 52.30 C ATOM 1267 CG1 VAL A 80 10.665 12.866 -0.126 1.00 24.34 C ATOM 1268 CG2 VAL A 80 9.337 10.751 -0.713 1.00 31.33 C ATOM 0 H VAL A 80 11.333 12.476 2.671 1.00 22.34 H new ATOM 0 HA VAL A 80 10.111 9.940 1.698 1.00 73.23 H new ATOM 0 HB VAL A 80 8.997 12.077 0.944 1.00 52.30 H new ATOM 0 HG11 VAL A 80 10.060 13.398 -0.861 1.00 24.34 H new ATOM 0 HG12 VAL A 80 10.921 13.541 0.690 1.00 24.34 H new ATOM 0 HG13 VAL A 80 11.578 12.506 -0.600 1.00 24.34 H new ATOM 0 HG21 VAL A 80 8.779 11.351 -1.431 1.00 31.33 H new ATOM 0 HG22 VAL A 80 10.178 10.274 -1.215 1.00 31.33 H new ATOM 0 HG23 VAL A 80 8.683 9.986 -0.294 1.00 31.33 H new ATOM 1278 N GLN A 81 12.179 9.360 0.247 1.00 64.03 N ATOM 1279 CA GLN A 81 13.439 8.834 -0.302 1.00 31.15 C ATOM 1280 C GLN A 81 13.188 8.191 -1.670 1.00 43.31 C ATOM 1281 O GLN A 81 12.215 7.443 -1.853 1.00 20.30 O ATOM 1282 CB GLN A 81 14.063 7.753 0.627 1.00 65.33 C ATOM 1283 CG GLN A 81 14.611 8.235 1.984 1.00 52.51 C ATOM 1284 CD GLN A 81 15.243 7.113 2.830 1.00 51.31 C ATOM 1285 OE1 GLN A 81 15.214 7.164 4.056 1.00 4.31 O ATOM 1286 NE2 GLN A 81 15.819 6.091 2.193 1.00 34.02 N ATOM 0 H GLN A 81 11.369 8.782 0.024 1.00 64.03 H new ATOM 0 HA GLN A 81 14.127 9.675 -0.388 1.00 31.15 H new ATOM 0 HB2 GLN A 81 13.307 6.991 0.817 1.00 65.33 H new ATOM 0 HB3 GLN A 81 14.875 7.268 0.086 1.00 65.33 H new ATOM 0 HG2 GLN A 81 15.357 9.011 1.810 1.00 52.51 H new ATOM 0 HG3 GLN A 81 13.801 8.693 2.551 1.00 52.51 H new ATOM 0 HE21 GLN A 81 15.832 6.068 1.173 1.00 34.02 H new ATOM 0 HE22 GLN A 81 16.246 5.333 2.726 1.00 34.02 H new ATOM 1295 N ARG A 82 14.094 8.472 -2.611 1.00 34.31 N ATOM 1296 CA ARG A 82 14.146 7.796 -3.910 1.00 23.32 C ATOM 1297 C ARG A 82 15.248 6.726 -3.840 1.00 30.51 C ATOM 1298 O ARG A 82 16.439 7.054 -3.826 1.00 34.31 O ATOM 1299 CB ARG A 82 14.432 8.822 -5.041 1.00 54.24 C ATOM 1300 CG ARG A 82 13.397 9.963 -5.144 1.00 71.51 C ATOM 1301 CD ARG A 82 13.766 10.993 -6.229 1.00 35.44 C ATOM 1302 NE ARG A 82 13.838 10.384 -7.570 1.00 20.55 N ATOM 1303 CZ ARG A 82 14.186 11.020 -8.703 1.00 63.42 C ATOM 1304 NH1 ARG A 82 14.508 12.312 -8.691 1.00 3.13 N ATOM 1305 NH2 ARG A 82 14.208 10.353 -9.847 1.00 71.01 N ATOM 0 H ARG A 82 14.818 9.181 -2.491 1.00 34.31 H new ATOM 0 HA ARG A 82 13.189 7.325 -4.136 1.00 23.32 H new ATOM 0 HB2 ARG A 82 15.419 9.256 -4.880 1.00 54.24 H new ATOM 0 HB3 ARG A 82 14.468 8.294 -5.994 1.00 54.24 H new ATOM 0 HG2 ARG A 82 12.416 9.542 -5.365 1.00 71.51 H new ATOM 0 HG3 ARG A 82 13.318 10.466 -4.180 1.00 71.51 H new ATOM 0 HD2 ARG A 82 13.027 11.794 -6.234 1.00 35.44 H new ATOM 0 HD3 ARG A 82 14.726 11.447 -5.985 1.00 35.44 H new ATOM 0 HE ARG A 82 13.603 9.394 -7.645 1.00 20.55 H new ATOM 0 HH11 ARG A 82 14.493 12.833 -7.814 1.00 3.13 H new ATOM 0 HH12 ARG A 82 14.770 12.780 -9.558 1.00 3.13 H new ATOM 0 HH21 ARG A 82 13.962 9.363 -9.865 1.00 71.01 H new ATOM 0 HH22 ARG A 82 14.471 10.829 -10.710 1.00 71.01 H new ATOM 1319 N ASN A 83 14.839 5.459 -3.733 1.00 12.31 N ATOM 1320 CA ASN A 83 15.759 4.308 -3.649 1.00 31.20 C ATOM 1321 C ASN A 83 15.803 3.576 -4.995 1.00 42.12 C ATOM 1322 O ASN A 83 14.833 3.606 -5.769 1.00 42.04 O ATOM 1323 CB ASN A 83 15.335 3.313 -2.531 1.00 41.12 C ATOM 1324 CG ASN A 83 15.376 3.878 -1.106 1.00 21.22 C ATOM 1325 OD1 ASN A 83 15.172 5.069 -0.873 1.00 64.52 O ATOM 1326 ND2 ASN A 83 15.633 3.012 -0.139 1.00 30.13 N ATOM 0 H ASN A 83 13.854 5.195 -3.702 1.00 12.31 H new ATOM 0 HA ASN A 83 16.748 4.693 -3.402 1.00 31.20 H new ATOM 0 HB2 ASN A 83 14.322 2.967 -2.739 1.00 41.12 H new ATOM 0 HB3 ASN A 83 15.986 2.440 -2.578 1.00 41.12 H new ATOM 0 HD21 ASN A 83 15.666 3.326 0.831 1.00 30.13 H new ATOM 0 HD22 ASN A 83 15.798 2.031 -0.364 1.00 30.13 H new ATOM 1333 N GLN A 84 16.934 2.907 -5.244 1.00 43.42 N ATOM 1334 CA GLN A 84 17.145 2.107 -6.456 1.00 71.11 C ATOM 1335 C GLN A 84 16.576 0.695 -6.237 1.00 44.22 C ATOM 1336 O GLN A 84 16.698 0.125 -5.139 1.00 63.11 O ATOM 1337 CB GLN A 84 18.659 2.074 -6.817 1.00 3.32 C ATOM 1338 CG GLN A 84 19.597 1.545 -5.704 1.00 61.34 C ATOM 1339 CD GLN A 84 21.099 1.654 -6.027 1.00 32.14 C ATOM 1340 OE1 GLN A 84 21.896 0.813 -5.611 1.00 61.21 O ATOM 1341 NE2 GLN A 84 21.508 2.710 -6.724 1.00 24.50 N ATOM 0 H GLN A 84 17.732 2.905 -4.608 1.00 43.42 H new ATOM 0 HA GLN A 84 16.620 2.558 -7.298 1.00 71.11 H new ATOM 0 HB2 GLN A 84 18.790 1.454 -7.704 1.00 3.32 H new ATOM 0 HB3 GLN A 84 18.973 3.083 -7.084 1.00 3.32 H new ATOM 0 HG2 GLN A 84 19.395 2.095 -4.785 1.00 61.34 H new ATOM 0 HG3 GLN A 84 19.355 0.500 -5.509 1.00 61.34 H new ATOM 0 HE21 GLN A 84 20.829 3.394 -7.059 1.00 24.50 H new ATOM 0 HE22 GLN A 84 22.500 2.836 -6.924 1.00 24.50 H new ATOM 1350 N SER A 85 15.918 0.155 -7.276 1.00 72.50 N ATOM 1351 CA SER A 85 15.152 -1.094 -7.166 1.00 0.10 C ATOM 1352 C SER A 85 16.061 -2.325 -7.238 1.00 70.41 C ATOM 1353 O SER A 85 16.994 -2.384 -8.048 1.00 54.54 O ATOM 1354 CB SER A 85 14.042 -1.136 -8.234 1.00 23.12 C ATOM 1355 OG SER A 85 13.225 -2.289 -8.092 1.00 53.35 O ATOM 0 H SER A 85 15.903 0.569 -8.208 1.00 72.50 H new ATOM 0 HA SER A 85 14.677 -1.117 -6.185 1.00 0.10 H new ATOM 0 HB2 SER A 85 13.426 -0.240 -8.155 1.00 23.12 H new ATOM 0 HB3 SER A 85 14.491 -1.127 -9.227 1.00 23.12 H new ATOM 0 HG SER A 85 13.584 -3.014 -8.645 1.00 53.35 H new ATOM 1361 N ASP A 86 15.787 -3.283 -6.338 1.00 44.24 N ATOM 1362 CA ASP A 86 16.518 -4.549 -6.239 1.00 23.11 C ATOM 1363 C ASP A 86 15.563 -5.639 -5.678 1.00 72.24 C ATOM 1364 O ASP A 86 14.867 -5.377 -4.686 1.00 72.33 O ATOM 1365 CB ASP A 86 17.765 -4.362 -5.334 1.00 61.03 C ATOM 1366 CG ASP A 86 18.618 -5.627 -5.199 1.00 63.21 C ATOM 1367 OD1 ASP A 86 18.359 -6.431 -4.283 1.00 35.24 O ATOM 1368 OD2 ASP A 86 19.541 -5.826 -6.006 1.00 13.32 O ATOM 0 H ASP A 86 15.039 -3.195 -5.650 1.00 44.24 H new ATOM 0 HA ASP A 86 16.866 -4.866 -7.222 1.00 23.11 H new ATOM 0 HB2 ASP A 86 18.381 -3.560 -5.740 1.00 61.03 H new ATOM 0 HB3 ASP A 86 17.440 -4.045 -4.343 1.00 61.03 H new ATOM 1373 N PRO A 87 15.498 -6.865 -6.311 1.00 2.41 N ATOM 1374 CA PRO A 87 14.639 -7.993 -5.838 1.00 51.12 C ATOM 1375 C PRO A 87 14.857 -8.394 -4.358 1.00 52.20 C ATOM 1376 O PRO A 87 13.890 -8.472 -3.583 1.00 15.44 O ATOM 1377 CB PRO A 87 15.028 -9.156 -6.789 1.00 51.13 C ATOM 1378 CG PRO A 87 15.493 -8.477 -8.040 1.00 43.31 C ATOM 1379 CD PRO A 87 16.207 -7.228 -7.574 1.00 62.22 C ATOM 0 HA PRO A 87 13.585 -7.716 -5.867 1.00 51.12 H new ATOM 0 HB2 PRO A 87 15.814 -9.775 -6.358 1.00 51.13 H new ATOM 0 HB3 PRO A 87 14.178 -9.810 -6.985 1.00 51.13 H new ATOM 0 HG2 PRO A 87 16.160 -9.121 -8.612 1.00 43.31 H new ATOM 0 HG3 PRO A 87 14.653 -8.231 -8.689 1.00 43.31 H new ATOM 0 HD2 PRO A 87 17.267 -7.414 -7.399 1.00 62.22 H new ATOM 0 HD3 PRO A 87 16.142 -6.430 -8.313 1.00 62.22 H new ATOM 1387 N THR A 88 16.130 -8.620 -3.964 1.00 75.04 N ATOM 1388 CA THR A 88 16.455 -9.128 -2.613 1.00 63.42 C ATOM 1389 C THR A 88 16.301 -8.031 -1.555 1.00 45.10 C ATOM 1390 O THR A 88 16.034 -8.345 -0.400 1.00 21.42 O ATOM 1391 CB THR A 88 17.883 -9.768 -2.528 1.00 21.11 C ATOM 1392 OG1 THR A 88 18.891 -8.831 -2.914 1.00 64.01 O ATOM 1393 CG2 THR A 88 18.005 -11.025 -3.405 1.00 73.44 C ATOM 0 H THR A 88 16.944 -8.460 -4.558 1.00 75.04 H new ATOM 0 HA THR A 88 15.735 -9.921 -2.408 1.00 63.42 H new ATOM 0 HB THR A 88 18.030 -10.055 -1.487 1.00 21.11 H new ATOM 0 HG1 THR A 88 18.470 -8.052 -3.335 1.00 64.01 H new ATOM 0 HG21 THR A 88 19.011 -11.435 -3.315 1.00 73.44 H new ATOM 0 HG22 THR A 88 17.279 -11.769 -3.077 1.00 73.44 H new ATOM 0 HG23 THR A 88 17.812 -10.763 -4.445 1.00 73.44 H new ATOM 1401 N MET A 89 16.439 -6.751 -1.967 1.00 11.31 N ATOM 1402 CA MET A 89 16.230 -5.581 -1.079 1.00 35.54 C ATOM 1403 C MET A 89 14.814 -5.604 -0.480 1.00 30.34 C ATOM 1404 O MET A 89 14.635 -5.349 0.716 1.00 53.14 O ATOM 1405 CB MET A 89 16.458 -4.255 -1.856 1.00 23.25 C ATOM 1406 CG MET A 89 16.271 -2.973 -1.024 1.00 32.23 C ATOM 1407 SD MET A 89 17.393 -2.881 0.395 1.00 3.40 S ATOM 1408 CE MET A 89 16.938 -1.299 1.121 1.00 75.32 C ATOM 0 H MET A 89 16.697 -6.498 -2.921 1.00 11.31 H new ATOM 0 HA MET A 89 16.955 -5.638 -0.267 1.00 35.54 H new ATOM 0 HB2 MET A 89 17.468 -4.260 -2.265 1.00 23.25 H new ATOM 0 HB3 MET A 89 15.771 -4.224 -2.702 1.00 23.25 H new ATOM 0 HG2 MET A 89 16.431 -2.105 -1.663 1.00 32.23 H new ATOM 0 HG3 MET A 89 15.241 -2.923 -0.670 1.00 32.23 H new ATOM 0 HE1 MET A 89 17.550 -1.114 2.004 1.00 75.32 H new ATOM 0 HE2 MET A 89 17.101 -0.504 0.393 1.00 75.32 H new ATOM 0 HE3 MET A 89 15.886 -1.319 1.407 1.00 75.32 H new ATOM 1418 N PHE A 90 13.835 -5.961 -1.333 1.00 33.31 N ATOM 1419 CA PHE A 90 12.413 -6.070 -0.954 1.00 0.51 C ATOM 1420 C PHE A 90 12.224 -7.134 0.159 1.00 3.32 C ATOM 1421 O PHE A 90 11.458 -6.928 1.112 1.00 61.25 O ATOM 1422 CB PHE A 90 11.561 -6.405 -2.212 1.00 70.33 C ATOM 1423 CG PHE A 90 10.035 -6.335 -2.009 1.00 61.54 C ATOM 1424 CD1 PHE A 90 9.321 -7.429 -1.518 1.00 41.40 C ATOM 1425 CD2 PHE A 90 9.324 -5.173 -2.316 1.00 24.42 C ATOM 1426 CE1 PHE A 90 7.951 -7.370 -1.345 1.00 62.40 C ATOM 1427 CE2 PHE A 90 7.952 -5.113 -2.142 1.00 73.14 C ATOM 1428 CZ PHE A 90 7.267 -6.209 -1.655 1.00 61.13 C ATOM 0 H PHE A 90 14.010 -6.184 -2.313 1.00 33.31 H new ATOM 0 HA PHE A 90 12.073 -5.115 -0.552 1.00 0.51 H new ATOM 0 HB2 PHE A 90 11.837 -5.717 -3.012 1.00 70.33 H new ATOM 0 HB3 PHE A 90 11.821 -7.408 -2.550 1.00 70.33 H new ATOM 0 HD1 PHE A 90 9.848 -8.338 -1.269 1.00 41.40 H new ATOM 0 HD2 PHE A 90 9.851 -4.310 -2.694 1.00 24.42 H new ATOM 0 HE1 PHE A 90 7.416 -8.229 -0.968 1.00 62.40 H new ATOM 0 HE2 PHE A 90 7.416 -4.208 -2.387 1.00 73.14 H new ATOM 0 HZ PHE A 90 6.197 -6.159 -1.516 1.00 61.13 H new ATOM 1438 N ASN A 91 12.957 -8.253 0.029 1.00 75.51 N ATOM 1439 CA ASN A 91 12.910 -9.365 1.001 1.00 23.32 C ATOM 1440 C ASN A 91 13.578 -8.957 2.335 1.00 1.12 C ATOM 1441 O ASN A 91 13.078 -9.300 3.412 1.00 54.21 O ATOM 1442 CB ASN A 91 13.602 -10.621 0.406 1.00 41.41 C ATOM 1443 CG ASN A 91 13.570 -11.845 1.340 1.00 60.53 C ATOM 1444 OD1 ASN A 91 14.488 -12.060 2.137 1.00 13.51 O ATOM 1445 ND2 ASN A 91 12.521 -12.653 1.245 1.00 55.04 N ATOM 0 H ASN A 91 13.597 -8.414 -0.749 1.00 75.51 H new ATOM 0 HA ASN A 91 11.866 -9.603 1.206 1.00 23.32 H new ATOM 0 HB2 ASN A 91 13.118 -10.880 -0.535 1.00 41.41 H new ATOM 0 HB3 ASN A 91 14.639 -10.378 0.175 1.00 41.41 H new ATOM 0 HD21 ASN A 91 12.458 -13.479 1.841 1.00 55.04 H new ATOM 0 HD22 ASN A 91 11.778 -12.448 0.576 1.00 55.04 H new ATOM 1452 N LYS A 92 14.708 -8.214 2.234 1.00 44.54 N ATOM 1453 CA LYS A 92 15.494 -7.754 3.405 1.00 70.55 C ATOM 1454 C LYS A 92 14.647 -6.879 4.338 1.00 50.43 C ATOM 1455 O LYS A 92 14.516 -7.173 5.521 1.00 24.41 O ATOM 1456 CB LYS A 92 16.757 -6.967 2.963 1.00 11.32 C ATOM 1457 CG LYS A 92 17.779 -7.794 2.159 1.00 73.44 C ATOM 1458 CD LYS A 92 18.957 -6.941 1.630 1.00 3.32 C ATOM 1459 CE LYS A 92 19.857 -7.721 0.658 1.00 35.52 C ATOM 1460 NZ LYS A 92 21.007 -6.903 0.192 1.00 4.41 N ATOM 0 H LYS A 92 15.099 -7.918 1.340 1.00 44.54 H new ATOM 0 HA LYS A 92 15.806 -8.647 3.947 1.00 70.55 H new ATOM 0 HB2 LYS A 92 16.445 -6.114 2.360 1.00 11.32 H new ATOM 0 HB3 LYS A 92 17.249 -6.568 3.850 1.00 11.32 H new ATOM 0 HG2 LYS A 92 18.169 -8.593 2.789 1.00 73.44 H new ATOM 0 HG3 LYS A 92 17.274 -8.269 1.318 1.00 73.44 H new ATOM 0 HD2 LYS A 92 18.565 -6.057 1.127 1.00 3.32 H new ATOM 0 HD3 LYS A 92 19.554 -6.590 2.472 1.00 3.32 H new ATOM 0 HE2 LYS A 92 20.227 -8.621 1.148 1.00 35.52 H new ATOM 0 HE3 LYS A 92 19.269 -8.044 -0.201 1.00 35.52 H new ATOM 0 HZ1 LYS A 92 21.590 -7.464 -0.461 1.00 4.41 H new ATOM 0 HZ2 LYS A 92 20.655 -6.056 -0.298 1.00 4.41 H new ATOM 0 HZ3 LYS A 92 21.582 -6.615 1.009 1.00 4.41 H new ATOM 1474 N ILE A 93 14.054 -5.818 3.771 1.00 64.02 N ATOM 1475 CA ILE A 93 13.235 -4.843 4.517 1.00 25.25 C ATOM 1476 C ILE A 93 11.935 -5.494 5.041 1.00 14.03 C ATOM 1477 O ILE A 93 11.420 -5.084 6.083 1.00 14.45 O ATOM 1478 CB ILE A 93 12.920 -3.591 3.612 1.00 22.31 C ATOM 1479 CG1 ILE A 93 12.180 -4.048 2.316 1.00 43.10 C ATOM 1480 CG2 ILE A 93 14.211 -2.799 3.291 1.00 41.10 C ATOM 1481 CD1 ILE A 93 12.120 -3.053 1.163 1.00 44.25 C ATOM 0 H ILE A 93 14.128 -5.608 2.776 1.00 64.02 H new ATOM 0 HA ILE A 93 13.804 -4.506 5.384 1.00 25.25 H new ATOM 0 HB ILE A 93 12.262 -2.914 4.157 1.00 22.31 H new ATOM 0 HG12 ILE A 93 12.662 -4.956 1.954 1.00 43.10 H new ATOM 0 HG13 ILE A 93 11.158 -4.315 2.586 1.00 43.10 H new ATOM 0 HG21 ILE A 93 13.965 -1.941 2.666 1.00 41.10 H new ATOM 0 HG22 ILE A 93 14.666 -2.453 4.219 1.00 41.10 H new ATOM 0 HG23 ILE A 93 14.912 -3.445 2.762 1.00 41.10 H new ATOM 0 HD11 ILE A 93 11.579 -3.497 0.327 1.00 44.25 H new ATOM 0 HD12 ILE A 93 11.606 -2.149 1.489 1.00 44.25 H new ATOM 0 HD13 ILE A 93 13.132 -2.801 0.847 1.00 44.25 H new ATOM 1493 N ALA A 94 11.428 -6.513 4.310 1.00 41.42 N ATOM 1494 CA ALA A 94 10.242 -7.291 4.718 1.00 54.23 C ATOM 1495 C ALA A 94 10.506 -8.121 5.999 1.00 64.21 C ATOM 1496 O ALA A 94 9.685 -8.126 6.927 1.00 52.44 O ATOM 1497 CB ALA A 94 9.787 -8.202 3.567 1.00 33.41 C ATOM 0 H ALA A 94 11.830 -6.816 3.423 1.00 41.42 H new ATOM 0 HA ALA A 94 9.446 -6.584 4.951 1.00 54.23 H new ATOM 0 HB1 ALA A 94 8.911 -8.772 3.878 1.00 33.41 H new ATOM 0 HB2 ALA A 94 9.534 -7.593 2.699 1.00 33.41 H new ATOM 0 HB3 ALA A 94 10.593 -8.888 3.306 1.00 33.41 H new ATOM 1503 N VAL A 95 11.666 -8.808 6.044 1.00 73.35 N ATOM 1504 CA VAL A 95 12.009 -9.745 7.144 1.00 20.23 C ATOM 1505 C VAL A 95 12.686 -9.009 8.323 1.00 64.53 C ATOM 1506 O VAL A 95 12.627 -9.471 9.469 1.00 44.14 O ATOM 1507 CB VAL A 95 12.927 -10.927 6.630 1.00 51.33 C ATOM 1508 CG1 VAL A 95 14.336 -10.435 6.225 1.00 33.43 C ATOM 1509 CG2 VAL A 95 13.002 -12.083 7.662 1.00 32.41 C ATOM 0 H VAL A 95 12.388 -8.733 5.328 1.00 73.35 H new ATOM 0 HA VAL A 95 11.073 -10.173 7.504 1.00 20.23 H new ATOM 0 HB VAL A 95 12.458 -11.323 5.729 1.00 51.33 H new ATOM 0 HG11 VAL A 95 14.931 -11.280 5.879 1.00 33.43 H new ATOM 0 HG12 VAL A 95 14.249 -9.700 5.424 1.00 33.43 H new ATOM 0 HG13 VAL A 95 14.823 -9.977 7.086 1.00 33.43 H new ATOM 0 HG21 VAL A 95 13.641 -12.876 7.274 1.00 32.41 H new ATOM 0 HG22 VAL A 95 13.416 -11.709 8.598 1.00 32.41 H new ATOM 0 HG23 VAL A 95 12.002 -12.477 7.840 1.00 32.41 H new ATOM 1519 N PHE A 96 13.322 -7.863 8.041 1.00 73.41 N ATOM 1520 CA PHE A 96 14.018 -7.060 9.067 1.00 45.54 C ATOM 1521 C PHE A 96 13.010 -6.131 9.760 1.00 3.55 C ATOM 1522 O PHE A 96 13.084 -5.935 10.971 1.00 51.33 O ATOM 1523 CB PHE A 96 15.176 -6.249 8.420 1.00 34.42 C ATOM 1524 CG PHE A 96 16.222 -5.727 9.409 1.00 4.00 C ATOM 1525 CD1 PHE A 96 17.268 -6.550 9.842 1.00 72.21 C ATOM 1526 CD2 PHE A 96 16.169 -4.428 9.905 1.00 51.42 C ATOM 1527 CE1 PHE A 96 18.219 -6.086 10.731 1.00 1.33 C ATOM 1528 CE2 PHE A 96 17.120 -3.965 10.794 1.00 2.44 C ATOM 1529 CZ PHE A 96 18.145 -4.792 11.207 1.00 73.34 C ATOM 0 H PHE A 96 13.371 -7.465 7.103 1.00 73.41 H new ATOM 0 HA PHE A 96 14.453 -7.722 9.816 1.00 45.54 H new ATOM 0 HB2 PHE A 96 15.675 -6.879 7.683 1.00 34.42 H new ATOM 0 HB3 PHE A 96 14.751 -5.402 7.881 1.00 34.42 H new ATOM 0 HD1 PHE A 96 17.333 -7.564 9.476 1.00 72.21 H new ATOM 0 HD2 PHE A 96 15.372 -3.771 9.590 1.00 51.42 H new ATOM 0 HE1 PHE A 96 19.020 -6.735 11.053 1.00 1.33 H new ATOM 0 HE2 PHE A 96 17.061 -2.953 11.167 1.00 2.44 H new ATOM 0 HZ PHE A 96 18.888 -4.428 11.901 1.00 73.34 H new ATOM 1539 N PHE A 97 12.063 -5.601 8.941 1.00 52.23 N ATOM 1540 CA PHE A 97 10.960 -4.687 9.343 1.00 55.14 C ATOM 1541 C PHE A 97 11.388 -3.569 10.335 1.00 42.11 C ATOM 1542 O PHE A 97 10.722 -3.317 11.348 1.00 24.33 O ATOM 1543 CB PHE A 97 9.648 -5.466 9.777 1.00 60.34 C ATOM 1544 CG PHE A 97 9.769 -6.519 10.899 1.00 3.02 C ATOM 1545 CD1 PHE A 97 10.104 -7.843 10.609 1.00 12.44 C ATOM 1546 CD2 PHE A 97 9.521 -6.189 12.235 1.00 25.53 C ATOM 1547 CE1 PHE A 97 10.195 -8.796 11.610 1.00 75.30 C ATOM 1548 CE2 PHE A 97 9.614 -7.143 13.236 1.00 1.05 C ATOM 1549 CZ PHE A 97 9.953 -8.446 12.924 1.00 11.44 C ATOM 0 H PHE A 97 12.047 -5.807 7.942 1.00 52.23 H new ATOM 0 HA PHE A 97 10.692 -4.142 8.438 1.00 55.14 H new ATOM 0 HB2 PHE A 97 8.909 -4.728 10.090 1.00 60.34 H new ATOM 0 HB3 PHE A 97 9.247 -5.963 8.894 1.00 60.34 H new ATOM 0 HD1 PHE A 97 10.296 -8.129 9.585 1.00 12.44 H new ATOM 0 HD2 PHE A 97 9.253 -5.175 12.491 1.00 25.53 H new ATOM 0 HE1 PHE A 97 10.456 -9.814 11.363 1.00 75.30 H new ATOM 0 HE2 PHE A 97 9.421 -6.868 14.262 1.00 1.05 H new ATOM 0 HZ PHE A 97 10.028 -9.188 13.705 1.00 11.44 H new ATOM 1559 N GLN A 98 12.503 -2.885 9.999 1.00 51.20 N ATOM 1560 CA GLN A 98 13.073 -1.791 10.811 1.00 20.22 C ATOM 1561 C GLN A 98 13.982 -0.911 9.920 1.00 43.22 C ATOM 1562 O GLN A 98 14.968 -1.434 9.366 1.00 74.22 O ATOM 1563 CB GLN A 98 13.867 -2.372 12.016 1.00 42.14 C ATOM 1564 CG GLN A 98 14.465 -1.335 12.987 1.00 41.10 C ATOM 1565 CD GLN A 98 13.432 -0.460 13.709 1.00 13.34 C ATOM 1566 OE1 GLN A 98 12.291 -0.866 13.950 1.00 13.41 O ATOM 1567 NE2 GLN A 98 13.836 0.744 14.083 1.00 44.32 N ATOM 1568 OXT GLN A 98 13.711 0.301 9.765 1.00 38.34 O ATOM 0 H GLN A 98 13.035 -3.079 9.151 1.00 51.20 H new ATOM 0 HA GLN A 98 12.267 -1.174 11.208 1.00 20.22 H new ATOM 0 HB2 GLN A 98 13.206 -3.030 12.579 1.00 42.14 H new ATOM 0 HB3 GLN A 98 14.678 -2.990 11.629 1.00 42.14 H new ATOM 0 HG2 GLN A 98 15.062 -1.859 13.733 1.00 41.10 H new ATOM 0 HG3 GLN A 98 15.144 -0.688 12.432 1.00 41.10 H new ATOM 0 HE21 GLN A 98 14.785 1.053 13.870 1.00 44.32 H new ATOM 0 HE22 GLN A 98 13.199 1.363 14.584 1.00 44.32 H new TER 1577 GLN A 98 ATOM 1578 N GLY B 1 -5.148 -3.118 19.988 1.00 51.31 N ATOM 1579 CA GLY B 1 -5.834 -3.648 21.193 1.00 43.52 C ATOM 1580 C GLY B 1 -5.180 -3.189 22.491 1.00 1.25 C ATOM 1581 O GLY B 1 -5.847 -2.608 23.353 1.00 23.33 O ATOM 0 H1 GLY B 1 -5.775 -3.209 19.163 1.00 51.31 H new ATOM 0 H2 GLY B 1 -4.913 -2.116 20.135 1.00 51.31 H new ATOM 0 H3 GLY B 1 -4.275 -3.657 19.820 1.00 51.31 H new ATOM 0 HA2 GLY B 1 -6.876 -3.328 21.183 1.00 43.52 H new ATOM 0 HA3 GLY B 1 -5.834 -4.737 21.156 1.00 43.52 H new ATOM 1587 N SER B 2 -3.861 -3.438 22.617 1.00 13.15 N ATOM 1588 CA SER B 2 -3.090 -3.093 23.828 1.00 1.20 C ATOM 1589 C SER B 2 -1.575 -3.065 23.505 1.00 25.34 C ATOM 1590 O SER B 2 -1.181 -3.263 22.345 1.00 3.45 O ATOM 1591 CB SER B 2 -3.413 -4.110 24.958 1.00 44.13 C ATOM 1592 OG SER B 2 -2.821 -3.737 26.187 1.00 54.34 O ATOM 0 H SER B 2 -3.303 -3.881 21.887 1.00 13.15 H new ATOM 0 HA SER B 2 -3.373 -2.099 24.173 1.00 1.20 H new ATOM 0 HB2 SER B 2 -4.493 -4.183 25.083 1.00 44.13 H new ATOM 0 HB3 SER B 2 -3.058 -5.099 24.669 1.00 44.13 H new ATOM 0 HG SER B 2 -3.047 -4.399 26.873 1.00 54.34 H new ATOM 1598 N MET B 3 -0.747 -2.798 24.546 1.00 53.12 N ATOM 1599 CA MET B 3 0.727 -2.741 24.435 1.00 54.01 C ATOM 1600 C MET B 3 1.291 -4.139 24.126 1.00 20.14 C ATOM 1601 O MET B 3 1.564 -4.924 25.039 1.00 62.10 O ATOM 1602 CB MET B 3 1.355 -2.199 25.758 1.00 25.33 C ATOM 1603 CG MET B 3 0.918 -0.789 26.152 1.00 3.45 C ATOM 1604 SD MET B 3 1.531 -0.296 27.782 1.00 31.41 S ATOM 1605 CE MET B 3 3.315 -0.365 27.561 1.00 54.42 C ATOM 0 H MET B 3 -1.088 -2.616 25.490 1.00 53.12 H new ATOM 0 HA MET B 3 0.984 -2.064 23.621 1.00 54.01 H new ATOM 0 HB2 MET B 3 1.101 -2.881 26.569 1.00 25.33 H new ATOM 0 HB3 MET B 3 2.440 -2.212 25.659 1.00 25.33 H new ATOM 0 HG2 MET B 3 1.275 -0.080 25.405 1.00 3.45 H new ATOM 0 HG3 MET B 3 -0.171 -0.736 26.147 1.00 3.45 H new ATOM 0 HE1 MET B 3 3.805 0.130 28.400 1.00 54.42 H new ATOM 0 HE2 MET B 3 3.636 -1.406 27.516 1.00 54.42 H new ATOM 0 HE3 MET B 3 3.586 0.139 26.633 1.00 54.42 H new ATOM 1615 N GLN B 4 1.394 -4.461 22.827 1.00 11.53 N ATOM 1616 CA GLN B 4 1.962 -5.734 22.340 1.00 62.40 C ATOM 1617 C GLN B 4 2.864 -5.456 21.127 1.00 70.21 C ATOM 1618 O GLN B 4 2.796 -4.374 20.535 1.00 22.50 O ATOM 1619 CB GLN B 4 0.833 -6.737 21.940 1.00 34.11 C ATOM 1620 CG GLN B 4 -0.164 -7.088 23.069 1.00 51.35 C ATOM 1621 CD GLN B 4 -1.169 -8.204 22.722 1.00 22.04 C ATOM 1622 OE1 GLN B 4 -1.614 -8.940 23.603 1.00 12.22 O ATOM 1623 NE2 GLN B 4 -1.543 -8.339 21.452 1.00 13.11 N ATOM 0 H GLN B 4 1.084 -3.843 22.077 1.00 11.53 H new ATOM 0 HA GLN B 4 2.546 -6.184 23.143 1.00 62.40 H new ATOM 0 HB2 GLN B 4 0.276 -6.318 21.102 1.00 34.11 H new ATOM 0 HB3 GLN B 4 1.296 -7.658 21.586 1.00 34.11 H new ATOM 0 HG2 GLN B 4 0.400 -7.389 23.952 1.00 51.35 H new ATOM 0 HG3 GLN B 4 -0.719 -6.189 23.336 1.00 51.35 H new ATOM 0 HE21 GLN B 4 -1.161 -7.718 20.739 1.00 13.11 H new ATOM 0 HE22 GLN B 4 -2.212 -9.064 21.192 1.00 13.11 H new ATOM 1632 N ASN B 5 3.695 -6.450 20.759 1.00 60.22 N ATOM 1633 CA ASN B 5 4.504 -6.424 19.511 1.00 11.41 C ATOM 1634 C ASN B 5 3.594 -6.653 18.273 1.00 33.14 C ATOM 1635 O ASN B 5 2.366 -6.515 18.387 1.00 35.32 O ATOM 1636 CB ASN B 5 5.656 -7.480 19.606 1.00 55.20 C ATOM 1637 CG ASN B 5 5.188 -8.942 19.758 1.00 41.31 C ATOM 1638 OD1 ASN B 5 4.104 -9.224 20.271 1.00 5.13 O ATOM 1639 ND2 ASN B 5 6.023 -9.887 19.351 1.00 72.45 N ATOM 0 H ASN B 5 3.829 -7.296 21.313 1.00 60.22 H new ATOM 0 HA ASN B 5 4.964 -5.443 19.391 1.00 11.41 H new ATOM 0 HB2 ASN B 5 6.274 -7.403 18.711 1.00 55.20 H new ATOM 0 HB3 ASN B 5 6.291 -7.227 20.455 1.00 55.20 H new ATOM 0 HD21 ASN B 5 5.773 -10.870 19.460 1.00 72.45 H new ATOM 0 HD22 ASN B 5 6.916 -9.632 18.929 1.00 72.45 H new ATOM 1646 N THR B 6 4.176 -6.962 17.086 1.00 43.33 N ATOM 1647 CA THR B 6 3.377 -7.215 15.863 1.00 64.04 C ATOM 1648 C THR B 6 2.573 -8.535 16.005 1.00 0.43 C ATOM 1649 O THR B 6 3.007 -9.616 15.581 1.00 23.51 O ATOM 1650 CB THR B 6 4.255 -7.213 14.557 1.00 0.45 C ATOM 1651 OG1 THR B 6 5.349 -8.140 14.677 1.00 41.31 O ATOM 1652 CG2 THR B 6 4.811 -5.806 14.244 1.00 51.10 C ATOM 0 H THR B 6 5.184 -7.041 16.952 1.00 43.33 H new ATOM 0 HA THR B 6 2.673 -6.390 15.758 1.00 64.04 H new ATOM 0 HB THR B 6 3.606 -7.519 13.737 1.00 0.45 H new ATOM 0 HG1 THR B 6 5.010 -9.009 14.978 1.00 41.31 H new ATOM 0 HG21 THR B 6 5.412 -5.846 13.335 1.00 51.10 H new ATOM 0 HG22 THR B 6 3.983 -5.111 14.102 1.00 51.10 H new ATOM 0 HG23 THR B 6 5.431 -5.467 15.074 1.00 51.10 H new ATOM 1660 N THR B 7 1.416 -8.403 16.668 1.00 14.14 N ATOM 1661 CA THR B 7 0.492 -9.500 16.991 1.00 42.44 C ATOM 1662 C THR B 7 -0.671 -9.510 15.990 1.00 14.40 C ATOM 1663 O THR B 7 -0.787 -8.595 15.166 1.00 61.15 O ATOM 1664 CB THR B 7 -0.049 -9.329 18.461 1.00 23.12 C ATOM 1665 OG1 THR B 7 -0.410 -7.951 18.705 1.00 21.51 O ATOM 1666 CG2 THR B 7 0.983 -9.776 19.513 1.00 62.20 C ATOM 0 H THR B 7 1.086 -7.499 17.006 1.00 14.14 H new ATOM 0 HA THR B 7 1.022 -10.450 16.923 1.00 42.44 H new ATOM 0 HB THR B 7 -0.928 -9.967 18.554 1.00 23.12 H new ATOM 0 HG1 THR B 7 0.227 -7.552 19.334 1.00 21.51 H new ATOM 0 HG21 THR B 7 0.567 -9.640 20.511 1.00 62.20 H new ATOM 0 HG22 THR B 7 1.226 -10.828 19.361 1.00 62.20 H new ATOM 0 HG23 THR B 7 1.888 -9.177 19.413 1.00 62.20 H new ATOM 1674 N HIS B 8 -1.560 -10.518 16.099 1.00 61.12 N ATOM 1675 CA HIS B 8 -2.702 -10.693 15.165 1.00 14.00 C ATOM 1676 C HIS B 8 -3.919 -9.797 15.541 1.00 54.22 C ATOM 1677 O HIS B 8 -5.063 -10.141 15.241 1.00 31.42 O ATOM 1678 CB HIS B 8 -3.094 -12.207 15.055 1.00 20.05 C ATOM 1679 CG HIS B 8 -3.635 -12.845 16.316 1.00 12.02 C ATOM 1680 ND1 HIS B 8 -4.882 -12.558 16.824 1.00 41.40 N ATOM 1681 CD2 HIS B 8 -3.107 -13.776 17.153 1.00 44.34 C ATOM 1682 CE1 HIS B 8 -5.100 -13.272 17.905 1.00 35.54 C ATOM 1683 NE2 HIS B 8 -4.041 -14.020 18.132 1.00 43.43 N ATOM 0 H HIS B 8 -1.512 -11.230 16.828 1.00 61.12 H new ATOM 0 HA HIS B 8 -2.378 -10.357 14.180 1.00 14.00 H new ATOM 0 HB2 HIS B 8 -3.842 -12.312 14.269 1.00 20.05 H new ATOM 0 HB3 HIS B 8 -2.215 -12.767 14.736 1.00 20.05 H new ATOM 0 HD1 HIS B 8 -5.539 -11.890 16.421 1.00 41.40 H new ATOM 0 HD2 HIS B 8 -2.135 -14.238 17.066 1.00 44.34 H new ATOM 0 HE1 HIS B 8 -5.997 -13.249 18.506 1.00 35.54 H new ATOM 1692 N ASP B 9 -3.650 -8.630 16.172 1.00 43.31 N ATOM 1693 CA ASP B 9 -4.663 -7.566 16.407 1.00 51.23 C ATOM 1694 C ASP B 9 -5.141 -7.001 15.060 1.00 51.41 C ATOM 1695 O ASP B 9 -6.297 -6.599 14.894 1.00 32.31 O ATOM 1696 CB ASP B 9 -4.051 -6.435 17.280 1.00 24.23 C ATOM 1697 CG ASP B 9 -5.045 -5.298 17.597 1.00 44.32 C ATOM 1698 OD1 ASP B 9 -6.003 -5.534 18.360 1.00 63.00 O ATOM 1699 OD2 ASP B 9 -4.869 -4.158 17.111 1.00 0.22 O ATOM 0 H ASP B 9 -2.725 -8.396 16.534 1.00 43.31 H new ATOM 0 HA ASP B 9 -5.516 -7.991 16.935 1.00 51.23 H new ATOM 0 HB2 ASP B 9 -3.690 -6.863 18.215 1.00 24.23 H new ATOM 0 HB3 ASP B 9 -3.185 -6.018 16.766 1.00 24.23 H new ATOM 1704 N ASN B 10 -4.211 -6.984 14.109 1.00 63.10 N ATOM 1705 CA ASN B 10 -4.482 -6.654 12.711 1.00 64.40 C ATOM 1706 C ASN B 10 -5.095 -7.877 11.989 1.00 23.54 C ATOM 1707 O ASN B 10 -5.006 -9.014 12.474 1.00 63.34 O ATOM 1708 CB ASN B 10 -3.163 -6.201 12.022 1.00 52.13 C ATOM 1709 CG ASN B 10 -2.076 -7.296 11.961 1.00 64.20 C ATOM 1710 OD1 ASN B 10 -2.059 -8.233 12.758 1.00 53.14 O ATOM 1711 ND2 ASN B 10 -1.133 -7.158 11.054 1.00 52.20 N ATOM 0 H ASN B 10 -3.231 -7.203 14.290 1.00 63.10 H new ATOM 0 HA ASN B 10 -5.201 -5.836 12.658 1.00 64.40 H new ATOM 0 HB2 ASN B 10 -3.390 -5.872 11.008 1.00 52.13 H new ATOM 0 HB3 ASN B 10 -2.765 -5.338 12.555 1.00 52.13 H new ATOM 0 HD21 ASN B 10 -0.371 -7.834 11.003 1.00 52.20 H new ATOM 0 HD22 ASN B 10 -1.164 -6.375 10.401 1.00 52.20 H new ATOM 1718 N VAL B 11 -5.712 -7.635 10.833 1.00 45.20 N ATOM 1719 CA VAL B 11 -6.289 -8.687 9.980 1.00 53.35 C ATOM 1720 C VAL B 11 -5.771 -8.478 8.569 1.00 71.33 C ATOM 1721 O VAL B 11 -5.515 -7.341 8.152 1.00 5.33 O ATOM 1722 CB VAL B 11 -7.871 -8.726 9.987 1.00 54.43 C ATOM 1723 CG1 VAL B 11 -8.406 -9.101 11.389 1.00 14.31 C ATOM 1724 CG2 VAL B 11 -8.501 -7.400 9.480 1.00 51.41 C ATOM 0 H VAL B 11 -5.829 -6.695 10.454 1.00 45.20 H new ATOM 0 HA VAL B 11 -5.979 -9.651 10.383 1.00 53.35 H new ATOM 0 HB VAL B 11 -8.174 -9.502 9.284 1.00 54.43 H new ATOM 0 HG11 VAL B 11 -9.496 -9.121 11.369 1.00 14.31 H new ATOM 0 HG12 VAL B 11 -8.030 -10.084 11.671 1.00 14.31 H new ATOM 0 HG13 VAL B 11 -8.070 -8.362 12.116 1.00 14.31 H new ATOM 0 HG21 VAL B 11 -9.588 -7.481 9.505 1.00 51.41 H new ATOM 0 HG22 VAL B 11 -8.183 -6.578 10.121 1.00 51.41 H new ATOM 0 HG23 VAL B 11 -8.175 -7.210 8.457 1.00 51.41 H new ATOM 1734 N ILE B 12 -5.605 -9.581 7.844 1.00 61.31 N ATOM 1735 CA ILE B 12 -4.994 -9.575 6.520 1.00 33.04 C ATOM 1736 C ILE B 12 -6.112 -9.548 5.470 1.00 3.02 C ATOM 1737 O ILE B 12 -6.588 -10.585 5.015 1.00 23.20 O ATOM 1738 CB ILE B 12 -4.072 -10.844 6.358 1.00 75.00 C ATOM 1739 CG1 ILE B 12 -3.068 -10.984 7.536 1.00 1.33 C ATOM 1740 CG2 ILE B 12 -3.311 -10.828 5.036 1.00 63.42 C ATOM 1741 CD1 ILE B 12 -1.984 -9.928 7.628 1.00 51.01 C ATOM 0 H ILE B 12 -5.892 -10.507 8.161 1.00 61.31 H new ATOM 0 HA ILE B 12 -4.367 -8.694 6.386 1.00 33.04 H new ATOM 0 HB ILE B 12 -4.738 -11.707 6.365 1.00 75.00 H new ATOM 0 HG12 ILE B 12 -3.632 -10.976 8.468 1.00 1.33 H new ATOM 0 HG13 ILE B 12 -2.588 -11.960 7.462 1.00 1.33 H new ATOM 0 HG21 ILE B 12 -2.688 -11.719 4.964 1.00 63.42 H new ATOM 0 HG22 ILE B 12 -4.020 -10.813 4.208 1.00 63.42 H new ATOM 0 HG23 ILE B 12 -2.681 -9.940 4.990 1.00 63.42 H new ATOM 0 HD11 ILE B 12 -1.348 -10.134 8.489 1.00 51.01 H new ATOM 0 HD12 ILE B 12 -1.382 -9.945 6.720 1.00 51.01 H new ATOM 0 HD13 ILE B 12 -2.442 -8.945 7.742 1.00 51.01 H new ATOM 1753 N LEU B 13 -6.566 -8.344 5.122 1.00 34.13 N ATOM 1754 CA LEU B 13 -7.629 -8.165 4.133 1.00 72.24 C ATOM 1755 C LEU B 13 -7.003 -8.085 2.751 1.00 51.24 C ATOM 1756 O LEU B 13 -6.639 -6.999 2.293 1.00 32.00 O ATOM 1757 CB LEU B 13 -8.454 -6.888 4.430 1.00 32.10 C ATOM 1758 CG LEU B 13 -9.147 -6.840 5.818 1.00 54.33 C ATOM 1759 CD1 LEU B 13 -9.963 -5.546 5.980 1.00 22.35 C ATOM 1760 CD2 LEU B 13 -10.014 -8.097 6.061 1.00 23.02 C ATOM 0 H LEU B 13 -6.211 -7.472 5.514 1.00 34.13 H new ATOM 0 HA LEU B 13 -8.311 -9.014 4.180 1.00 72.24 H new ATOM 0 HB2 LEU B 13 -7.795 -6.024 4.344 1.00 32.10 H new ATOM 0 HB3 LEU B 13 -9.218 -6.784 3.660 1.00 32.10 H new ATOM 0 HG LEU B 13 -8.369 -6.837 6.581 1.00 54.33 H new ATOM 0 HD11 LEU B 13 -10.439 -5.536 6.961 1.00 22.35 H new ATOM 0 HD12 LEU B 13 -9.301 -4.685 5.889 1.00 22.35 H new ATOM 0 HD13 LEU B 13 -10.728 -5.499 5.205 1.00 22.35 H new ATOM 0 HD21 LEU B 13 -10.484 -8.030 7.042 1.00 23.02 H new ATOM 0 HD22 LEU B 13 -10.784 -8.162 5.293 1.00 23.02 H new ATOM 0 HD23 LEU B 13 -9.385 -8.986 6.020 1.00 23.02 H new ATOM 1772 N GLU B 14 -6.833 -9.243 2.102 1.00 44.34 N ATOM 1773 CA GLU B 14 -6.245 -9.271 0.765 1.00 74.30 C ATOM 1774 C GLU B 14 -7.347 -9.127 -0.257 1.00 41.12 C ATOM 1775 O GLU B 14 -8.448 -9.645 -0.084 1.00 4.21 O ATOM 1776 CB GLU B 14 -5.412 -10.537 0.479 1.00 72.14 C ATOM 1777 CG GLU B 14 -6.176 -11.864 0.340 1.00 63.04 C ATOM 1778 CD GLU B 14 -5.332 -12.974 -0.317 1.00 0.25 C ATOM 1779 OE1 GLU B 14 -4.610 -13.705 0.396 1.00 15.43 O ATOM 1780 OE2 GLU B 14 -5.372 -13.096 -1.564 1.00 22.44 O ATOM 0 H GLU B 14 -7.090 -10.156 2.476 1.00 44.34 H new ATOM 0 HA GLU B 14 -5.546 -8.437 0.703 1.00 74.30 H new ATOM 0 HB2 GLU B 14 -4.851 -10.372 -0.441 1.00 72.14 H new ATOM 0 HB3 GLU B 14 -4.682 -10.650 1.281 1.00 72.14 H new ATOM 0 HG2 GLU B 14 -6.500 -12.196 1.326 1.00 63.04 H new ATOM 0 HG3 GLU B 14 -7.076 -11.699 -0.253 1.00 63.04 H new ATOM 1787 N LEU B 15 -7.055 -8.391 -1.305 1.00 72.12 N ATOM 1788 CA LEU B 15 -7.957 -8.241 -2.428 1.00 71.25 C ATOM 1789 C LEU B 15 -7.137 -8.345 -3.708 1.00 54.44 C ATOM 1790 O LEU B 15 -6.102 -7.685 -3.864 1.00 75.32 O ATOM 1791 CB LEU B 15 -8.801 -6.924 -2.296 1.00 14.24 C ATOM 1792 CG LEU B 15 -8.145 -5.742 -1.504 1.00 22.13 C ATOM 1793 CD1 LEU B 15 -7.045 -5.038 -2.317 1.00 3.51 C ATOM 1794 CD2 LEU B 15 -9.210 -4.747 -0.995 1.00 4.13 C ATOM 0 H LEU B 15 -6.180 -7.876 -1.404 1.00 72.12 H new ATOM 0 HA LEU B 15 -8.701 -9.037 -2.451 1.00 71.25 H new ATOM 0 HB2 LEU B 15 -9.038 -6.570 -3.299 1.00 14.24 H new ATOM 0 HB3 LEU B 15 -9.746 -7.173 -1.814 1.00 14.24 H new ATOM 0 HG LEU B 15 -7.657 -6.173 -0.630 1.00 22.13 H new ATOM 0 HD11 LEU B 15 -6.620 -4.226 -1.727 1.00 3.51 H new ATOM 0 HD12 LEU B 15 -6.262 -5.754 -2.566 1.00 3.51 H new ATOM 0 HD13 LEU B 15 -7.473 -4.634 -3.235 1.00 3.51 H new ATOM 0 HD21 LEU B 15 -8.722 -3.939 -0.450 1.00 4.13 H new ATOM 0 HD22 LEU B 15 -9.757 -4.334 -1.843 1.00 4.13 H new ATOM 0 HD23 LEU B 15 -9.904 -5.264 -0.333 1.00 4.13 H new ATOM 1806 N THR B 16 -7.590 -9.235 -4.576 1.00 4.02 N ATOM 1807 CA THR B 16 -6.980 -9.494 -5.857 1.00 33.35 C ATOM 1808 C THR B 16 -7.580 -8.513 -6.839 1.00 62.21 C ATOM 1809 O THR B 16 -8.784 -8.549 -7.083 1.00 11.14 O ATOM 1810 CB THR B 16 -7.250 -10.956 -6.310 1.00 74.53 C ATOM 1811 OG1 THR B 16 -6.721 -11.850 -5.326 1.00 13.41 O ATOM 1812 CG2 THR B 16 -6.620 -11.253 -7.680 1.00 33.41 C ATOM 0 H THR B 16 -8.414 -9.809 -4.398 1.00 4.02 H new ATOM 0 HA THR B 16 -5.898 -9.372 -5.800 1.00 33.35 H new ATOM 0 HB THR B 16 -8.327 -11.094 -6.409 1.00 74.53 H new ATOM 0 HG1 THR B 16 -6.887 -12.776 -5.602 1.00 13.41 H new ATOM 0 HG21 THR B 16 -6.831 -12.285 -7.962 1.00 33.41 H new ATOM 0 HG22 THR B 16 -7.040 -10.580 -8.427 1.00 33.41 H new ATOM 0 HG23 THR B 16 -5.541 -11.105 -7.624 1.00 33.41 H new ATOM 1820 N VAL B 17 -6.762 -7.585 -7.323 1.00 3.34 N ATOM 1821 CA VAL B 17 -7.201 -6.513 -8.206 1.00 74.34 C ATOM 1822 C VAL B 17 -6.392 -6.556 -9.500 1.00 61.43 C ATOM 1823 O VAL B 17 -5.239 -6.986 -9.501 1.00 43.34 O ATOM 1824 CB VAL B 17 -7.054 -5.100 -7.513 1.00 4.21 C ATOM 1825 CG1 VAL B 17 -7.525 -5.129 -6.032 1.00 63.24 C ATOM 1826 CG2 VAL B 17 -5.623 -4.499 -7.635 1.00 11.21 C ATOM 0 H VAL B 17 -5.765 -7.556 -7.110 1.00 3.34 H new ATOM 0 HA VAL B 17 -8.257 -6.661 -8.431 1.00 74.34 H new ATOM 0 HB VAL B 17 -7.716 -4.433 -8.065 1.00 4.21 H new ATOM 0 HG11 VAL B 17 -7.407 -4.138 -5.593 1.00 63.24 H new ATOM 0 HG12 VAL B 17 -8.574 -5.422 -5.989 1.00 63.24 H new ATOM 0 HG13 VAL B 17 -6.925 -5.847 -5.473 1.00 63.24 H new ATOM 0 HG21 VAL B 17 -5.592 -3.529 -7.138 1.00 11.21 H new ATOM 0 HG22 VAL B 17 -4.905 -5.171 -7.165 1.00 11.21 H new ATOM 0 HG23 VAL B 17 -5.369 -4.376 -8.688 1.00 11.21 H new ATOM 1836 N ARG B 18 -7.003 -6.117 -10.595 1.00 2.41 N ATOM 1837 CA ARG B 18 -6.288 -5.828 -11.845 1.00 55.32 C ATOM 1838 C ARG B 18 -6.042 -4.310 -11.885 1.00 22.20 C ATOM 1839 O ARG B 18 -6.907 -3.542 -11.438 1.00 23.44 O ATOM 1840 CB ARG B 18 -7.084 -6.357 -13.071 1.00 2.54 C ATOM 1841 CG ARG B 18 -8.576 -5.956 -13.111 1.00 2.10 C ATOM 1842 CD ARG B 18 -9.349 -6.644 -14.250 1.00 72.43 C ATOM 1843 NE ARG B 18 -8.804 -6.317 -15.583 1.00 2.35 N ATOM 1844 CZ ARG B 18 -9.518 -5.895 -16.642 1.00 11.21 C ATOM 1845 NH1 ARG B 18 -10.838 -5.725 -16.561 1.00 3.52 N ATOM 1846 NH2 ARG B 18 -8.909 -5.677 -17.792 1.00 52.23 N ATOM 0 H ARG B 18 -8.008 -5.950 -10.647 1.00 2.41 H new ATOM 0 HA ARG B 18 -5.328 -6.343 -11.887 1.00 55.32 H new ATOM 0 HB2 ARG B 18 -6.603 -5.995 -13.980 1.00 2.54 H new ATOM 0 HB3 ARG B 18 -7.016 -7.445 -13.086 1.00 2.54 H new ATOM 0 HG2 ARG B 18 -9.041 -6.209 -12.158 1.00 2.10 H new ATOM 0 HG3 ARG B 18 -8.654 -4.875 -13.227 1.00 2.10 H new ATOM 0 HD2 ARG B 18 -9.319 -7.724 -14.104 1.00 72.43 H new ATOM 0 HD3 ARG B 18 -10.396 -6.345 -14.206 1.00 72.43 H new ATOM 0 HE ARG B 18 -7.797 -6.420 -15.712 1.00 2.35 H new ATOM 0 HH11 ARG B 18 -11.324 -5.916 -15.685 1.00 3.52 H new ATOM 0 HH12 ARG B 18 -11.362 -5.404 -17.375 1.00 3.52 H new ATOM 0 HH21 ARG B 18 -7.904 -5.829 -17.873 1.00 52.23 H new ATOM 0 HH22 ARG B 18 -9.444 -5.357 -18.600 1.00 52.23 H new ATOM 1860 N ASN B 19 -4.862 -3.901 -12.395 1.00 21.14 N ATOM 1861 CA ASN B 19 -4.324 -2.535 -12.211 1.00 21.42 C ATOM 1862 C ASN B 19 -5.146 -1.485 -13.001 1.00 44.02 C ATOM 1863 O ASN B 19 -4.871 -1.180 -14.167 1.00 71.12 O ATOM 1864 CB ASN B 19 -2.799 -2.483 -12.575 1.00 1.53 C ATOM 1865 CG ASN B 19 -2.071 -1.224 -12.047 1.00 31.53 C ATOM 1866 OD1 ASN B 19 -2.661 -0.160 -11.901 1.00 32.13 O ATOM 1867 ND2 ASN B 19 -0.782 -1.341 -11.740 1.00 45.42 N ATOM 0 H ASN B 19 -4.255 -4.507 -12.946 1.00 21.14 H new ATOM 0 HA ASN B 19 -4.419 -2.276 -11.156 1.00 21.42 H new ATOM 0 HB2 ASN B 19 -2.309 -3.370 -12.173 1.00 1.53 H new ATOM 0 HB3 ASN B 19 -2.693 -2.524 -13.659 1.00 1.53 H new ATOM 0 HD21 ASN B 19 -0.269 -0.538 -11.377 1.00 45.42 H new ATOM 0 HD22 ASN B 19 -0.306 -2.234 -11.868 1.00 45.42 H new ATOM 1874 N HIS B 20 -6.217 -1.026 -12.340 1.00 15.34 N ATOM 1875 CA HIS B 20 -7.040 0.133 -12.739 1.00 63.53 C ATOM 1876 C HIS B 20 -6.480 1.416 -12.075 1.00 73.12 C ATOM 1877 O HIS B 20 -5.693 1.313 -11.125 1.00 33.30 O ATOM 1878 CB HIS B 20 -8.528 -0.113 -12.323 1.00 12.14 C ATOM 1879 CG HIS B 20 -9.267 -1.048 -13.238 1.00 34.23 C ATOM 1880 ND1 HIS B 20 -9.988 -0.615 -14.323 1.00 73.22 N ATOM 1881 CD2 HIS B 20 -9.378 -2.394 -13.235 1.00 73.21 C ATOM 1882 CE1 HIS B 20 -10.506 -1.649 -14.947 1.00 71.42 C ATOM 1883 NE2 HIS B 20 -10.154 -2.744 -14.311 1.00 63.14 N ATOM 0 H HIS B 20 -6.550 -1.465 -11.481 1.00 15.34 H new ATOM 0 HA HIS B 20 -7.004 0.261 -13.821 1.00 63.53 H new ATOM 0 HB2 HIS B 20 -8.550 -0.517 -11.311 1.00 12.14 H new ATOM 0 HB3 HIS B 20 -9.051 0.843 -12.296 1.00 12.14 H new ATOM 0 HD2 HIS B 20 -8.937 -3.070 -12.518 1.00 73.21 H new ATOM 0 HE1 HIS B 20 -11.119 -1.606 -15.835 1.00 71.42 H new ATOM 0 HE2 HIS B 20 -10.414 -3.695 -14.573 1.00 63.14 H new ATOM 1892 N PRO B 21 -6.842 2.647 -12.598 1.00 51.31 N ATOM 1893 CA PRO B 21 -6.403 3.945 -12.012 1.00 40.33 C ATOM 1894 C PRO B 21 -6.538 4.039 -10.469 1.00 15.05 C ATOM 1895 O PRO B 21 -7.637 4.258 -9.932 1.00 11.41 O ATOM 1896 CB PRO B 21 -7.312 4.963 -12.738 1.00 41.04 C ATOM 1897 CG PRO B 21 -7.539 4.358 -14.090 1.00 35.10 C ATOM 1898 CD PRO B 21 -7.635 2.867 -13.848 1.00 51.53 C ATOM 0 HA PRO B 21 -5.336 4.112 -12.157 1.00 40.33 H new ATOM 0 HB2 PRO B 21 -8.251 5.109 -12.205 1.00 41.04 H new ATOM 0 HB3 PRO B 21 -6.834 5.940 -12.814 1.00 41.04 H new ATOM 0 HG2 PRO B 21 -8.452 4.742 -14.545 1.00 35.10 H new ATOM 0 HG3 PRO B 21 -6.720 4.595 -14.770 1.00 35.10 H new ATOM 0 HD2 PRO B 21 -8.670 2.549 -13.724 1.00 51.53 H new ATOM 0 HD3 PRO B 21 -7.226 2.300 -14.684 1.00 51.53 H new ATOM 1906 N GLY B 22 -5.386 3.824 -9.789 1.00 11.31 N ATOM 1907 CA GLY B 22 -5.268 3.933 -8.337 1.00 23.15 C ATOM 1908 C GLY B 22 -6.238 3.042 -7.566 1.00 54.21 C ATOM 1909 O GLY B 22 -7.054 3.550 -6.791 1.00 43.14 O ATOM 0 H GLY B 22 -4.512 3.568 -10.248 1.00 11.31 H new ATOM 0 HA2 GLY B 22 -4.249 3.680 -8.046 1.00 23.15 H new ATOM 0 HA3 GLY B 22 -5.434 4.970 -8.046 1.00 23.15 H new ATOM 1913 N VAL B 23 -6.174 1.716 -7.787 1.00 44.51 N ATOM 1914 CA VAL B 23 -7.026 0.753 -7.044 1.00 14.44 C ATOM 1915 C VAL B 23 -6.668 0.775 -5.553 1.00 40.21 C ATOM 1916 O VAL B 23 -7.534 0.794 -4.689 1.00 32.13 O ATOM 1917 CB VAL B 23 -6.885 -0.724 -7.549 1.00 73.35 C ATOM 1918 CG1 VAL B 23 -7.951 -1.617 -6.881 1.00 31.51 C ATOM 1919 CG2 VAL B 23 -6.962 -0.820 -9.075 1.00 23.52 C ATOM 0 H VAL B 23 -5.548 1.284 -8.467 1.00 44.51 H new ATOM 0 HA VAL B 23 -8.054 1.073 -7.216 1.00 14.44 H new ATOM 0 HB VAL B 23 -5.896 -1.082 -7.262 1.00 73.35 H new ATOM 0 HG11 VAL B 23 -7.844 -2.641 -7.239 1.00 31.51 H new ATOM 0 HG12 VAL B 23 -7.818 -1.595 -5.799 1.00 31.51 H new ATOM 0 HG13 VAL B 23 -8.945 -1.247 -7.132 1.00 31.51 H new ATOM 0 HG21 VAL B 23 -6.860 -1.862 -9.380 1.00 23.52 H new ATOM 0 HG22 VAL B 23 -7.923 -0.435 -9.416 1.00 23.52 H new ATOM 0 HG23 VAL B 23 -6.158 -0.232 -9.518 1.00 23.52 H new ATOM 1929 N MET B 24 -5.359 0.767 -5.290 1.00 44.31 N ATOM 1930 CA MET B 24 -4.789 0.850 -3.936 1.00 43.20 C ATOM 1931 C MET B 24 -5.214 2.154 -3.200 1.00 61.33 C ATOM 1932 O MET B 24 -5.242 2.187 -1.960 1.00 12.40 O ATOM 1933 CB MET B 24 -3.249 0.661 -3.982 1.00 11.24 C ATOM 1934 CG MET B 24 -2.490 1.633 -4.889 1.00 70.44 C ATOM 1935 SD MET B 24 -2.847 1.438 -6.658 1.00 32.45 S ATOM 1936 CE MET B 24 -2.218 -0.210 -6.989 1.00 10.12 C ATOM 0 H MET B 24 -4.651 0.702 -6.021 1.00 44.31 H new ATOM 0 HA MET B 24 -5.200 0.032 -3.345 1.00 43.20 H new ATOM 0 HB2 MET B 24 -2.859 0.758 -2.969 1.00 11.24 H new ATOM 0 HB3 MET B 24 -3.035 -0.356 -4.310 1.00 11.24 H new ATOM 0 HG2 MET B 24 -2.732 2.653 -4.592 1.00 70.44 H new ATOM 0 HG3 MET B 24 -1.420 1.500 -4.729 1.00 70.44 H new ATOM 0 HE1 MET B 24 -2.143 -0.361 -8.066 1.00 10.12 H new ATOM 0 HE2 MET B 24 -1.232 -0.321 -6.538 1.00 10.12 H new ATOM 0 HE3 MET B 24 -2.896 -0.950 -6.565 1.00 10.12 H new ATOM 1946 N THR B 25 -5.531 3.228 -3.963 1.00 4.53 N ATOM 1947 CA THR B 25 -6.148 4.451 -3.402 1.00 73.40 C ATOM 1948 C THR B 25 -7.566 4.124 -2.857 1.00 44.50 C ATOM 1949 O THR B 25 -7.937 4.576 -1.765 1.00 44.02 O ATOM 1950 CB THR B 25 -6.253 5.588 -4.478 1.00 64.42 C ATOM 1951 OG1 THR B 25 -5.033 5.673 -5.220 1.00 75.14 O ATOM 1952 CG2 THR B 25 -6.556 6.968 -3.853 1.00 70.32 C ATOM 0 H THR B 25 -5.369 3.270 -4.969 1.00 4.53 H new ATOM 0 HA THR B 25 -5.510 4.805 -2.592 1.00 73.40 H new ATOM 0 HB THR B 25 -7.083 5.326 -5.134 1.00 64.42 H new ATOM 0 HG1 THR B 25 -4.362 5.085 -4.815 1.00 75.14 H new ATOM 0 HG21 THR B 25 -6.618 7.719 -4.641 1.00 70.32 H new ATOM 0 HG22 THR B 25 -7.504 6.925 -3.318 1.00 70.32 H new ATOM 0 HG23 THR B 25 -5.759 7.236 -3.159 1.00 70.32 H new ATOM 1960 N HIS B 26 -8.334 3.314 -3.634 1.00 62.30 N ATOM 1961 CA HIS B 26 -9.712 2.892 -3.268 1.00 53.24 C ATOM 1962 C HIS B 26 -9.685 2.071 -1.964 1.00 64.21 C ATOM 1963 O HIS B 26 -10.488 2.313 -1.052 1.00 13.24 O ATOM 1964 CB HIS B 26 -10.389 2.014 -4.377 1.00 13.04 C ATOM 1965 CG HIS B 26 -10.395 2.568 -5.785 1.00 44.01 C ATOM 1966 ND1 HIS B 26 -10.767 1.808 -6.874 1.00 53.04 N ATOM 1967 CD2 HIS B 26 -10.058 3.780 -6.288 1.00 15.21 C ATOM 1968 CE1 HIS B 26 -10.656 2.522 -7.977 1.00 20.11 C ATOM 1969 NE2 HIS B 26 -10.230 3.722 -7.651 1.00 24.30 N ATOM 0 H HIS B 26 -8.017 2.937 -4.527 1.00 62.30 H new ATOM 0 HA HIS B 26 -10.292 3.807 -3.147 1.00 53.24 H new ATOM 0 HB2 HIS B 26 -9.887 1.047 -4.396 1.00 13.04 H new ATOM 0 HB3 HIS B 26 -11.422 1.832 -4.081 1.00 13.04 H new ATOM 0 HD2 HIS B 26 -9.717 4.635 -5.722 1.00 15.21 H new ATOM 0 HE1 HIS B 26 -10.877 2.179 -8.977 1.00 20.11 H new ATOM 0 HE2 HIS B 26 -10.055 4.486 -8.303 1.00 24.30 H new ATOM 1978 N VAL B 27 -8.733 1.111 -1.893 1.00 12.10 N ATOM 1979 CA VAL B 27 -8.680 0.115 -0.806 1.00 74.01 C ATOM 1980 C VAL B 27 -8.399 0.792 0.544 1.00 62.44 C ATOM 1981 O VAL B 27 -9.105 0.546 1.529 1.00 44.25 O ATOM 1982 CB VAL B 27 -7.659 -1.067 -1.108 1.00 23.41 C ATOM 1983 CG1 VAL B 27 -7.827 -1.577 -2.558 1.00 30.01 C ATOM 1984 CG2 VAL B 27 -6.183 -0.707 -0.824 1.00 34.10 C ATOM 0 H VAL B 27 -7.988 1.008 -2.582 1.00 12.10 H new ATOM 0 HA VAL B 27 -9.664 -0.350 -0.746 1.00 74.01 H new ATOM 0 HB VAL B 27 -7.912 -1.866 -0.411 1.00 23.41 H new ATOM 0 HG11 VAL B 27 -7.119 -2.385 -2.744 1.00 30.01 H new ATOM 0 HG12 VAL B 27 -8.843 -1.945 -2.699 1.00 30.01 H new ATOM 0 HG13 VAL B 27 -7.637 -0.761 -3.255 1.00 30.01 H new ATOM 0 HG21 VAL B 27 -5.549 -1.563 -1.054 1.00 34.10 H new ATOM 0 HG22 VAL B 27 -5.889 0.139 -1.445 1.00 34.10 H new ATOM 0 HG23 VAL B 27 -6.069 -0.443 0.227 1.00 34.10 H new ATOM 1994 N CYS B 28 -7.417 1.713 0.555 1.00 51.41 N ATOM 1995 CA CYS B 28 -7.074 2.475 1.757 1.00 21.30 C ATOM 1996 C CYS B 28 -8.181 3.478 2.097 1.00 33.12 C ATOM 1997 O CYS B 28 -8.400 3.780 3.269 1.00 31.52 O ATOM 1998 CB CYS B 28 -5.750 3.216 1.594 1.00 51.13 C ATOM 1999 SG CYS B 28 -5.319 4.195 3.045 1.00 12.41 S ATOM 0 H CYS B 28 -6.849 1.943 -0.261 1.00 51.41 H new ATOM 0 HA CYS B 28 -6.971 1.759 2.572 1.00 21.30 H new ATOM 0 HB2 CYS B 28 -4.956 2.495 1.398 1.00 51.13 H new ATOM 0 HB3 CYS B 28 -5.809 3.870 0.724 1.00 51.13 H new ATOM 0 HG CYS B 28 -6.107 5.226 3.122 1.00 12.41 H new ATOM 2005 N GLY B 29 -8.876 3.975 1.048 1.00 11.02 N ATOM 2006 CA GLY B 29 -9.984 4.922 1.201 1.00 73.10 C ATOM 2007 C GLY B 29 -11.086 4.386 2.108 1.00 64.31 C ATOM 2008 O GLY B 29 -11.536 5.083 3.019 1.00 21.31 O ATOM 0 H GLY B 29 -8.679 3.727 0.079 1.00 11.02 H new ATOM 0 HA2 GLY B 29 -9.604 5.858 1.610 1.00 73.10 H new ATOM 0 HA3 GLY B 29 -10.403 5.149 0.220 1.00 73.10 H new ATOM 2012 N LEU B 30 -11.466 3.112 1.880 1.00 53.22 N ATOM 2013 CA LEU B 30 -12.493 2.414 2.681 1.00 13.22 C ATOM 2014 C LEU B 30 -12.016 2.173 4.135 1.00 23.34 C ATOM 2015 O LEU B 30 -12.667 2.604 5.097 1.00 5.32 O ATOM 2016 CB LEU B 30 -12.921 1.065 2.003 1.00 62.31 C ATOM 2017 CG LEU B 30 -14.061 1.163 0.927 1.00 4.11 C ATOM 2018 CD1 LEU B 30 -15.344 1.808 1.523 1.00 32.33 C ATOM 2019 CD2 LEU B 30 -13.595 1.907 -0.351 1.00 45.42 C ATOM 0 H LEU B 30 -11.070 2.538 1.136 1.00 53.22 H new ATOM 0 HA LEU B 30 -13.367 3.064 2.723 1.00 13.22 H new ATOM 0 HB2 LEU B 30 -12.042 0.624 1.533 1.00 62.31 H new ATOM 0 HB3 LEU B 30 -13.244 0.376 2.784 1.00 62.31 H new ATOM 0 HG LEU B 30 -14.307 0.144 0.628 1.00 4.11 H new ATOM 0 HD11 LEU B 30 -16.115 1.862 0.754 1.00 32.33 H new ATOM 0 HD12 LEU B 30 -15.703 1.202 2.355 1.00 32.33 H new ATOM 0 HD13 LEU B 30 -15.115 2.813 1.878 1.00 32.33 H new ATOM 0 HD21 LEU B 30 -14.416 1.950 -1.067 1.00 45.42 H new ATOM 0 HD22 LEU B 30 -13.287 2.920 -0.091 1.00 45.42 H new ATOM 0 HD23 LEU B 30 -12.754 1.375 -0.796 1.00 45.42 H new ATOM 2031 N PHE B 31 -10.866 1.504 4.278 1.00 11.24 N ATOM 2032 CA PHE B 31 -10.373 1.027 5.593 1.00 24.11 C ATOM 2033 C PHE B 31 -9.988 2.189 6.538 1.00 20.11 C ATOM 2034 O PHE B 31 -10.108 2.052 7.765 1.00 13.42 O ATOM 2035 CB PHE B 31 -9.209 0.016 5.391 1.00 10.13 C ATOM 2036 CG PHE B 31 -9.602 -1.189 4.509 1.00 21.13 C ATOM 2037 CD1 PHE B 31 -10.867 -1.789 4.624 1.00 60.43 C ATOM 2038 CD2 PHE B 31 -8.734 -1.694 3.544 1.00 11.43 C ATOM 2039 CE1 PHE B 31 -11.234 -2.850 3.812 1.00 5.55 C ATOM 2040 CE2 PHE B 31 -9.107 -2.754 2.728 1.00 12.42 C ATOM 2041 CZ PHE B 31 -10.352 -3.330 2.861 1.00 71.40 C ATOM 0 H PHE B 31 -10.249 1.275 3.498 1.00 11.24 H new ATOM 0 HA PHE B 31 -11.191 0.507 6.092 1.00 24.11 H new ATOM 0 HB2 PHE B 31 -8.363 0.531 4.937 1.00 10.13 H new ATOM 0 HB3 PHE B 31 -8.877 -0.346 6.364 1.00 10.13 H new ATOM 0 HD1 PHE B 31 -11.566 -1.417 5.358 1.00 60.43 H new ATOM 0 HD2 PHE B 31 -7.755 -1.254 3.428 1.00 11.43 H new ATOM 0 HE1 PHE B 31 -12.209 -3.302 3.922 1.00 5.55 H new ATOM 0 HE2 PHE B 31 -8.418 -3.129 1.986 1.00 12.42 H new ATOM 0 HZ PHE B 31 -10.638 -4.154 2.224 1.00 71.40 H new ATOM 2051 N ALA B 32 -9.569 3.329 5.952 1.00 53.13 N ATOM 2052 CA ALA B 32 -9.246 4.564 6.702 1.00 42.33 C ATOM 2053 C ALA B 32 -10.530 5.274 7.198 1.00 23.14 C ATOM 2054 O ALA B 32 -10.627 5.626 8.383 1.00 52.43 O ATOM 2055 CB ALA B 32 -8.417 5.520 5.829 1.00 22.53 C ATOM 0 H ALA B 32 -9.444 3.421 4.944 1.00 53.13 H new ATOM 0 HA ALA B 32 -8.658 4.279 7.575 1.00 42.33 H new ATOM 0 HB1 ALA B 32 -8.188 6.423 6.395 1.00 22.53 H new ATOM 0 HB2 ALA B 32 -7.489 5.031 5.534 1.00 22.53 H new ATOM 0 HB3 ALA B 32 -8.986 5.785 4.938 1.00 22.53 H new ATOM 2061 N ARG B 33 -11.524 5.454 6.282 1.00 22.22 N ATOM 2062 CA ARG B 33 -12.793 6.185 6.588 1.00 14.15 C ATOM 2063 C ARG B 33 -13.698 5.399 7.559 1.00 23.31 C ATOM 2064 O ARG B 33 -14.710 5.927 8.033 1.00 63.12 O ATOM 2065 CB ARG B 33 -13.591 6.520 5.293 1.00 51.23 C ATOM 2066 CG ARG B 33 -14.238 5.304 4.592 1.00 22.34 C ATOM 2067 CD ARG B 33 -15.038 5.685 3.339 1.00 21.44 C ATOM 2068 NE ARG B 33 -16.247 6.462 3.670 1.00 11.02 N ATOM 2069 CZ ARG B 33 -17.114 6.993 2.784 1.00 52.24 C ATOM 2070 NH1 ARG B 33 -16.932 6.854 1.467 1.00 21.11 N ATOM 2071 NH2 ARG B 33 -18.175 7.657 3.235 1.00 32.42 N ATOM 0 H ARG B 33 -11.472 5.104 5.325 1.00 22.22 H new ATOM 0 HA ARG B 33 -12.495 7.116 7.071 1.00 14.15 H new ATOM 0 HB2 ARG B 33 -14.374 7.236 5.542 1.00 51.23 H new ATOM 0 HB3 ARG B 33 -12.921 7.013 4.588 1.00 51.23 H new ATOM 0 HG2 ARG B 33 -13.458 4.594 4.316 1.00 22.34 H new ATOM 0 HG3 ARG B 33 -14.897 4.795 5.295 1.00 22.34 H new ATOM 0 HD2 ARG B 33 -14.406 6.267 2.668 1.00 21.44 H new ATOM 0 HD3 ARG B 33 -15.324 4.780 2.803 1.00 21.44 H new ATOM 0 HE ARG B 33 -16.446 6.611 4.659 1.00 11.02 H new ATOM 0 HH11 ARG B 33 -16.125 6.338 1.115 1.00 21.11 H new ATOM 0 HH12 ARG B 33 -17.600 7.264 0.814 1.00 21.11 H new ATOM 0 HH21 ARG B 33 -18.324 7.759 4.239 1.00 32.42 H new ATOM 0 HH22 ARG B 33 -18.839 8.064 2.577 1.00 32.42 H new ATOM 2085 N ARG B 34 -13.325 4.141 7.829 1.00 41.50 N ATOM 2086 CA ARG B 34 -14.019 3.273 8.774 1.00 24.10 C ATOM 2087 C ARG B 34 -13.908 3.852 10.196 1.00 11.42 C ATOM 2088 O ARG B 34 -14.927 4.149 10.827 1.00 22.43 O ATOM 2089 CB ARG B 34 -13.415 1.841 8.644 1.00 25.24 C ATOM 2090 CG ARG B 34 -13.904 0.766 9.651 1.00 53.14 C ATOM 2091 CD ARG B 34 -13.056 0.698 10.938 1.00 55.23 C ATOM 2092 NE ARG B 34 -11.612 0.572 10.645 1.00 23.21 N ATOM 2093 CZ ARG B 34 -10.697 0.011 11.451 1.00 52.05 C ATOM 2094 NH1 ARG B 34 -11.029 -0.510 12.631 1.00 42.22 N ATOM 2095 NH2 ARG B 34 -9.435 0.011 11.088 1.00 54.14 N ATOM 0 H ARG B 34 -12.520 3.696 7.388 1.00 41.50 H new ATOM 0 HA ARG B 34 -15.085 3.213 8.554 1.00 24.10 H new ATOM 0 HB2 ARG B 34 -13.622 1.478 7.637 1.00 25.24 H new ATOM 0 HB3 ARG B 34 -12.332 1.922 8.737 1.00 25.24 H new ATOM 0 HG2 ARG B 34 -14.940 0.974 9.918 1.00 53.14 H new ATOM 0 HG3 ARG B 34 -13.890 -0.209 9.164 1.00 53.14 H new ATOM 0 HD2 ARG B 34 -13.228 1.595 11.533 1.00 55.23 H new ATOM 0 HD3 ARG B 34 -13.379 -0.151 11.540 1.00 55.23 H new ATOM 0 HE ARG B 34 -11.283 0.943 9.754 1.00 23.21 H new ATOM 0 HH11 ARG B 34 -12.000 -0.489 12.943 1.00 42.22 H new ATOM 0 HH12 ARG B 34 -10.312 -0.930 13.223 1.00 42.22 H new ATOM 0 HH21 ARG B 34 -9.159 0.434 10.202 1.00 54.14 H new ATOM 0 HH22 ARG B 34 -8.731 -0.412 11.692 1.00 54.14 H new ATOM 2109 N ALA B 35 -12.657 4.039 10.661 1.00 2.22 N ATOM 2110 CA ALA B 35 -12.347 4.583 12.002 1.00 54.44 C ATOM 2111 C ALA B 35 -10.832 4.716 12.158 1.00 51.25 C ATOM 2112 O ALA B 35 -10.301 5.822 12.305 1.00 22.33 O ATOM 2113 CB ALA B 35 -12.928 3.702 13.134 1.00 74.24 C ATOM 0 H ALA B 35 -11.826 3.816 10.114 1.00 2.22 H new ATOM 0 HA ALA B 35 -12.816 5.564 12.086 1.00 54.44 H new ATOM 0 HB1 ALA B 35 -12.676 4.139 14.100 1.00 74.24 H new ATOM 0 HB2 ALA B 35 -14.012 3.646 13.032 1.00 74.24 H new ATOM 0 HB3 ALA B 35 -12.506 2.699 13.068 1.00 74.24 H new ATOM 2119 N PHE B 36 -10.151 3.569 12.093 1.00 1.03 N ATOM 2120 CA PHE B 36 -8.692 3.482 12.258 1.00 1.42 C ATOM 2121 C PHE B 36 -8.048 3.277 10.883 1.00 33.34 C ATOM 2122 O PHE B 36 -8.629 2.618 10.016 1.00 52.44 O ATOM 2123 CB PHE B 36 -8.333 2.314 13.212 1.00 31.44 C ATOM 2124 CG PHE B 36 -6.838 2.191 13.556 1.00 54.42 C ATOM 2125 CD1 PHE B 36 -6.205 3.156 14.343 1.00 64.23 C ATOM 2126 CD2 PHE B 36 -6.073 1.116 13.097 1.00 14.33 C ATOM 2127 CE1 PHE B 36 -4.862 3.049 14.659 1.00 72.10 C ATOM 2128 CE2 PHE B 36 -4.730 1.010 13.411 1.00 20.45 C ATOM 2129 CZ PHE B 36 -4.124 1.975 14.191 1.00 52.23 C ATOM 0 H PHE B 36 -10.596 2.667 11.923 1.00 1.03 H new ATOM 0 HA PHE B 36 -8.313 4.405 12.697 1.00 1.42 H new ATOM 0 HB2 PHE B 36 -8.895 2.436 14.138 1.00 31.44 H new ATOM 0 HB3 PHE B 36 -8.664 1.380 12.759 1.00 31.44 H new ATOM 0 HD1 PHE B 36 -6.772 3.998 14.710 1.00 64.23 H new ATOM 0 HD2 PHE B 36 -6.538 0.355 12.487 1.00 14.33 H new ATOM 0 HE1 PHE B 36 -4.389 3.803 15.271 1.00 72.10 H new ATOM 0 HE2 PHE B 36 -4.155 0.172 13.046 1.00 20.45 H new ATOM 0 HZ PHE B 36 -3.075 1.892 14.436 1.00 52.23 H new ATOM 2139 N ASN B 37 -6.840 3.819 10.720 1.00 63.55 N ATOM 2140 CA ASN B 37 -6.088 3.781 9.455 1.00 61.32 C ATOM 2141 C ASN B 37 -5.438 2.401 9.251 1.00 42.03 C ATOM 2142 O ASN B 37 -5.543 1.516 10.108 1.00 4.25 O ATOM 2143 CB ASN B 37 -5.000 4.880 9.477 1.00 72.24 C ATOM 2144 CG ASN B 37 -5.541 6.270 9.812 1.00 14.45 C ATOM 2145 OD1 ASN B 37 -6.661 6.632 9.442 1.00 65.43 O ATOM 2146 ND2 ASN B 37 -4.757 7.056 10.537 1.00 32.13 N ATOM 0 H ASN B 37 -6.346 4.304 11.469 1.00 63.55 H new ATOM 0 HA ASN B 37 -6.775 3.960 8.628 1.00 61.32 H new ATOM 0 HB2 ASN B 37 -4.238 4.610 10.208 1.00 72.24 H new ATOM 0 HB3 ASN B 37 -4.511 4.915 8.504 1.00 72.24 H new ATOM 0 HD21 ASN B 37 -5.075 7.988 10.804 1.00 32.13 H new ATOM 0 HD22 ASN B 37 -3.836 6.729 10.828 1.00 32.13 H new ATOM 2153 N VAL B 38 -4.761 2.229 8.110 1.00 4.44 N ATOM 2154 CA VAL B 38 -4.024 0.992 7.810 1.00 14.33 C ATOM 2155 C VAL B 38 -2.666 1.010 8.551 1.00 23.13 C ATOM 2156 O VAL B 38 -2.007 2.051 8.624 1.00 70.40 O ATOM 2157 CB VAL B 38 -3.810 0.805 6.257 1.00 42.21 C ATOM 2158 CG1 VAL B 38 -3.198 -0.575 5.943 1.00 41.24 C ATOM 2159 CG2 VAL B 38 -5.132 1.002 5.480 1.00 32.53 C ATOM 0 H VAL B 38 -4.707 2.934 7.375 1.00 4.44 H new ATOM 0 HA VAL B 38 -4.615 0.145 8.157 1.00 14.33 H new ATOM 0 HB VAL B 38 -3.108 1.572 5.929 1.00 42.21 H new ATOM 0 HG11 VAL B 38 -3.062 -0.676 4.866 1.00 41.24 H new ATOM 0 HG12 VAL B 38 -2.233 -0.667 6.441 1.00 41.24 H new ATOM 0 HG13 VAL B 38 -3.866 -1.359 6.299 1.00 41.24 H new ATOM 0 HG21 VAL B 38 -4.951 0.867 4.414 1.00 32.53 H new ATOM 0 HG22 VAL B 38 -5.866 0.271 5.819 1.00 32.53 H new ATOM 0 HG23 VAL B 38 -5.513 2.008 5.659 1.00 32.53 H new ATOM 2169 N GLU B 39 -2.296 -0.140 9.130 1.00 74.50 N ATOM 2170 CA GLU B 39 -1.037 -0.327 9.877 1.00 74.43 C ATOM 2171 C GLU B 39 0.089 -0.752 8.916 1.00 71.24 C ATOM 2172 O GLU B 39 1.200 -0.191 8.944 1.00 3.12 O ATOM 2173 CB GLU B 39 -1.298 -1.370 11.018 1.00 33.41 C ATOM 2174 CG GLU B 39 -0.049 -2.019 11.690 1.00 64.43 C ATOM 2175 CD GLU B 39 0.339 -3.385 11.069 1.00 0.23 C ATOM 2176 OE1 GLU B 39 -0.402 -4.359 11.285 1.00 42.22 O ATOM 2177 OE2 GLU B 39 1.359 -3.481 10.352 1.00 34.42 O ATOM 0 H GLU B 39 -2.870 -0.983 9.094 1.00 74.50 H new ATOM 0 HA GLU B 39 -0.707 0.604 10.337 1.00 74.43 H new ATOM 0 HB2 GLU B 39 -1.884 -0.880 11.796 1.00 33.41 H new ATOM 0 HB3 GLU B 39 -1.916 -2.170 10.610 1.00 33.41 H new ATOM 0 HG2 GLU B 39 0.796 -1.336 11.606 1.00 64.43 H new ATOM 0 HG3 GLU B 39 -0.246 -2.154 12.754 1.00 64.43 H new ATOM 2184 N GLY B 40 -0.231 -1.721 8.045 1.00 52.35 N ATOM 2185 CA GLY B 40 0.733 -2.305 7.111 1.00 35.55 C ATOM 2186 C GLY B 40 0.078 -2.683 5.796 1.00 14.30 C ATOM 2187 O GLY B 40 -1.122 -2.938 5.752 1.00 52.54 O ATOM 0 H GLY B 40 -1.167 -2.119 7.971 1.00 52.35 H new ATOM 0 HA2 GLY B 40 1.538 -1.594 6.926 1.00 35.55 H new ATOM 0 HA3 GLY B 40 1.186 -3.189 7.560 1.00 35.55 H new ATOM 2191 N ILE B 41 0.852 -2.680 4.708 1.00 42.14 N ATOM 2192 CA ILE B 41 0.367 -3.038 3.360 1.00 1.35 C ATOM 2193 C ILE B 41 1.408 -3.939 2.701 1.00 61.21 C ATOM 2194 O ILE B 41 2.609 -3.789 2.929 1.00 31.11 O ATOM 2195 CB ILE B 41 0.124 -1.766 2.433 1.00 10.54 C ATOM 2196 CG1 ILE B 41 -0.851 -0.751 3.106 1.00 50.20 C ATOM 2197 CG2 ILE B 41 -0.402 -2.172 1.022 1.00 3.30 C ATOM 2198 CD1 ILE B 41 -1.127 0.504 2.299 1.00 75.35 C ATOM 0 H ILE B 41 1.840 -2.428 4.731 1.00 42.14 H new ATOM 0 HA ILE B 41 -0.593 -3.542 3.473 1.00 1.35 H new ATOM 0 HB ILE B 41 1.090 -1.279 2.303 1.00 10.54 H new ATOM 0 HG12 ILE B 41 -1.798 -1.255 3.302 1.00 50.20 H new ATOM 0 HG13 ILE B 41 -0.439 -0.460 4.072 1.00 50.20 H new ATOM 0 HG21 ILE B 41 -0.555 -1.277 0.419 1.00 3.30 H new ATOM 0 HG22 ILE B 41 0.328 -2.818 0.533 1.00 3.30 H new ATOM 0 HG23 ILE B 41 -1.347 -2.706 1.126 1.00 3.30 H new ATOM 0 HD11 ILE B 41 -1.815 1.146 2.849 1.00 75.35 H new ATOM 0 HD12 ILE B 41 -0.193 1.037 2.125 1.00 75.35 H new ATOM 0 HD13 ILE B 41 -1.572 0.231 1.342 1.00 75.35 H new ATOM 2210 N LEU B 42 0.938 -4.883 1.894 1.00 65.11 N ATOM 2211 CA LEU B 42 1.787 -5.657 0.993 1.00 72.34 C ATOM 2212 C LEU B 42 1.054 -5.762 -0.341 1.00 4.12 C ATOM 2213 O LEU B 42 -0.134 -6.027 -0.366 1.00 30.53 O ATOM 2214 CB LEU B 42 2.111 -7.049 1.596 1.00 42.32 C ATOM 2215 CG LEU B 42 3.022 -7.980 0.735 1.00 41.05 C ATOM 2216 CD1 LEU B 42 4.296 -7.261 0.256 1.00 3.50 C ATOM 2217 CD2 LEU B 42 3.373 -9.269 1.504 1.00 21.42 C ATOM 0 H LEU B 42 -0.049 -5.135 1.845 1.00 65.11 H new ATOM 0 HA LEU B 42 2.749 -5.165 0.845 1.00 72.34 H new ATOM 0 HB2 LEU B 42 2.591 -6.900 2.563 1.00 42.32 H new ATOM 0 HB3 LEU B 42 1.171 -7.568 1.783 1.00 42.32 H new ATOM 0 HG LEU B 42 2.454 -8.253 -0.154 1.00 41.05 H new ATOM 0 HD11 LEU B 42 4.899 -7.947 -0.339 1.00 3.50 H new ATOM 0 HD12 LEU B 42 4.021 -6.399 -0.352 1.00 3.50 H new ATOM 0 HD13 LEU B 42 4.872 -6.927 1.119 1.00 3.50 H new ATOM 0 HD21 LEU B 42 4.008 -9.901 0.884 1.00 21.42 H new ATOM 0 HD22 LEU B 42 3.902 -9.012 2.422 1.00 21.42 H new ATOM 0 HD23 LEU B 42 2.457 -9.806 1.751 1.00 21.42 H new ATOM 2229 N CYS B 43 1.767 -5.506 -1.430 1.00 52.43 N ATOM 2230 CA CYS B 43 1.224 -5.523 -2.787 1.00 11.13 C ATOM 2231 C CYS B 43 2.329 -5.974 -3.729 1.00 41.14 C ATOM 2232 O CYS B 43 3.415 -5.381 -3.745 1.00 52.33 O ATOM 2233 CB CYS B 43 0.710 -4.124 -3.195 1.00 62.24 C ATOM 2234 SG CYS B 43 0.221 -3.973 -4.931 1.00 53.23 S ATOM 0 H CYS B 43 2.760 -5.276 -1.397 1.00 52.43 H new ATOM 0 HA CYS B 43 0.378 -6.209 -2.836 1.00 11.13 H new ATOM 0 HB2 CYS B 43 -0.144 -3.869 -2.568 1.00 62.24 H new ATOM 0 HB3 CYS B 43 1.489 -3.391 -2.986 1.00 62.24 H new ATOM 0 HG CYS B 43 -0.077 -5.148 -5.402 1.00 53.23 H new ATOM 2240 N LEU B 44 2.055 -7.037 -4.483 1.00 13.51 N ATOM 2241 CA LEU B 44 2.989 -7.589 -5.467 1.00 45.20 C ATOM 2242 C LEU B 44 2.184 -8.217 -6.616 1.00 21.55 C ATOM 2243 O LEU B 44 1.121 -8.820 -6.370 1.00 61.22 O ATOM 2244 CB LEU B 44 3.989 -8.585 -4.783 1.00 63.23 C ATOM 2245 CG LEU B 44 3.405 -9.573 -3.712 1.00 33.02 C ATOM 2246 CD1 LEU B 44 2.667 -10.779 -4.334 1.00 40.21 C ATOM 2247 CD2 LEU B 44 4.497 -10.033 -2.724 1.00 71.31 C ATOM 0 H LEU B 44 1.172 -7.545 -4.429 1.00 13.51 H new ATOM 0 HA LEU B 44 3.609 -6.800 -5.893 1.00 45.20 H new ATOM 0 HB2 LEU B 44 4.462 -9.178 -5.566 1.00 63.23 H new ATOM 0 HB3 LEU B 44 4.776 -7.999 -4.307 1.00 63.23 H new ATOM 0 HG LEU B 44 2.653 -9.012 -3.157 1.00 33.02 H new ATOM 0 HD11 LEU B 44 2.288 -11.423 -3.540 1.00 40.21 H new ATOM 0 HD12 LEU B 44 1.835 -10.423 -4.941 1.00 40.21 H new ATOM 0 HD13 LEU B 44 3.357 -11.344 -4.961 1.00 40.21 H new ATOM 0 HD21 LEU B 44 4.063 -10.716 -1.994 1.00 71.31 H new ATOM 0 HD22 LEU B 44 5.291 -10.542 -3.270 1.00 71.31 H new ATOM 0 HD23 LEU B 44 4.910 -9.166 -2.208 1.00 71.31 H new ATOM 2259 N PRO B 45 2.651 -8.058 -7.893 1.00 3.41 N ATOM 2260 CA PRO B 45 1.911 -8.541 -9.063 1.00 43.45 C ATOM 2261 C PRO B 45 1.988 -10.075 -9.204 1.00 33.33 C ATOM 2262 O PRO B 45 2.886 -10.731 -8.660 1.00 10.42 O ATOM 2263 CB PRO B 45 2.600 -7.809 -10.241 1.00 54.12 C ATOM 2264 CG PRO B 45 4.013 -7.617 -9.793 1.00 32.30 C ATOM 2265 CD PRO B 45 3.938 -7.406 -8.293 1.00 11.04 C ATOM 0 HA PRO B 45 0.842 -8.335 -9.005 1.00 43.45 H new ATOM 0 HB2 PRO B 45 2.551 -8.399 -11.157 1.00 54.12 H new ATOM 0 HB3 PRO B 45 2.118 -6.854 -10.451 1.00 54.12 H new ATOM 0 HG2 PRO B 45 4.623 -8.486 -10.037 1.00 32.30 H new ATOM 0 HG3 PRO B 45 4.468 -6.759 -10.288 1.00 32.30 H new ATOM 0 HD2 PRO B 45 4.789 -7.859 -7.784 1.00 11.04 H new ATOM 0 HD3 PRO B 45 3.943 -6.346 -8.039 1.00 11.04 H new ATOM 2273 N ILE B 46 1.009 -10.622 -9.908 1.00 30.23 N ATOM 2274 CA ILE B 46 0.946 -12.037 -10.250 1.00 5.33 C ATOM 2275 C ILE B 46 1.668 -12.231 -11.581 1.00 44.34 C ATOM 2276 O ILE B 46 1.351 -11.547 -12.560 1.00 51.43 O ATOM 2277 CB ILE B 46 -0.556 -12.498 -10.329 1.00 33.05 C ATOM 2278 CG1 ILE B 46 -1.246 -12.330 -8.934 1.00 73.14 C ATOM 2279 CG2 ILE B 46 -0.700 -13.940 -10.851 1.00 52.30 C ATOM 2280 CD1 ILE B 46 -0.548 -13.050 -7.783 1.00 61.50 C ATOM 0 H ILE B 46 0.219 -10.085 -10.266 1.00 30.23 H new ATOM 0 HA ILE B 46 1.432 -12.647 -9.489 1.00 5.33 H new ATOM 0 HB ILE B 46 -1.060 -11.856 -11.051 1.00 33.05 H new ATOM 0 HG12 ILE B 46 -1.303 -11.267 -8.698 1.00 73.14 H new ATOM 0 HG13 ILE B 46 -2.270 -12.696 -9.005 1.00 73.14 H new ATOM 0 HG21 ILE B 46 -1.755 -14.210 -10.887 1.00 52.30 H new ATOM 0 HG22 ILE B 46 -0.274 -14.009 -11.852 1.00 52.30 H new ATOM 0 HG23 ILE B 46 -0.173 -14.623 -10.184 1.00 52.30 H new ATOM 0 HD11 ILE B 46 -1.098 -12.876 -6.858 1.00 61.50 H new ATOM 0 HD12 ILE B 46 -0.515 -14.120 -7.990 1.00 61.50 H new ATOM 0 HD13 ILE B 46 0.468 -12.669 -7.678 1.00 61.50 H new ATOM 2292 N GLN B 47 2.661 -13.133 -11.607 1.00 62.31 N ATOM 2293 CA GLN B 47 3.484 -13.355 -12.808 1.00 72.32 C ATOM 2294 C GLN B 47 2.659 -14.017 -13.927 1.00 35.43 C ATOM 2295 O GLN B 47 2.804 -13.675 -15.099 1.00 73.24 O ATOM 2296 CB GLN B 47 4.748 -14.205 -12.490 1.00 5.12 C ATOM 2297 CG GLN B 47 4.472 -15.633 -11.982 1.00 0.21 C ATOM 2298 CD GLN B 47 5.718 -16.518 -11.952 1.00 13.02 C ATOM 2299 OE1 GLN B 47 6.014 -17.224 -12.914 1.00 12.11 O ATOM 2300 NE2 GLN B 47 6.473 -16.464 -10.872 1.00 64.21 N ATOM 0 H GLN B 47 2.914 -13.720 -10.812 1.00 62.31 H new ATOM 0 HA GLN B 47 3.818 -12.377 -13.155 1.00 72.32 H new ATOM 0 HB2 GLN B 47 5.358 -14.269 -13.391 1.00 5.12 H new ATOM 0 HB3 GLN B 47 5.340 -13.679 -11.741 1.00 5.12 H new ATOM 0 HG2 GLN B 47 4.050 -15.578 -10.979 1.00 0.21 H new ATOM 0 HG3 GLN B 47 3.720 -16.098 -12.619 1.00 0.21 H new ATOM 0 HE21 GLN B 47 6.202 -15.869 -10.089 1.00 64.21 H new ATOM 0 HE22 GLN B 47 7.328 -17.017 -10.819 1.00 64.21 H new ATOM 2309 N ASP B 48 1.769 -14.939 -13.540 1.00 54.02 N ATOM 2310 CA ASP B 48 1.024 -15.780 -14.490 1.00 42.10 C ATOM 2311 C ASP B 48 -0.147 -15.016 -15.144 1.00 73.23 C ATOM 2312 O ASP B 48 -0.501 -15.284 -16.297 1.00 12.41 O ATOM 2313 CB ASP B 48 0.520 -17.051 -13.766 1.00 43.10 C ATOM 2314 CG ASP B 48 -0.256 -18.011 -14.685 1.00 2.24 C ATOM 2315 OD1 ASP B 48 0.374 -18.662 -15.550 1.00 72.01 O ATOM 2316 OD2 ASP B 48 -1.497 -18.102 -14.562 1.00 61.43 O ATOM 0 H ASP B 48 1.544 -15.124 -12.562 1.00 54.02 H new ATOM 0 HA ASP B 48 1.699 -16.066 -15.296 1.00 42.10 H new ATOM 0 HB2 ASP B 48 1.373 -17.579 -13.339 1.00 43.10 H new ATOM 0 HB3 ASP B 48 -0.122 -16.757 -12.936 1.00 43.10 H new ATOM 2321 N SER B 49 -0.719 -14.047 -14.414 1.00 62.14 N ATOM 2322 CA SER B 49 -1.967 -13.362 -14.814 1.00 52.10 C ATOM 2323 C SER B 49 -1.885 -11.852 -14.519 1.00 44.53 C ATOM 2324 O SER B 49 -1.212 -11.443 -13.569 1.00 0.32 O ATOM 2325 CB SER B 49 -3.160 -13.992 -14.062 1.00 41.05 C ATOM 2326 OG SER B 49 -3.229 -15.393 -14.281 1.00 32.45 O ATOM 0 H SER B 49 -0.334 -13.713 -13.530 1.00 62.14 H new ATOM 0 HA SER B 49 -2.108 -13.485 -15.888 1.00 52.10 H new ATOM 0 HB2 SER B 49 -3.065 -13.793 -12.994 1.00 41.05 H new ATOM 0 HB3 SER B 49 -4.088 -13.525 -14.392 1.00 41.05 H new ATOM 0 HG SER B 49 -3.993 -15.763 -13.791 1.00 32.45 H new ATOM 2332 N ASP B 50 -2.597 -11.036 -15.329 1.00 62.14 N ATOM 2333 CA ASP B 50 -2.600 -9.556 -15.205 1.00 23.14 C ATOM 2334 C ASP B 50 -3.458 -9.105 -14.016 1.00 4.44 C ATOM 2335 O ASP B 50 -4.629 -8.713 -14.177 1.00 12.54 O ATOM 2336 CB ASP B 50 -3.101 -8.898 -16.514 1.00 12.32 C ATOM 2337 CG ASP B 50 -2.174 -9.181 -17.696 1.00 65.35 C ATOM 2338 OD1 ASP B 50 -1.187 -8.440 -17.878 1.00 21.45 O ATOM 2339 OD2 ASP B 50 -2.425 -10.149 -18.453 1.00 60.43 O ATOM 0 H ASP B 50 -3.186 -11.382 -16.087 1.00 62.14 H new ATOM 0 HA ASP B 50 -1.575 -9.233 -15.026 1.00 23.14 H new ATOM 0 HB2 ASP B 50 -4.101 -9.265 -16.743 1.00 12.32 H new ATOM 0 HB3 ASP B 50 -3.183 -7.821 -16.369 1.00 12.32 H new ATOM 2344 N LYS B 51 -2.869 -9.209 -12.820 1.00 60.03 N ATOM 2345 CA LYS B 51 -3.505 -8.836 -11.552 1.00 33.04 C ATOM 2346 C LYS B 51 -2.440 -8.731 -10.440 1.00 61.13 C ATOM 2347 O LYS B 51 -1.246 -8.897 -10.702 1.00 34.30 O ATOM 2348 CB LYS B 51 -4.629 -9.856 -11.193 1.00 43.12 C ATOM 2349 CG LYS B 51 -4.162 -11.324 -11.088 1.00 24.02 C ATOM 2350 CD LYS B 51 -5.332 -12.312 -10.909 1.00 21.32 C ATOM 2351 CE LYS B 51 -4.858 -13.756 -10.721 1.00 64.41 C ATOM 2352 NZ LYS B 51 -5.993 -14.695 -10.554 1.00 64.41 N ATOM 0 H LYS B 51 -1.919 -9.561 -12.704 1.00 60.03 H new ATOM 0 HA LYS B 51 -3.974 -7.857 -11.652 1.00 33.04 H new ATOM 0 HB2 LYS B 51 -5.076 -9.563 -10.243 1.00 43.12 H new ATOM 0 HB3 LYS B 51 -5.413 -9.792 -11.948 1.00 43.12 H new ATOM 0 HG2 LYS B 51 -3.604 -11.588 -11.986 1.00 24.02 H new ATOM 0 HG3 LYS B 51 -3.477 -11.423 -10.246 1.00 24.02 H new ATOM 0 HD2 LYS B 51 -5.927 -12.013 -10.046 1.00 21.32 H new ATOM 0 HD3 LYS B 51 -5.985 -12.258 -11.780 1.00 21.32 H new ATOM 0 HE2 LYS B 51 -4.262 -14.057 -11.582 1.00 64.41 H new ATOM 0 HE3 LYS B 51 -4.208 -13.814 -9.848 1.00 64.41 H new ATOM 0 HZ1 LYS B 51 -5.629 -15.661 -10.430 1.00 64.41 H new ATOM 0 HZ2 LYS B 51 -6.548 -14.424 -9.717 1.00 64.41 H new ATOM 0 HZ3 LYS B 51 -6.600 -14.660 -11.398 1.00 64.41 H new ATOM 2366 N SER B 52 -2.887 -8.455 -9.216 1.00 73.51 N ATOM 2367 CA SER B 52 -2.025 -8.259 -8.045 1.00 74.13 C ATOM 2368 C SER B 52 -2.832 -8.585 -6.784 1.00 64.42 C ATOM 2369 O SER B 52 -4.053 -8.435 -6.776 1.00 60.34 O ATOM 2370 CB SER B 52 -1.519 -6.793 -7.992 1.00 62.15 C ATOM 2371 OG SER B 52 -0.701 -6.560 -6.855 1.00 15.34 O ATOM 0 H SER B 52 -3.880 -8.359 -9.003 1.00 73.51 H new ATOM 0 HA SER B 52 -1.158 -8.917 -8.110 1.00 74.13 H new ATOM 0 HB2 SER B 52 -0.955 -6.570 -8.898 1.00 62.15 H new ATOM 0 HB3 SER B 52 -2.372 -6.114 -7.972 1.00 62.15 H new ATOM 0 HG SER B 52 -0.212 -7.379 -6.631 1.00 15.34 H new ATOM 2377 N HIS B 53 -2.160 -9.064 -5.731 1.00 12.11 N ATOM 2378 CA HIS B 53 -2.788 -9.275 -4.411 1.00 32.31 C ATOM 2379 C HIS B 53 -2.255 -8.204 -3.454 1.00 55.53 C ATOM 2380 O HIS B 53 -1.039 -8.051 -3.314 1.00 64.04 O ATOM 2381 CB HIS B 53 -2.485 -10.690 -3.857 1.00 13.41 C ATOM 2382 CG HIS B 53 -3.168 -11.837 -4.562 1.00 14.23 C ATOM 2383 ND1 HIS B 53 -3.686 -12.923 -3.892 1.00 43.13 N ATOM 2384 CD2 HIS B 53 -3.370 -12.089 -5.876 1.00 35.55 C ATOM 2385 CE1 HIS B 53 -4.170 -13.789 -4.759 1.00 33.22 C ATOM 2386 NE2 HIS B 53 -3.991 -13.308 -5.972 1.00 72.33 N ATOM 0 H HIS B 53 -1.172 -9.316 -5.763 1.00 12.11 H new ATOM 0 HA HIS B 53 -3.871 -9.195 -4.510 1.00 32.31 H new ATOM 0 HB2 HIS B 53 -1.408 -10.853 -3.900 1.00 13.41 H new ATOM 0 HB3 HIS B 53 -2.769 -10.715 -2.805 1.00 13.41 H new ATOM 0 HD1 HIS B 53 -3.694 -13.039 -2.879 1.00 43.13 H new ATOM 0 HD2 HIS B 53 -3.093 -11.447 -6.699 1.00 35.55 H new ATOM 0 HE1 HIS B 53 -4.635 -14.733 -4.516 1.00 33.22 H new ATOM 2395 N ILE B 54 -3.170 -7.438 -2.836 1.00 61.34 N ATOM 2396 CA ILE B 54 -2.815 -6.392 -1.867 1.00 32.23 C ATOM 2397 C ILE B 54 -3.367 -6.808 -0.490 1.00 34.11 C ATOM 2398 O ILE B 54 -4.580 -6.788 -0.288 1.00 41.51 O ATOM 2399 CB ILE B 54 -3.360 -4.944 -2.253 1.00 71.31 C ATOM 2400 CG1 ILE B 54 -2.931 -4.488 -3.694 1.00 34.20 C ATOM 2401 CG2 ILE B 54 -2.892 -3.895 -1.211 1.00 33.44 C ATOM 2402 CD1 ILE B 54 -3.637 -5.181 -4.850 1.00 24.14 C ATOM 0 H ILE B 54 -4.174 -7.528 -2.995 1.00 61.34 H new ATOM 0 HA ILE B 54 -1.728 -6.307 -1.858 1.00 32.23 H new ATOM 0 HB ILE B 54 -4.448 -5.014 -2.249 1.00 71.31 H new ATOM 0 HG12 ILE B 54 -3.102 -3.415 -3.780 1.00 34.20 H new ATOM 0 HG13 ILE B 54 -1.858 -4.649 -3.800 1.00 34.20 H new ATOM 0 HG21 ILE B 54 -3.272 -2.912 -1.489 1.00 33.44 H new ATOM 0 HG22 ILE B 54 -3.272 -4.166 -0.226 1.00 33.44 H new ATOM 0 HG23 ILE B 54 -1.803 -3.869 -1.185 1.00 33.44 H new ATOM 0 HD11 ILE B 54 -3.262 -4.787 -5.794 1.00 24.14 H new ATOM 0 HD12 ILE B 54 -3.446 -6.253 -4.803 1.00 24.14 H new ATOM 0 HD13 ILE B 54 -4.710 -5.000 -4.782 1.00 24.14 H new ATOM 2414 N TRP B 55 -2.471 -7.213 0.423 1.00 11.15 N ATOM 2415 CA TRP B 55 -2.816 -7.588 1.801 1.00 0.53 C ATOM 2416 C TRP B 55 -2.810 -6.328 2.690 1.00 33.31 C ATOM 2417 O TRP B 55 -1.741 -5.763 2.957 1.00 1.13 O ATOM 2418 CB TRP B 55 -1.792 -8.634 2.342 1.00 11.30 C ATOM 2419 CG TRP B 55 -1.743 -9.929 1.541 1.00 63.14 C ATOM 2420 CD1 TRP B 55 -2.421 -11.086 1.797 1.00 73.04 C ATOM 2421 CD2 TRP B 55 -0.957 -10.205 0.380 1.00 73.40 C ATOM 2422 NE1 TRP B 55 -2.148 -12.026 0.850 1.00 3.53 N ATOM 2423 CE2 TRP B 55 -1.237 -11.525 -0.017 1.00 30.51 C ATOM 2424 CE3 TRP B 55 -0.049 -9.468 -0.360 1.00 33.10 C ATOM 2425 CZ2 TRP B 55 -0.649 -12.116 -1.123 1.00 20.10 C ATOM 2426 CZ3 TRP B 55 0.544 -10.054 -1.452 1.00 54.10 C ATOM 2427 CH2 TRP B 55 0.245 -11.369 -1.824 1.00 55.03 C ATOM 0 H TRP B 55 -1.474 -7.290 0.221 1.00 11.15 H new ATOM 0 HA TRP B 55 -3.810 -8.035 1.817 1.00 0.53 H new ATOM 0 HB2 TRP B 55 -0.799 -8.185 2.347 1.00 11.30 H new ATOM 0 HB3 TRP B 55 -2.041 -8.869 3.377 1.00 11.30 H new ATOM 0 HD1 TRP B 55 -3.084 -11.236 2.636 1.00 73.04 H new ATOM 0 HE1 TRP B 55 -2.563 -12.957 0.802 1.00 3.53 H new ATOM 0 HE3 TRP B 55 0.189 -8.451 -0.084 1.00 33.10 H new ATOM 0 HZ2 TRP B 55 -0.890 -13.127 -1.416 1.00 20.10 H new ATOM 0 HZ3 TRP B 55 1.255 -9.488 -2.035 1.00 54.10 H new ATOM 0 HH2 TRP B 55 0.734 -11.799 -2.685 1.00 55.03 H new ATOM 2438 N LEU B 56 -4.006 -5.869 3.096 1.00 71.53 N ATOM 2439 CA LEU B 56 -4.164 -4.708 3.993 1.00 22.45 C ATOM 2440 C LEU B 56 -4.211 -5.182 5.449 1.00 14.25 C ATOM 2441 O LEU B 56 -5.158 -5.852 5.861 1.00 71.42 O ATOM 2442 CB LEU B 56 -5.448 -3.880 3.666 1.00 22.22 C ATOM 2443 CG LEU B 56 -5.477 -3.119 2.295 1.00 40.12 C ATOM 2444 CD1 LEU B 56 -4.201 -2.269 2.088 1.00 53.43 C ATOM 2445 CD2 LEU B 56 -5.741 -4.075 1.110 1.00 21.40 C ATOM 0 H LEU B 56 -4.890 -6.291 2.813 1.00 71.53 H new ATOM 0 HA LEU B 56 -3.305 -4.055 3.839 1.00 22.45 H new ATOM 0 HB2 LEU B 56 -6.303 -4.555 3.696 1.00 22.22 H new ATOM 0 HB3 LEU B 56 -5.591 -3.149 4.462 1.00 22.22 H new ATOM 0 HG LEU B 56 -6.318 -2.426 2.328 1.00 40.12 H new ATOM 0 HD11 LEU B 56 -4.257 -1.756 1.128 1.00 53.43 H new ATOM 0 HD12 LEU B 56 -4.120 -1.533 2.888 1.00 53.43 H new ATOM 0 HD13 LEU B 56 -3.325 -2.918 2.102 1.00 53.43 H new ATOM 0 HD21 LEU B 56 -5.753 -3.507 0.180 1.00 21.40 H new ATOM 0 HD22 LEU B 56 -4.953 -4.826 1.066 1.00 21.40 H new ATOM 0 HD23 LEU B 56 -6.704 -4.567 1.247 1.00 21.40 H new ATOM 2457 N LEU B 57 -3.178 -4.815 6.203 1.00 43.34 N ATOM 2458 CA LEU B 57 -3.056 -5.099 7.638 1.00 44.32 C ATOM 2459 C LEU B 57 -3.722 -3.954 8.395 1.00 73.44 C ATOM 2460 O LEU B 57 -3.167 -2.858 8.491 1.00 62.34 O ATOM 2461 CB LEU B 57 -1.562 -5.218 8.059 1.00 65.25 C ATOM 2462 CG LEU B 57 -0.793 -6.517 7.661 1.00 53.11 C ATOM 2463 CD1 LEU B 57 -0.856 -6.823 6.148 1.00 64.35 C ATOM 2464 CD2 LEU B 57 0.667 -6.445 8.166 1.00 62.43 C ATOM 0 H LEU B 57 -2.382 -4.300 5.828 1.00 43.34 H new ATOM 0 HA LEU B 57 -3.538 -6.049 7.869 1.00 44.32 H new ATOM 0 HB2 LEU B 57 -1.026 -4.369 7.635 1.00 65.25 H new ATOM 0 HB3 LEU B 57 -1.511 -5.118 9.143 1.00 65.25 H new ATOM 0 HG LEU B 57 -1.297 -7.352 8.149 1.00 53.11 H new ATOM 0 HD11 LEU B 57 -0.302 -7.738 5.938 1.00 64.35 H new ATOM 0 HD12 LEU B 57 -1.895 -6.951 5.846 1.00 64.35 H new ATOM 0 HD13 LEU B 57 -0.415 -5.996 5.591 1.00 64.35 H new ATOM 0 HD21 LEU B 57 1.195 -7.356 7.883 1.00 62.43 H new ATOM 0 HD22 LEU B 57 1.164 -5.584 7.720 1.00 62.43 H new ATOM 0 HD23 LEU B 57 0.672 -6.345 9.251 1.00 62.43 H new ATOM 2476 N VAL B 58 -4.932 -4.209 8.875 1.00 10.32 N ATOM 2477 CA VAL B 58 -5.743 -3.217 9.590 1.00 53.52 C ATOM 2478 C VAL B 58 -6.524 -3.947 10.682 1.00 70.01 C ATOM 2479 O VAL B 58 -6.834 -5.116 10.506 1.00 23.53 O ATOM 2480 CB VAL B 58 -6.716 -2.476 8.583 1.00 22.13 C ATOM 2481 CG1 VAL B 58 -7.849 -3.387 8.055 1.00 13.12 C ATOM 2482 CG2 VAL B 58 -7.264 -1.166 9.181 1.00 21.14 C ATOM 0 H VAL B 58 -5.387 -5.117 8.781 1.00 10.32 H new ATOM 0 HA VAL B 58 -5.108 -2.456 10.043 1.00 53.52 H new ATOM 0 HB VAL B 58 -6.113 -2.213 7.714 1.00 22.13 H new ATOM 0 HG11 VAL B 58 -8.481 -2.822 7.370 1.00 13.12 H new ATOM 0 HG12 VAL B 58 -7.416 -4.239 7.530 1.00 13.12 H new ATOM 0 HG13 VAL B 58 -8.449 -3.744 8.892 1.00 13.12 H new ATOM 0 HG21 VAL B 58 -7.927 -0.687 8.461 1.00 21.14 H new ATOM 0 HG22 VAL B 58 -7.818 -1.386 10.094 1.00 21.14 H new ATOM 0 HG23 VAL B 58 -6.435 -0.497 9.412 1.00 21.14 H new ATOM 2492 N ASN B 59 -6.828 -3.299 11.811 1.00 62.25 N ATOM 2493 CA ASN B 59 -7.570 -3.976 12.895 1.00 23.33 C ATOM 2494 C ASN B 59 -9.061 -4.089 12.509 1.00 53.34 C ATOM 2495 O ASN B 59 -9.648 -3.135 11.976 1.00 15.33 O ATOM 2496 CB ASN B 59 -7.367 -3.261 14.261 1.00 52.23 C ATOM 2497 CG ASN B 59 -8.025 -1.881 14.373 1.00 12.42 C ATOM 2498 OD1 ASN B 59 -8.166 -1.153 13.390 1.00 62.03 O ATOM 2499 ND2 ASN B 59 -8.439 -1.511 15.570 1.00 10.23 N ATOM 0 H ASN B 59 -6.581 -2.328 12.002 1.00 62.25 H new ATOM 0 HA ASN B 59 -7.173 -4.983 13.020 1.00 23.33 H new ATOM 0 HB2 ASN B 59 -7.761 -3.900 15.051 1.00 52.23 H new ATOM 0 HB3 ASN B 59 -6.298 -3.153 14.442 1.00 52.23 H new ATOM 0 HD21 ASN B 59 -8.888 -0.604 15.697 1.00 10.23 H new ATOM 0 HD22 ASN B 59 -8.311 -2.132 16.369 1.00 10.23 H new ATOM 2506 N ASP B 60 -9.643 -5.279 12.734 1.00 15.34 N ATOM 2507 CA ASP B 60 -11.044 -5.563 12.387 1.00 64.12 C ATOM 2508 C ASP B 60 -12.008 -4.798 13.299 1.00 22.41 C ATOM 2509 O ASP B 60 -11.733 -4.595 14.485 1.00 63.55 O ATOM 2510 CB ASP B 60 -11.347 -7.081 12.418 1.00 73.34 C ATOM 2511 CG ASP B 60 -11.217 -7.703 13.817 1.00 44.12 C ATOM 2512 OD1 ASP B 60 -10.083 -7.994 14.239 1.00 44.53 O ATOM 2513 OD2 ASP B 60 -12.250 -7.899 14.502 1.00 3.04 O ATOM 0 H ASP B 60 -9.157 -6.068 13.160 1.00 15.34 H new ATOM 0 HA ASP B 60 -11.197 -5.217 11.365 1.00 64.12 H new ATOM 0 HB2 ASP B 60 -12.358 -7.249 12.047 1.00 73.34 H new ATOM 0 HB3 ASP B 60 -10.668 -7.593 11.737 1.00 73.34 H new ATOM 2518 N ASP B 61 -13.113 -4.348 12.704 1.00 10.13 N ATOM 2519 CA ASP B 61 -14.159 -3.581 13.386 1.00 4.54 C ATOM 2520 C ASP B 61 -15.521 -3.997 12.820 1.00 62.51 C ATOM 2521 O ASP B 61 -15.587 -4.616 11.743 1.00 1.43 O ATOM 2522 CB ASP B 61 -13.881 -2.074 13.171 1.00 54.23 C ATOM 2523 CG ASP B 61 -14.872 -1.149 13.880 1.00 70.53 C ATOM 2524 OD1 ASP B 61 -14.821 -1.062 15.115 1.00 33.42 O ATOM 2525 OD2 ASP B 61 -15.702 -0.515 13.204 1.00 71.10 O ATOM 0 H ASP B 61 -13.311 -4.509 11.716 1.00 10.13 H new ATOM 0 HA ASP B 61 -14.164 -3.778 14.458 1.00 4.54 H new ATOM 0 HB2 ASP B 61 -12.874 -1.848 13.522 1.00 54.23 H new ATOM 0 HB3 ASP B 61 -13.902 -1.860 12.102 1.00 54.23 H new ATOM 2530 N GLN B 62 -16.606 -3.669 13.550 1.00 71.14 N ATOM 2531 CA GLN B 62 -17.988 -3.931 13.107 1.00 4.10 C ATOM 2532 C GLN B 62 -18.259 -3.249 11.749 1.00 31.34 C ATOM 2533 O GLN B 62 -18.770 -3.878 10.819 1.00 22.45 O ATOM 2534 CB GLN B 62 -19.005 -3.427 14.168 1.00 20.04 C ATOM 2535 CG GLN B 62 -18.919 -4.140 15.537 1.00 12.43 C ATOM 2536 CD GLN B 62 -19.891 -3.586 16.597 1.00 25.42 C ATOM 2537 OE1 GLN B 62 -20.393 -4.329 17.441 1.00 73.20 O ATOM 2538 NE2 GLN B 62 -20.136 -2.279 16.592 1.00 64.41 N ATOM 0 H GLN B 62 -16.548 -3.216 14.462 1.00 71.14 H new ATOM 0 HA GLN B 62 -18.110 -5.008 12.989 1.00 4.10 H new ATOM 0 HB2 GLN B 62 -18.851 -2.359 14.320 1.00 20.04 H new ATOM 0 HB3 GLN B 62 -20.013 -3.551 13.772 1.00 20.04 H new ATOM 0 HG2 GLN B 62 -19.120 -5.202 15.395 1.00 12.43 H new ATOM 0 HG3 GLN B 62 -17.900 -4.056 15.915 1.00 12.43 H new ATOM 0 HE21 GLN B 62 -19.709 -1.683 15.883 1.00 64.41 H new ATOM 0 HE22 GLN B 62 -20.751 -1.873 17.297 1.00 64.41 H new ATOM 2547 N ARG B 63 -17.847 -1.977 11.640 1.00 43.00 N ATOM 2548 CA ARG B 63 -18.066 -1.147 10.438 1.00 54.32 C ATOM 2549 C ARG B 63 -17.127 -1.570 9.299 1.00 4.41 C ATOM 2550 O ARG B 63 -17.477 -1.419 8.129 1.00 72.41 O ATOM 2551 CB ARG B 63 -17.876 0.361 10.766 1.00 40.34 C ATOM 2552 CG ARG B 63 -18.114 1.318 9.569 1.00 2.33 C ATOM 2553 CD ARG B 63 -17.893 2.795 9.921 1.00 1.51 C ATOM 2554 NE ARG B 63 -18.863 3.281 10.917 1.00 24.52 N ATOM 2555 CZ ARG B 63 -18.650 4.275 11.794 1.00 44.01 C ATOM 2556 NH1 ARG B 63 -17.487 4.921 11.823 1.00 50.51 N ATOM 2557 NH2 ARG B 63 -19.604 4.614 12.645 1.00 33.10 N ATOM 0 H ARG B 63 -17.350 -1.489 12.385 1.00 43.00 H new ATOM 0 HA ARG B 63 -19.093 -1.301 10.108 1.00 54.32 H new ATOM 0 HB2 ARG B 63 -18.558 0.632 11.572 1.00 40.34 H new ATOM 0 HB3 ARG B 63 -16.863 0.513 11.140 1.00 40.34 H new ATOM 0 HG2 ARG B 63 -17.446 1.042 8.753 1.00 2.33 H new ATOM 0 HG3 ARG B 63 -19.133 1.187 9.205 1.00 2.33 H new ATOM 0 HD2 ARG B 63 -16.882 2.928 10.306 1.00 1.51 H new ATOM 0 HD3 ARG B 63 -17.971 3.398 9.016 1.00 1.51 H new ATOM 0 HE ARG B 63 -19.774 2.823 10.943 1.00 24.52 H new ATOM 0 HH11 ARG B 63 -16.744 4.663 11.174 1.00 50.51 H new ATOM 0 HH12 ARG B 63 -17.339 5.674 12.495 1.00 50.51 H new ATOM 0 HH21 ARG B 63 -20.497 4.121 12.633 1.00 33.10 H new ATOM 0 HH22 ARG B 63 -19.447 5.368 13.313 1.00 33.10 H new ATOM 2571 N LEU B 64 -15.942 -2.115 9.654 1.00 2.34 N ATOM 2572 CA LEU B 64 -14.920 -2.537 8.667 1.00 21.24 C ATOM 2573 C LEU B 64 -15.502 -3.539 7.651 1.00 5.43 C ATOM 2574 O LEU B 64 -15.157 -3.503 6.472 1.00 41.22 O ATOM 2575 CB LEU B 64 -13.686 -3.160 9.371 1.00 52.15 C ATOM 2576 CG LEU B 64 -12.413 -3.345 8.478 1.00 35.34 C ATOM 2577 CD1 LEU B 64 -11.699 -2.004 8.210 1.00 23.21 C ATOM 2578 CD2 LEU B 64 -11.438 -4.359 9.088 1.00 75.55 C ATOM 0 H LEU B 64 -15.668 -2.274 10.623 1.00 2.34 H new ATOM 0 HA LEU B 64 -14.603 -1.643 8.130 1.00 21.24 H new ATOM 0 HB2 LEU B 64 -13.422 -2.532 10.222 1.00 52.15 H new ATOM 0 HB3 LEU B 64 -13.972 -4.133 9.769 1.00 52.15 H new ATOM 0 HG LEU B 64 -12.757 -3.738 7.521 1.00 35.34 H new ATOM 0 HD11 LEU B 64 -10.821 -2.177 7.587 1.00 23.21 H new ATOM 0 HD12 LEU B 64 -12.380 -1.325 7.697 1.00 23.21 H new ATOM 0 HD13 LEU B 64 -11.390 -1.561 9.157 1.00 23.21 H new ATOM 0 HD21 LEU B 64 -10.567 -4.461 8.441 1.00 75.55 H new ATOM 0 HD22 LEU B 64 -11.121 -4.012 10.071 1.00 75.55 H new ATOM 0 HD23 LEU B 64 -11.932 -5.325 9.186 1.00 75.55 H new ATOM 2590 N GLU B 65 -16.420 -4.391 8.137 1.00 64.54 N ATOM 2591 CA GLU B 65 -17.110 -5.411 7.321 1.00 40.32 C ATOM 2592 C GLU B 65 -17.965 -4.769 6.213 1.00 2.14 C ATOM 2593 O GLU B 65 -18.074 -5.318 5.111 1.00 61.52 O ATOM 2594 CB GLU B 65 -17.983 -6.310 8.227 1.00 54.11 C ATOM 2595 CG GLU B 65 -17.184 -7.026 9.335 1.00 62.33 C ATOM 2596 CD GLU B 65 -18.052 -7.946 10.204 1.00 53.32 C ATOM 2597 OE1 GLU B 65 -18.348 -9.083 9.776 1.00 73.20 O ATOM 2598 OE2 GLU B 65 -18.443 -7.541 11.320 1.00 40.31 O ATOM 0 H GLU B 65 -16.708 -4.393 9.115 1.00 64.54 H new ATOM 0 HA GLU B 65 -16.351 -6.023 6.834 1.00 40.32 H new ATOM 0 HB2 GLU B 65 -18.762 -5.702 8.687 1.00 54.11 H new ATOM 0 HB3 GLU B 65 -18.484 -7.057 7.611 1.00 54.11 H new ATOM 0 HG2 GLU B 65 -16.387 -7.613 8.878 1.00 62.33 H new ATOM 0 HG3 GLU B 65 -16.707 -6.280 9.970 1.00 62.33 H new ATOM 2605 N GLN B 66 -18.554 -3.603 6.524 1.00 75.21 N ATOM 2606 CA GLN B 66 -19.344 -2.800 5.563 1.00 21.54 C ATOM 2607 C GLN B 66 -18.428 -2.262 4.449 1.00 21.54 C ATOM 2608 O GLN B 66 -18.793 -2.288 3.267 1.00 72.22 O ATOM 2609 CB GLN B 66 -20.039 -1.618 6.294 1.00 73.33 C ATOM 2610 CG GLN B 66 -20.985 -0.772 5.412 1.00 52.33 C ATOM 2611 CD GLN B 66 -21.551 0.461 6.130 1.00 20.42 C ATOM 2612 OE1 GLN B 66 -20.905 1.050 7.001 1.00 11.14 O ATOM 2613 NE2 GLN B 66 -22.761 0.857 5.778 1.00 13.14 N ATOM 0 H GLN B 66 -18.498 -3.185 7.453 1.00 75.21 H new ATOM 0 HA GLN B 66 -20.109 -3.437 5.119 1.00 21.54 H new ATOM 0 HB2 GLN B 66 -20.608 -2.014 7.135 1.00 73.33 H new ATOM 0 HB3 GLN B 66 -19.271 -0.964 6.708 1.00 73.33 H new ATOM 0 HG2 GLN B 66 -20.446 -0.449 4.521 1.00 52.33 H new ATOM 0 HG3 GLN B 66 -21.811 -1.398 5.075 1.00 52.33 H new ATOM 0 HE21 GLN B 66 -23.273 0.352 5.055 1.00 13.14 H new ATOM 0 HE22 GLN B 66 -23.184 1.668 6.229 1.00 13.14 H new ATOM 2622 N MET B 67 -17.236 -1.778 4.853 1.00 33.43 N ATOM 2623 CA MET B 67 -16.192 -1.286 3.924 1.00 22.22 C ATOM 2624 C MET B 67 -15.733 -2.405 2.962 1.00 23.13 C ATOM 2625 O MET B 67 -15.574 -2.161 1.762 1.00 71.42 O ATOM 2626 CB MET B 67 -14.979 -0.717 4.713 1.00 42.43 C ATOM 2627 CG MET B 67 -15.180 0.676 5.340 1.00 14.01 C ATOM 2628 SD MET B 67 -16.560 0.790 6.501 1.00 52.41 S ATOM 2629 CE MET B 67 -17.798 1.689 5.561 1.00 21.23 C ATOM 0 H MET B 67 -16.967 -1.716 5.835 1.00 33.43 H new ATOM 0 HA MET B 67 -16.625 -0.483 3.328 1.00 22.22 H new ATOM 0 HB2 MET B 67 -14.725 -1.419 5.507 1.00 42.43 H new ATOM 0 HB3 MET B 67 -14.122 -0.672 4.041 1.00 42.43 H new ATOM 0 HG2 MET B 67 -14.264 0.962 5.857 1.00 14.01 H new ATOM 0 HG3 MET B 67 -15.335 1.400 4.540 1.00 14.01 H new ATOM 0 HE1 MET B 67 -18.634 1.945 6.212 1.00 21.23 H new ATOM 0 HE2 MET B 67 -17.358 2.602 5.160 1.00 21.23 H new ATOM 0 HE3 MET B 67 -18.154 1.067 4.740 1.00 21.23 H new ATOM 2639 N ILE B 68 -15.537 -3.618 3.518 1.00 34.41 N ATOM 2640 CA ILE B 68 -15.139 -4.825 2.762 1.00 61.44 C ATOM 2641 C ILE B 68 -16.221 -5.202 1.730 1.00 54.53 C ATOM 2642 O ILE B 68 -15.916 -5.500 0.571 1.00 33.54 O ATOM 2643 CB ILE B 68 -14.872 -6.038 3.744 1.00 22.51 C ATOM 2644 CG1 ILE B 68 -13.721 -5.697 4.748 1.00 34.45 C ATOM 2645 CG2 ILE B 68 -14.559 -7.354 2.981 1.00 55.12 C ATOM 2646 CD1 ILE B 68 -13.578 -6.674 5.905 1.00 41.42 C ATOM 0 H ILE B 68 -15.652 -3.790 4.517 1.00 34.41 H new ATOM 0 HA ILE B 68 -14.215 -4.601 2.229 1.00 61.44 H new ATOM 0 HB ILE B 68 -15.791 -6.201 4.306 1.00 22.51 H new ATOM 0 HG12 ILE B 68 -12.779 -5.662 4.201 1.00 34.45 H new ATOM 0 HG13 ILE B 68 -13.893 -4.699 5.152 1.00 34.45 H new ATOM 0 HG21 ILE B 68 -14.383 -8.157 3.697 1.00 55.12 H new ATOM 0 HG22 ILE B 68 -15.404 -7.615 2.344 1.00 55.12 H new ATOM 0 HG23 ILE B 68 -13.670 -7.215 2.366 1.00 55.12 H new ATOM 0 HD11 ILE B 68 -12.757 -6.358 6.548 1.00 41.42 H new ATOM 0 HD12 ILE B 68 -14.503 -6.694 6.481 1.00 41.42 H new ATOM 0 HD13 ILE B 68 -13.372 -7.671 5.516 1.00 41.42 H new ATOM 2658 N SER B 69 -17.488 -5.143 2.167 1.00 51.14 N ATOM 2659 CA SER B 69 -18.652 -5.481 1.328 1.00 70.35 C ATOM 2660 C SER B 69 -18.851 -4.451 0.196 1.00 33.24 C ATOM 2661 O SER B 69 -19.249 -4.813 -0.916 1.00 10.32 O ATOM 2662 CB SER B 69 -19.919 -5.563 2.206 1.00 73.04 C ATOM 2663 OG SER B 69 -19.771 -6.524 3.239 1.00 44.43 O ATOM 0 H SER B 69 -17.737 -4.859 3.115 1.00 51.14 H new ATOM 0 HA SER B 69 -18.468 -6.450 0.863 1.00 70.35 H new ATOM 0 HB2 SER B 69 -20.125 -4.586 2.643 1.00 73.04 H new ATOM 0 HB3 SER B 69 -20.777 -5.822 1.586 1.00 73.04 H new ATOM 0 HG SER B 69 -19.182 -6.167 3.936 1.00 44.43 H new ATOM 2669 N GLN B 70 -18.562 -3.172 0.495 1.00 74.33 N ATOM 2670 CA GLN B 70 -18.759 -2.051 -0.445 1.00 60.25 C ATOM 2671 C GLN B 70 -17.711 -2.125 -1.563 1.00 33.14 C ATOM 2672 O GLN B 70 -18.050 -2.046 -2.744 1.00 0.31 O ATOM 2673 CB GLN B 70 -18.665 -0.690 0.330 1.00 64.33 C ATOM 2674 CG GLN B 70 -19.098 0.590 -0.443 1.00 34.33 C ATOM 2675 CD GLN B 70 -18.124 1.096 -1.531 1.00 75.33 C ATOM 2676 OE1 GLN B 70 -18.547 1.661 -2.535 1.00 11.21 O ATOM 2677 NE2 GLN B 70 -16.828 0.920 -1.339 1.00 42.21 N ATOM 0 H GLN B 70 -18.184 -2.885 1.398 1.00 74.33 H new ATOM 0 HA GLN B 70 -19.748 -2.118 -0.899 1.00 60.25 H new ATOM 0 HB2 GLN B 70 -19.278 -0.768 1.228 1.00 64.33 H new ATOM 0 HB3 GLN B 70 -17.634 -0.556 0.658 1.00 64.33 H new ATOM 0 HG2 GLN B 70 -20.063 0.397 -0.911 1.00 34.33 H new ATOM 0 HG3 GLN B 70 -19.249 1.391 0.280 1.00 34.33 H new ATOM 0 HE21 GLN B 70 -16.497 0.448 -0.498 1.00 42.21 H new ATOM 0 HE22 GLN B 70 -16.159 1.256 -2.032 1.00 42.21 H new ATOM 2686 N ILE B 71 -16.436 -2.268 -1.158 1.00 0.22 N ATOM 2687 CA ILE B 71 -15.296 -2.275 -2.092 1.00 62.44 C ATOM 2688 C ILE B 71 -15.328 -3.535 -2.987 1.00 24.14 C ATOM 2689 O ILE B 71 -14.846 -3.517 -4.125 1.00 10.33 O ATOM 2690 CB ILE B 71 -13.917 -2.151 -1.354 1.00 23.22 C ATOM 2691 CG1 ILE B 71 -12.789 -1.860 -2.390 1.00 31.51 C ATOM 2692 CG2 ILE B 71 -13.606 -3.410 -0.496 1.00 52.52 C ATOM 2693 CD1 ILE B 71 -11.399 -1.882 -1.822 1.00 51.45 C ATOM 0 H ILE B 71 -16.168 -2.381 -0.180 1.00 0.22 H new ATOM 0 HA ILE B 71 -15.398 -1.394 -2.725 1.00 62.44 H new ATOM 0 HB ILE B 71 -13.970 -1.314 -0.658 1.00 23.22 H new ATOM 0 HG12 ILE B 71 -12.852 -2.596 -3.192 1.00 31.51 H new ATOM 0 HG13 ILE B 71 -12.969 -0.883 -2.839 1.00 31.51 H new ATOM 0 HG21 ILE B 71 -12.643 -3.284 -0.001 1.00 52.52 H new ATOM 0 HG22 ILE B 71 -14.385 -3.540 0.255 1.00 52.52 H new ATOM 0 HG23 ILE B 71 -13.572 -4.289 -1.139 1.00 52.52 H new ATOM 0 HD11 ILE B 71 -10.679 -1.670 -2.613 1.00 51.45 H new ATOM 0 HD12 ILE B 71 -11.313 -1.127 -1.041 1.00 51.45 H new ATOM 0 HD13 ILE B 71 -11.194 -2.866 -1.400 1.00 51.45 H new ATOM 2705 N ASP B 72 -15.917 -4.618 -2.451 1.00 3.35 N ATOM 2706 CA ASP B 72 -16.140 -5.875 -3.186 1.00 54.04 C ATOM 2707 C ASP B 72 -16.995 -5.640 -4.455 1.00 11.13 C ATOM 2708 O ASP B 72 -16.804 -6.303 -5.476 1.00 54.20 O ATOM 2709 CB ASP B 72 -16.821 -6.900 -2.241 1.00 75.34 C ATOM 2710 CG ASP B 72 -17.250 -8.209 -2.929 1.00 20.52 C ATOM 2711 OD1 ASP B 72 -16.386 -8.908 -3.497 1.00 55.23 O ATOM 2712 OD2 ASP B 72 -18.456 -8.538 -2.913 1.00 4.41 O ATOM 0 H ASP B 72 -16.254 -4.646 -1.489 1.00 3.35 H new ATOM 0 HA ASP B 72 -15.179 -6.269 -3.516 1.00 54.04 H new ATOM 0 HB2 ASP B 72 -16.135 -7.138 -1.428 1.00 75.34 H new ATOM 0 HB3 ASP B 72 -17.698 -6.435 -1.792 1.00 75.34 H new ATOM 2717 N LYS B 73 -17.907 -4.653 -4.387 1.00 74.32 N ATOM 2718 CA LYS B 73 -18.821 -4.327 -5.502 1.00 54.31 C ATOM 2719 C LYS B 73 -18.077 -3.592 -6.639 1.00 75.42 C ATOM 2720 O LYS B 73 -18.572 -3.537 -7.769 1.00 23.12 O ATOM 2721 CB LYS B 73 -20.027 -3.468 -5.009 1.00 22.11 C ATOM 2722 CG LYS B 73 -20.692 -3.955 -3.698 1.00 53.52 C ATOM 2723 CD LYS B 73 -21.062 -5.458 -3.695 1.00 1.34 C ATOM 2724 CE LYS B 73 -22.116 -5.825 -4.748 1.00 12.41 C ATOM 2725 NZ LYS B 73 -22.361 -7.298 -4.807 1.00 12.53 N ATOM 0 H LYS B 73 -18.032 -4.062 -3.565 1.00 74.32 H new ATOM 0 HA LYS B 73 -19.204 -5.270 -5.893 1.00 54.31 H new ATOM 0 HB2 LYS B 73 -19.687 -2.442 -4.866 1.00 22.11 H new ATOM 0 HB3 LYS B 73 -20.782 -3.447 -5.795 1.00 22.11 H new ATOM 0 HG2 LYS B 73 -20.017 -3.757 -2.866 1.00 53.52 H new ATOM 0 HG3 LYS B 73 -21.595 -3.370 -3.522 1.00 53.52 H new ATOM 0 HD2 LYS B 73 -20.162 -6.047 -3.871 1.00 1.34 H new ATOM 0 HD3 LYS B 73 -21.434 -5.732 -2.708 1.00 1.34 H new ATOM 0 HE2 LYS B 73 -23.050 -5.311 -4.520 1.00 12.41 H new ATOM 0 HE3 LYS B 73 -21.789 -5.473 -5.726 1.00 12.41 H new ATOM 0 HZ1 LYS B 73 -23.079 -7.502 -5.531 1.00 12.53 H new ATOM 0 HZ2 LYS B 73 -21.476 -7.788 -5.050 1.00 12.53 H new ATOM 0 HZ3 LYS B 73 -22.698 -7.631 -3.881 1.00 12.53 H new ATOM 2739 N LEU B 74 -16.892 -3.029 -6.322 1.00 13.14 N ATOM 2740 CA LEU B 74 -16.039 -2.327 -7.302 1.00 72.24 C ATOM 2741 C LEU B 74 -15.348 -3.348 -8.228 1.00 51.51 C ATOM 2742 O LEU B 74 -14.861 -4.385 -7.771 1.00 55.32 O ATOM 2743 CB LEU B 74 -14.995 -1.410 -6.585 1.00 13.01 C ATOM 2744 CG LEU B 74 -15.514 -0.015 -6.087 1.00 23.52 C ATOM 2745 CD1 LEU B 74 -16.026 0.844 -7.270 1.00 71.40 C ATOM 2746 CD2 LEU B 74 -16.598 -0.157 -4.988 1.00 54.52 C ATOM 0 H LEU B 74 -16.501 -3.049 -5.380 1.00 13.14 H new ATOM 0 HA LEU B 74 -16.670 -1.681 -7.913 1.00 72.24 H new ATOM 0 HB2 LEU B 74 -14.597 -1.952 -5.727 1.00 13.01 H new ATOM 0 HB3 LEU B 74 -14.163 -1.240 -7.269 1.00 13.01 H new ATOM 0 HG LEU B 74 -14.667 0.501 -5.636 1.00 23.52 H new ATOM 0 HD11 LEU B 74 -16.379 1.805 -6.896 1.00 71.40 H new ATOM 0 HD12 LEU B 74 -15.215 1.007 -7.979 1.00 71.40 H new ATOM 0 HD13 LEU B 74 -16.845 0.325 -7.769 1.00 71.40 H new ATOM 0 HD21 LEU B 74 -16.928 0.833 -4.673 1.00 54.52 H new ATOM 0 HD22 LEU B 74 -17.447 -0.714 -5.384 1.00 54.52 H new ATOM 0 HD23 LEU B 74 -16.182 -0.690 -4.133 1.00 54.52 H new ATOM 2758 N GLU B 75 -15.313 -3.017 -9.531 1.00 51.40 N ATOM 2759 CA GLU B 75 -14.853 -3.928 -10.602 1.00 35.53 C ATOM 2760 C GLU B 75 -13.311 -4.045 -10.658 1.00 52.05 C ATOM 2761 O GLU B 75 -12.776 -5.053 -11.143 1.00 20.24 O ATOM 2762 CB GLU B 75 -15.469 -3.474 -11.967 1.00 72.11 C ATOM 2763 CG GLU B 75 -15.283 -1.979 -12.341 1.00 52.25 C ATOM 2764 CD GLU B 75 -13.873 -1.613 -12.846 1.00 42.40 C ATOM 2765 OE1 GLU B 75 -13.481 -2.106 -13.921 1.00 21.02 O ATOM 2766 OE2 GLU B 75 -13.166 -0.815 -12.187 1.00 12.13 O ATOM 0 H GLU B 75 -15.605 -2.103 -9.876 1.00 51.40 H new ATOM 0 HA GLU B 75 -15.207 -4.934 -10.378 1.00 35.53 H new ATOM 0 HB2 GLU B 75 -15.032 -4.082 -12.759 1.00 72.11 H new ATOM 0 HB3 GLU B 75 -16.537 -3.692 -11.950 1.00 72.11 H new ATOM 0 HG2 GLU B 75 -16.009 -1.718 -13.111 1.00 52.25 H new ATOM 0 HG3 GLU B 75 -15.511 -1.369 -11.467 1.00 52.25 H new ATOM 2773 N ASP B 76 -12.624 -2.998 -10.175 1.00 72.10 N ATOM 2774 CA ASP B 76 -11.154 -2.974 -10.028 1.00 74.45 C ATOM 2775 C ASP B 76 -10.677 -4.113 -9.109 1.00 22.23 C ATOM 2776 O ASP B 76 -9.712 -4.822 -9.430 1.00 74.32 O ATOM 2777 CB ASP B 76 -10.686 -1.582 -9.507 1.00 23.45 C ATOM 2778 CG ASP B 76 -11.546 -1.033 -8.349 1.00 32.32 C ATOM 2779 OD1 ASP B 76 -12.563 -0.368 -8.623 1.00 63.53 O ATOM 2780 OD2 ASP B 76 -11.220 -1.260 -7.167 1.00 62.44 O ATOM 0 H ASP B 76 -13.074 -2.135 -9.872 1.00 72.10 H new ATOM 0 HA ASP B 76 -10.702 -3.135 -11.006 1.00 74.45 H new ATOM 0 HB2 ASP B 76 -9.651 -1.657 -9.175 1.00 23.45 H new ATOM 0 HB3 ASP B 76 -10.705 -0.870 -10.332 1.00 23.45 H new ATOM 2785 N VAL B 77 -11.383 -4.280 -7.981 1.00 72.44 N ATOM 2786 CA VAL B 77 -11.234 -5.439 -7.098 1.00 41.24 C ATOM 2787 C VAL B 77 -11.926 -6.654 -7.751 1.00 0.44 C ATOM 2788 O VAL B 77 -13.156 -6.718 -7.833 1.00 12.04 O ATOM 2789 CB VAL B 77 -11.821 -5.137 -5.660 1.00 11.22 C ATOM 2790 CG1 VAL B 77 -11.951 -6.410 -4.790 1.00 53.41 C ATOM 2791 CG2 VAL B 77 -10.953 -4.085 -4.932 1.00 10.20 C ATOM 0 H VAL B 77 -12.078 -3.608 -7.656 1.00 72.44 H new ATOM 0 HA VAL B 77 -10.176 -5.663 -6.963 1.00 41.24 H new ATOM 0 HB VAL B 77 -12.826 -4.742 -5.807 1.00 11.22 H new ATOM 0 HG11 VAL B 77 -12.359 -6.144 -3.815 1.00 53.41 H new ATOM 0 HG12 VAL B 77 -12.617 -7.119 -5.281 1.00 53.41 H new ATOM 0 HG13 VAL B 77 -10.969 -6.864 -4.661 1.00 53.41 H new ATOM 0 HG21 VAL B 77 -11.371 -3.889 -3.945 1.00 10.20 H new ATOM 0 HG22 VAL B 77 -9.936 -4.462 -4.827 1.00 10.20 H new ATOM 0 HG23 VAL B 77 -10.940 -3.161 -5.510 1.00 10.20 H new ATOM 2801 N VAL B 78 -11.099 -7.578 -8.268 1.00 51.10 N ATOM 2802 CA VAL B 78 -11.561 -8.836 -8.887 1.00 2.13 C ATOM 2803 C VAL B 78 -12.230 -9.721 -7.822 1.00 13.55 C ATOM 2804 O VAL B 78 -13.330 -10.244 -8.034 1.00 43.33 O ATOM 2805 CB VAL B 78 -10.358 -9.607 -9.563 1.00 21.34 C ATOM 2806 CG1 VAL B 78 -10.814 -10.904 -10.277 1.00 23.50 C ATOM 2807 CG2 VAL B 78 -9.576 -8.675 -10.523 1.00 21.10 C ATOM 0 H VAL B 78 -10.084 -7.474 -8.269 1.00 51.10 H new ATOM 0 HA VAL B 78 -12.287 -8.596 -9.664 1.00 2.13 H new ATOM 0 HB VAL B 78 -9.684 -9.915 -8.764 1.00 21.34 H new ATOM 0 HG11 VAL B 78 -9.950 -11.396 -10.725 1.00 23.50 H new ATOM 0 HG12 VAL B 78 -11.278 -11.574 -9.553 1.00 23.50 H new ATOM 0 HG13 VAL B 78 -11.535 -10.656 -11.056 1.00 23.50 H new ATOM 0 HG21 VAL B 78 -8.753 -9.227 -10.976 1.00 21.10 H new ATOM 0 HG22 VAL B 78 -10.245 -8.314 -11.304 1.00 21.10 H new ATOM 0 HG23 VAL B 78 -9.180 -7.827 -9.964 1.00 21.10 H new ATOM 2817 N LYS B 79 -11.535 -9.869 -6.676 1.00 72.45 N ATOM 2818 CA LYS B 79 -12.020 -10.596 -5.482 1.00 53.53 C ATOM 2819 C LYS B 79 -11.486 -9.912 -4.220 1.00 20.13 C ATOM 2820 O LYS B 79 -10.395 -9.344 -4.245 1.00 50.42 O ATOM 2821 CB LYS B 79 -11.551 -12.088 -5.469 1.00 3.20 C ATOM 2822 CG LYS B 79 -12.165 -12.970 -6.569 1.00 31.45 C ATOM 2823 CD LYS B 79 -11.682 -14.435 -6.517 1.00 10.15 C ATOM 2824 CE LYS B 79 -10.161 -14.564 -6.666 1.00 74.20 C ATOM 2825 NZ LYS B 79 -9.731 -15.986 -6.666 1.00 31.40 N ATOM 0 H LYS B 79 -10.601 -9.479 -6.551 1.00 72.45 H new ATOM 0 HA LYS B 79 -13.109 -10.578 -5.510 1.00 53.53 H new ATOM 0 HB2 LYS B 79 -10.466 -12.113 -5.567 1.00 3.20 H new ATOM 0 HB3 LYS B 79 -11.794 -12.521 -4.499 1.00 3.20 H new ATOM 0 HG2 LYS B 79 -13.251 -12.949 -6.478 1.00 31.45 H new ATOM 0 HG3 LYS B 79 -11.919 -12.548 -7.543 1.00 31.45 H new ATOM 0 HD2 LYS B 79 -11.989 -14.881 -5.571 1.00 10.15 H new ATOM 0 HD3 LYS B 79 -12.170 -15.002 -7.310 1.00 10.15 H new ATOM 0 HE2 LYS B 79 -9.844 -14.087 -7.593 1.00 74.20 H new ATOM 0 HE3 LYS B 79 -9.669 -14.034 -5.851 1.00 74.20 H new ATOM 0 HZ1 LYS B 79 -8.697 -16.036 -6.768 1.00 31.40 H new ATOM 0 HZ2 LYS B 79 -10.012 -16.434 -5.770 1.00 31.40 H new ATOM 0 HZ3 LYS B 79 -10.182 -16.485 -7.459 1.00 31.40 H new ATOM 2839 N VAL B 80 -12.259 -9.967 -3.129 1.00 61.32 N ATOM 2840 CA VAL B 80 -11.806 -9.539 -1.788 1.00 52.24 C ATOM 2841 C VAL B 80 -11.810 -10.776 -0.864 1.00 5.14 C ATOM 2842 O VAL B 80 -12.583 -11.716 -1.083 1.00 25.13 O ATOM 2843 CB VAL B 80 -12.706 -8.384 -1.194 1.00 1.05 C ATOM 2844 CG1 VAL B 80 -14.115 -8.882 -0.810 1.00 11.31 C ATOM 2845 CG2 VAL B 80 -12.009 -7.665 -0.003 1.00 42.31 C ATOM 0 H VAL B 80 -13.220 -10.309 -3.145 1.00 61.32 H new ATOM 0 HA VAL B 80 -10.800 -9.127 -1.865 1.00 52.24 H new ATOM 0 HB VAL B 80 -12.836 -7.648 -1.988 1.00 1.05 H new ATOM 0 HG11 VAL B 80 -14.696 -8.053 -0.407 1.00 11.31 H new ATOM 0 HG12 VAL B 80 -14.614 -9.279 -1.694 1.00 11.31 H new ATOM 0 HG13 VAL B 80 -14.031 -9.666 -0.058 1.00 11.31 H new ATOM 0 HG21 VAL B 80 -12.660 -6.878 0.378 1.00 42.31 H new ATOM 0 HG22 VAL B 80 -11.809 -8.385 0.790 1.00 42.31 H new ATOM 0 HG23 VAL B 80 -11.070 -7.228 -0.341 1.00 42.31 H new ATOM 2855 N GLN B 81 -10.924 -10.784 0.138 1.00 51.04 N ATOM 2856 CA GLN B 81 -10.772 -11.897 1.089 1.00 30.02 C ATOM 2857 C GLN B 81 -10.448 -11.342 2.478 1.00 5.40 C ATOM 2858 O GLN B 81 -9.682 -10.384 2.614 1.00 50.15 O ATOM 2859 CB GLN B 81 -9.623 -12.858 0.663 1.00 63.30 C ATOM 2860 CG GLN B 81 -9.863 -13.699 -0.606 1.00 14.53 C ATOM 2861 CD GLN B 81 -8.704 -14.650 -0.959 1.00 51.34 C ATOM 2862 OE1 GLN B 81 -8.481 -14.953 -2.125 1.00 53.24 O ATOM 2863 NE2 GLN B 81 -7.954 -15.127 0.033 1.00 54.33 N ATOM 0 H GLN B 81 -10.284 -10.010 0.316 1.00 51.04 H new ATOM 0 HA GLN B 81 -11.710 -12.453 1.102 1.00 30.02 H new ATOM 0 HB2 GLN B 81 -8.721 -12.265 0.513 1.00 63.30 H new ATOM 0 HB3 GLN B 81 -9.424 -13.539 1.491 1.00 63.30 H new ATOM 0 HG2 GLN B 81 -10.772 -14.285 -0.474 1.00 14.53 H new ATOM 0 HG3 GLN B 81 -10.036 -13.027 -1.447 1.00 14.53 H new ATOM 0 HE21 GLN B 81 -8.156 -14.863 0.997 1.00 54.33 H new ATOM 0 HE22 GLN B 81 -7.178 -15.756 -0.172 1.00 54.33 H new ATOM 2872 N ARG B 82 -11.042 -11.957 3.501 1.00 31.32 N ATOM 2873 CA ARG B 82 -10.696 -11.718 4.904 1.00 75.21 C ATOM 2874 C ARG B 82 -9.840 -12.895 5.390 1.00 22.10 C ATOM 2875 O ARG B 82 -10.356 -13.998 5.599 1.00 52.14 O ATOM 2876 CB ARG B 82 -11.982 -11.585 5.759 1.00 22.13 C ATOM 2877 CG ARG B 82 -12.930 -10.458 5.306 1.00 51.34 C ATOM 2878 CD ARG B 82 -14.214 -10.415 6.142 1.00 54.15 C ATOM 2879 NE ARG B 82 -13.945 -10.189 7.575 1.00 21.43 N ATOM 2880 CZ ARG B 82 -14.878 -10.134 8.542 1.00 12.31 C ATOM 2881 NH1 ARG B 82 -16.168 -10.288 8.262 1.00 65.42 N ATOM 2882 NH2 ARG B 82 -14.507 -9.935 9.794 1.00 34.10 N ATOM 0 H ARG B 82 -11.786 -12.644 3.378 1.00 31.32 H new ATOM 0 HA ARG B 82 -10.136 -10.788 5.003 1.00 75.21 H new ATOM 0 HB2 ARG B 82 -12.522 -12.531 5.732 1.00 22.13 H new ATOM 0 HB3 ARG B 82 -11.698 -11.410 6.797 1.00 22.13 H new ATOM 0 HG2 ARG B 82 -12.416 -9.500 5.382 1.00 51.34 H new ATOM 0 HG3 ARG B 82 -13.186 -10.600 4.256 1.00 51.34 H new ATOM 0 HD2 ARG B 82 -14.862 -9.622 5.767 1.00 54.15 H new ATOM 0 HD3 ARG B 82 -14.755 -11.353 6.020 1.00 54.15 H new ATOM 0 HE ARG B 82 -12.972 -10.064 7.855 1.00 21.43 H new ATOM 0 HH11 ARG B 82 -16.465 -10.451 7.300 1.00 65.42 H new ATOM 0 HH12 ARG B 82 -16.861 -10.243 9.009 1.00 65.42 H new ATOM 0 HH21 ARG B 82 -13.519 -9.824 10.022 1.00 34.10 H new ATOM 0 HH22 ARG B 82 -15.209 -9.892 10.533 1.00 34.10 H new ATOM 2896 N ASN B 83 -8.528 -12.665 5.515 1.00 22.14 N ATOM 2897 CA ASN B 83 -7.557 -13.683 5.961 1.00 63.10 C ATOM 2898 C ASN B 83 -7.180 -13.432 7.425 1.00 14.03 C ATOM 2899 O ASN B 83 -7.232 -12.291 7.912 1.00 0.22 O ATOM 2900 CB ASN B 83 -6.268 -13.675 5.086 1.00 0.03 C ATOM 2901 CG ASN B 83 -6.486 -14.017 3.608 1.00 22.21 C ATOM 2902 OD1 ASN B 83 -7.531 -13.733 3.027 1.00 61.43 O ATOM 2903 ND2 ASN B 83 -5.490 -14.632 2.991 1.00 61.32 N ATOM 0 H ASN B 83 -8.102 -11.761 5.309 1.00 22.14 H new ATOM 0 HA ASN B 83 -8.030 -14.660 5.857 1.00 63.10 H new ATOM 0 HB2 ASN B 83 -5.809 -12.689 5.151 1.00 0.03 H new ATOM 0 HB3 ASN B 83 -5.557 -14.386 5.507 1.00 0.03 H new ATOM 0 HD21 ASN B 83 -5.578 -14.883 2.006 1.00 61.32 H new ATOM 0 HD22 ASN B 83 -4.635 -14.855 3.500 1.00 61.32 H new ATOM 2910 N GLN B 84 -6.791 -14.514 8.110 1.00 52.14 N ATOM 2911 CA GLN B 84 -6.339 -14.467 9.507 1.00 52.34 C ATOM 2912 C GLN B 84 -4.838 -14.134 9.537 1.00 72.34 C ATOM 2913 O GLN B 84 -4.064 -14.620 8.692 1.00 23.53 O ATOM 2914 CB GLN B 84 -6.646 -15.823 10.211 1.00 43.13 C ATOM 2915 CG GLN B 84 -6.039 -17.072 9.522 1.00 10.13 C ATOM 2916 CD GLN B 84 -6.497 -18.419 10.111 1.00 30.20 C ATOM 2917 OE1 GLN B 84 -5.748 -19.393 10.114 1.00 23.14 O ATOM 2918 NE2 GLN B 84 -7.738 -18.501 10.574 1.00 50.44 N ATOM 0 H GLN B 84 -6.781 -15.452 7.709 1.00 52.14 H new ATOM 0 HA GLN B 84 -6.874 -13.689 10.051 1.00 52.34 H new ATOM 0 HB2 GLN B 84 -6.275 -15.775 11.235 1.00 43.13 H new ATOM 0 HB3 GLN B 84 -7.727 -15.948 10.269 1.00 43.13 H new ATOM 0 HG2 GLN B 84 -6.297 -17.047 8.463 1.00 10.13 H new ATOM 0 HG3 GLN B 84 -4.952 -17.014 9.587 1.00 10.13 H new ATOM 0 HE21 GLN B 84 -8.342 -17.679 10.562 1.00 50.44 H new ATOM 0 HE22 GLN B 84 -8.088 -19.386 10.942 1.00 50.44 H new ATOM 2927 N SER B 85 -4.444 -13.268 10.487 1.00 41.11 N ATOM 2928 CA SER B 85 -3.092 -12.694 10.527 1.00 35.44 C ATOM 2929 C SER B 85 -2.079 -13.653 11.152 1.00 0.04 C ATOM 2930 O SER B 85 -2.352 -14.279 12.181 1.00 35.45 O ATOM 2931 CB SER B 85 -3.107 -11.339 11.259 1.00 55.11 C ATOM 2932 OG SER B 85 -1.818 -10.741 11.268 1.00 74.05 O ATOM 0 H SER B 85 -5.051 -12.949 11.243 1.00 41.11 H new ATOM 0 HA SER B 85 -2.771 -12.528 9.499 1.00 35.44 H new ATOM 0 HB2 SER B 85 -3.817 -10.669 10.774 1.00 55.11 H new ATOM 0 HB3 SER B 85 -3.451 -11.481 12.283 1.00 55.11 H new ATOM 0 HG SER B 85 -1.904 -9.777 11.116 1.00 74.05 H new ATOM 2938 N ASP B 86 -0.912 -13.754 10.489 1.00 24.41 N ATOM 2939 CA ASP B 86 0.209 -14.591 10.917 1.00 73.30 C ATOM 2940 C ASP B 86 1.538 -13.937 10.439 1.00 62.45 C ATOM 2941 O ASP B 86 1.614 -13.503 9.280 1.00 24.32 O ATOM 2942 CB ASP B 86 0.049 -16.028 10.353 1.00 43.44 C ATOM 2943 CG ASP B 86 1.171 -16.969 10.801 1.00 63.01 C ATOM 2944 OD1 ASP B 86 1.045 -17.604 11.868 1.00 51.11 O ATOM 2945 OD2 ASP B 86 2.202 -17.039 10.110 1.00 44.53 O ATOM 0 H ASP B 86 -0.725 -13.244 9.626 1.00 24.41 H new ATOM 0 HA ASP B 86 0.226 -14.666 12.004 1.00 73.30 H new ATOM 0 HB2 ASP B 86 -0.910 -16.435 10.674 1.00 43.44 H new ATOM 0 HB3 ASP B 86 0.029 -15.986 9.264 1.00 43.44 H new ATOM 2950 N PRO B 87 2.594 -13.844 11.327 1.00 62.42 N ATOM 2951 CA PRO B 87 3.924 -13.264 10.971 1.00 21.15 C ATOM 2952 C PRO B 87 4.596 -13.912 9.738 1.00 52.35 C ATOM 2953 O PRO B 87 4.990 -13.203 8.796 1.00 73.35 O ATOM 2954 CB PRO B 87 4.767 -13.510 12.251 1.00 12.41 C ATOM 2955 CG PRO B 87 3.760 -13.554 13.355 1.00 35.15 C ATOM 2956 CD PRO B 87 2.551 -14.238 12.764 1.00 4.43 C ATOM 0 HA PRO B 87 3.829 -12.217 10.683 1.00 21.15 H new ATOM 0 HB2 PRO B 87 5.326 -14.443 12.185 1.00 12.41 H new ATOM 0 HB3 PRO B 87 5.494 -12.713 12.408 1.00 12.41 H new ATOM 0 HG2 PRO B 87 4.142 -14.104 14.215 1.00 35.15 H new ATOM 0 HG3 PRO B 87 3.514 -12.551 13.703 1.00 35.15 H new ATOM 0 HD2 PRO B 87 2.603 -15.320 12.885 1.00 4.43 H new ATOM 0 HD3 PRO B 87 1.629 -13.908 13.243 1.00 4.43 H new ATOM 2964 N THR B 88 4.700 -15.258 9.737 1.00 14.13 N ATOM 2965 CA THR B 88 5.435 -15.988 8.682 1.00 71.04 C ATOM 2966 C THR B 88 4.647 -16.014 7.369 1.00 30.24 C ATOM 2967 O THR B 88 5.253 -16.085 6.307 1.00 45.15 O ATOM 2968 CB THR B 88 5.831 -17.444 9.110 1.00 44.32 C ATOM 2969 OG1 THR B 88 4.674 -18.207 9.466 1.00 74.45 O ATOM 2970 CG2 THR B 88 6.819 -17.448 10.287 1.00 74.44 C ATOM 0 H THR B 88 4.287 -15.858 10.451 1.00 14.13 H new ATOM 0 HA THR B 88 6.362 -15.437 8.524 1.00 71.04 H new ATOM 0 HB THR B 88 6.317 -17.900 8.248 1.00 44.32 H new ATOM 0 HG1 THR B 88 3.918 -17.602 9.621 1.00 74.45 H new ATOM 0 HG21 THR B 88 7.066 -18.476 10.551 1.00 74.44 H new ATOM 0 HG22 THR B 88 7.728 -16.918 10.001 1.00 74.44 H new ATOM 0 HG23 THR B 88 6.365 -16.953 11.145 1.00 74.44 H new ATOM 2978 N MET B 89 3.299 -15.916 7.455 1.00 42.14 N ATOM 2979 CA MET B 89 2.411 -15.834 6.268 1.00 74.01 C ATOM 2980 C MET B 89 2.803 -14.640 5.384 1.00 51.23 C ATOM 2981 O MET B 89 2.852 -14.759 4.153 1.00 45.30 O ATOM 2982 CB MET B 89 0.923 -15.713 6.705 1.00 20.54 C ATOM 2983 CG MET B 89 -0.089 -15.633 5.546 1.00 22.12 C ATOM 2984 SD MET B 89 -0.023 -17.077 4.454 1.00 15.11 S ATOM 2985 CE MET B 89 -1.292 -16.686 3.241 1.00 44.21 C ATOM 0 H MET B 89 2.798 -15.892 8.343 1.00 42.14 H new ATOM 0 HA MET B 89 2.529 -16.750 5.689 1.00 74.01 H new ATOM 0 HB2 MET B 89 0.672 -16.571 7.329 1.00 20.54 H new ATOM 0 HB3 MET B 89 0.813 -14.824 7.326 1.00 20.54 H new ATOM 0 HG2 MET B 89 -1.095 -15.538 5.954 1.00 22.12 H new ATOM 0 HG3 MET B 89 0.105 -14.733 4.962 1.00 22.12 H new ATOM 0 HE1 MET B 89 -1.357 -17.492 2.510 1.00 44.21 H new ATOM 0 HE2 MET B 89 -2.253 -16.574 3.743 1.00 44.21 H new ATOM 0 HE3 MET B 89 -1.037 -15.755 2.734 1.00 44.21 H new ATOM 2995 N PHE B 90 3.123 -13.512 6.048 1.00 24.22 N ATOM 2996 CA PHE B 90 3.547 -12.263 5.388 1.00 23.12 C ATOM 2997 C PHE B 90 4.858 -12.482 4.590 1.00 61.34 C ATOM 2998 O PHE B 90 5.017 -11.948 3.487 1.00 35.11 O ATOM 2999 CB PHE B 90 3.715 -11.137 6.449 1.00 32.40 C ATOM 3000 CG PHE B 90 3.948 -9.727 5.873 1.00 72.31 C ATOM 3001 CD1 PHE B 90 5.232 -9.288 5.538 1.00 3.13 C ATOM 3002 CD2 PHE B 90 2.883 -8.843 5.686 1.00 2.53 C ATOM 3003 CE1 PHE B 90 5.443 -8.021 5.027 1.00 24.12 C ATOM 3004 CE2 PHE B 90 3.095 -7.575 5.174 1.00 41.14 C ATOM 3005 CZ PHE B 90 4.375 -7.162 4.851 1.00 30.41 C ATOM 0 H PHE B 90 3.094 -13.442 7.065 1.00 24.22 H new ATOM 0 HA PHE B 90 2.778 -11.958 4.679 1.00 23.12 H new ATOM 0 HB2 PHE B 90 2.824 -11.114 7.076 1.00 32.40 H new ATOM 0 HB3 PHE B 90 4.554 -11.391 7.097 1.00 32.40 H new ATOM 0 HD1 PHE B 90 6.073 -9.950 5.681 1.00 3.13 H new ATOM 0 HD2 PHE B 90 1.881 -9.153 5.944 1.00 2.53 H new ATOM 0 HE1 PHE B 90 6.441 -7.703 4.766 1.00 24.12 H new ATOM 0 HE2 PHE B 90 2.260 -6.907 5.026 1.00 41.14 H new ATOM 0 HZ PHE B 90 4.540 -6.168 4.461 1.00 30.41 H new ATOM 3015 N ASN B 91 5.776 -13.279 5.166 1.00 0.21 N ATOM 3016 CA ASN B 91 7.073 -13.612 4.534 1.00 41.13 C ATOM 3017 C ASN B 91 6.870 -14.561 3.328 1.00 30.10 C ATOM 3018 O ASN B 91 7.532 -14.406 2.294 1.00 31.43 O ATOM 3019 CB ASN B 91 8.029 -14.254 5.580 1.00 11.52 C ATOM 3020 CG ASN B 91 9.415 -14.613 5.013 1.00 61.35 C ATOM 3021 OD1 ASN B 91 9.632 -15.724 4.526 1.00 21.33 O ATOM 3022 ND2 ASN B 91 10.357 -13.676 5.067 1.00 54.10 N ATOM 0 H ASN B 91 5.644 -13.711 6.080 1.00 0.21 H new ATOM 0 HA ASN B 91 7.525 -12.691 4.166 1.00 41.13 H new ATOM 0 HB2 ASN B 91 8.155 -13.565 6.415 1.00 11.52 H new ATOM 0 HB3 ASN B 91 7.564 -15.156 5.978 1.00 11.52 H new ATOM 0 HD21 ASN B 91 11.289 -13.868 4.699 1.00 54.10 H new ATOM 0 HD22 ASN B 91 10.148 -12.765 5.476 1.00 54.10 H new ATOM 3029 N LYS B 92 5.943 -15.533 3.483 1.00 64.25 N ATOM 3030 CA LYS B 92 5.639 -16.554 2.455 1.00 10.10 C ATOM 3031 C LYS B 92 5.154 -15.910 1.151 1.00 64.41 C ATOM 3032 O LYS B 92 5.724 -16.144 0.090 1.00 44.42 O ATOM 3033 CB LYS B 92 4.576 -17.559 2.970 1.00 52.22 C ATOM 3034 CG LYS B 92 5.029 -18.402 4.175 1.00 14.42 C ATOM 3035 CD LYS B 92 3.906 -19.305 4.724 1.00 0.05 C ATOM 3036 CE LYS B 92 4.294 -20.001 6.039 1.00 11.45 C ATOM 3037 NZ LYS B 92 3.192 -20.865 6.533 1.00 43.23 N ATOM 0 H LYS B 92 5.382 -15.632 4.329 1.00 64.25 H new ATOM 0 HA LYS B 92 6.565 -17.091 2.250 1.00 10.10 H new ATOM 0 HB2 LYS B 92 3.676 -17.008 3.245 1.00 52.22 H new ATOM 0 HB3 LYS B 92 4.303 -18.229 2.155 1.00 52.22 H new ATOM 0 HG2 LYS B 92 5.877 -19.021 3.882 1.00 14.42 H new ATOM 0 HG3 LYS B 92 5.377 -17.739 4.967 1.00 14.42 H new ATOM 0 HD2 LYS B 92 3.010 -18.706 4.885 1.00 0.05 H new ATOM 0 HD3 LYS B 92 3.655 -20.060 3.979 1.00 0.05 H new ATOM 0 HE2 LYS B 92 5.190 -20.602 5.885 1.00 11.45 H new ATOM 0 HE3 LYS B 92 4.538 -19.252 6.792 1.00 11.45 H new ATOM 0 HZ1 LYS B 92 3.481 -21.322 7.421 1.00 43.23 H new ATOM 0 HZ2 LYS B 92 2.345 -20.285 6.701 1.00 43.23 H new ATOM 0 HZ3 LYS B 92 2.977 -21.594 5.823 1.00 43.23 H new ATOM 3051 N ILE B 93 4.114 -15.077 1.262 1.00 15.20 N ATOM 3052 CA ILE B 93 3.483 -14.398 0.115 1.00 40.12 C ATOM 3053 C ILE B 93 4.442 -13.367 -0.521 1.00 20.23 C ATOM 3054 O ILE B 93 4.375 -13.121 -1.728 1.00 0.40 O ATOM 3055 CB ILE B 93 2.129 -13.727 0.562 1.00 34.24 C ATOM 3056 CG1 ILE B 93 2.396 -12.718 1.724 1.00 44.15 C ATOM 3057 CG2 ILE B 93 1.084 -14.802 0.959 1.00 54.11 C ATOM 3058 CD1 ILE B 93 1.189 -12.250 2.527 1.00 64.20 C ATOM 0 H ILE B 93 3.679 -14.850 2.156 1.00 15.20 H new ATOM 0 HA ILE B 93 3.260 -15.142 -0.649 1.00 40.12 H new ATOM 0 HB ILE B 93 1.711 -13.172 -0.278 1.00 34.24 H new ATOM 0 HG12 ILE B 93 3.104 -13.176 2.414 1.00 44.15 H new ATOM 0 HG13 ILE B 93 2.884 -11.839 1.303 1.00 44.15 H new ATOM 0 HG21 ILE B 93 0.158 -14.314 1.264 1.00 54.11 H new ATOM 0 HG22 ILE B 93 0.888 -15.452 0.106 1.00 54.11 H new ATOM 0 HG23 ILE B 93 1.470 -15.397 1.787 1.00 54.11 H new ATOM 0 HD11 ILE B 93 1.514 -11.554 3.300 1.00 64.20 H new ATOM 0 HD12 ILE B 93 0.482 -11.751 1.864 1.00 64.20 H new ATOM 0 HD13 ILE B 93 0.706 -13.109 2.992 1.00 64.20 H new ATOM 3070 N ALA B 94 5.344 -12.800 0.308 1.00 24.01 N ATOM 3071 CA ALA B 94 6.373 -11.842 -0.137 1.00 53.14 C ATOM 3072 C ALA B 94 7.415 -12.518 -1.055 1.00 25.21 C ATOM 3073 O ALA B 94 7.772 -11.978 -2.112 1.00 5.45 O ATOM 3074 CB ALA B 94 7.060 -11.195 1.077 1.00 63.44 C ATOM 0 H ALA B 94 5.377 -12.996 1.308 1.00 24.01 H new ATOM 0 HA ALA B 94 5.878 -11.063 -0.717 1.00 53.14 H new ATOM 0 HB1 ALA B 94 7.817 -10.490 0.734 1.00 63.44 H new ATOM 0 HB2 ALA B 94 6.318 -10.667 1.676 1.00 63.44 H new ATOM 0 HB3 ALA B 94 7.532 -11.968 1.683 1.00 63.44 H new ATOM 3080 N VAL B 95 7.887 -13.709 -0.646 1.00 41.41 N ATOM 3081 CA VAL B 95 8.973 -14.428 -1.351 1.00 14.34 C ATOM 3082 C VAL B 95 8.418 -15.310 -2.493 1.00 31.35 C ATOM 3083 O VAL B 95 9.122 -15.581 -3.471 1.00 5.14 O ATOM 3084 CB VAL B 95 9.841 -15.292 -0.347 1.00 50.21 C ATOM 3085 CG1 VAL B 95 9.048 -16.481 0.240 1.00 42.35 C ATOM 3086 CG2 VAL B 95 11.170 -15.754 -1.003 1.00 12.14 C ATOM 0 H VAL B 95 7.533 -14.200 0.175 1.00 41.41 H new ATOM 0 HA VAL B 95 9.623 -13.674 -1.795 1.00 14.34 H new ATOM 0 HB VAL B 95 10.096 -14.645 0.492 1.00 50.21 H new ATOM 0 HG11 VAL B 95 9.686 -17.043 0.922 1.00 42.35 H new ATOM 0 HG12 VAL B 95 8.179 -16.107 0.781 1.00 42.35 H new ATOM 0 HG13 VAL B 95 8.719 -17.133 -0.569 1.00 42.35 H new ATOM 0 HG21 VAL B 95 11.743 -16.345 -0.288 1.00 12.14 H new ATOM 0 HG22 VAL B 95 10.950 -16.361 -1.882 1.00 12.14 H new ATOM 0 HG23 VAL B 95 11.751 -14.881 -1.301 1.00 12.14 H new ATOM 3096 N PHE B 96 7.150 -15.739 -2.374 1.00 31.13 N ATOM 3097 CA PHE B 96 6.507 -16.627 -3.365 1.00 13.24 C ATOM 3098 C PHE B 96 5.922 -15.797 -4.523 1.00 54.41 C ATOM 3099 O PHE B 96 5.991 -16.215 -5.676 1.00 11.33 O ATOM 3100 CB PHE B 96 5.404 -17.479 -2.686 1.00 2.23 C ATOM 3101 CG PHE B 96 4.943 -18.691 -3.501 1.00 70.01 C ATOM 3102 CD1 PHE B 96 5.647 -19.895 -3.441 1.00 11.41 C ATOM 3103 CD2 PHE B 96 3.824 -18.632 -4.324 1.00 53.33 C ATOM 3104 CE1 PHE B 96 5.246 -20.995 -4.173 1.00 54.50 C ATOM 3105 CE2 PHE B 96 3.424 -19.730 -5.057 1.00 50.30 C ATOM 3106 CZ PHE B 96 4.133 -20.912 -4.984 1.00 10.25 C ATOM 0 H PHE B 96 6.543 -15.484 -1.595 1.00 31.13 H new ATOM 0 HA PHE B 96 7.258 -17.303 -3.773 1.00 13.24 H new ATOM 0 HB2 PHE B 96 5.774 -17.826 -1.721 1.00 2.23 H new ATOM 0 HB3 PHE B 96 4.542 -16.842 -2.487 1.00 2.23 H new ATOM 0 HD1 PHE B 96 6.521 -19.967 -2.811 1.00 11.41 H new ATOM 0 HD2 PHE B 96 3.260 -17.713 -4.390 1.00 53.33 H new ATOM 0 HE1 PHE B 96 5.803 -21.918 -4.111 1.00 54.50 H new ATOM 0 HE2 PHE B 96 2.552 -19.664 -5.691 1.00 50.30 H new ATOM 0 HZ PHE B 96 3.817 -21.769 -5.560 1.00 10.25 H new ATOM 3116 N PHE B 97 5.327 -14.632 -4.169 1.00 3.22 N ATOM 3117 CA PHE B 97 4.787 -13.603 -5.109 1.00 14.41 C ATOM 3118 C PHE B 97 3.880 -14.160 -6.255 1.00 24.41 C ATOM 3119 O PHE B 97 3.781 -13.556 -7.334 1.00 11.12 O ATOM 3120 CB PHE B 97 5.920 -12.645 -5.645 1.00 52.23 C ATOM 3121 CG PHE B 97 7.069 -13.289 -6.454 1.00 63.24 C ATOM 3122 CD1 PHE B 97 6.915 -13.613 -7.808 1.00 21.23 C ATOM 3123 CD2 PHE B 97 8.304 -13.555 -5.860 1.00 2.42 C ATOM 3124 CE1 PHE B 97 7.949 -14.183 -8.530 1.00 34.31 C ATOM 3125 CE2 PHE B 97 9.339 -14.126 -6.584 1.00 53.23 C ATOM 3126 CZ PHE B 97 9.161 -14.438 -7.919 1.00 31.01 C ATOM 0 H PHE B 97 5.203 -14.368 -3.192 1.00 3.22 H new ATOM 0 HA PHE B 97 4.105 -13.006 -4.503 1.00 14.41 H new ATOM 0 HB2 PHE B 97 5.451 -11.885 -6.271 1.00 52.23 H new ATOM 0 HB3 PHE B 97 6.357 -12.129 -4.790 1.00 52.23 H new ATOM 0 HD1 PHE B 97 5.973 -13.415 -8.297 1.00 21.23 H new ATOM 0 HD2 PHE B 97 8.456 -13.312 -4.819 1.00 2.42 H new ATOM 0 HE1 PHE B 97 7.808 -14.429 -9.572 1.00 34.31 H new ATOM 0 HE2 PHE B 97 10.286 -14.327 -6.105 1.00 53.23 H new ATOM 0 HZ PHE B 97 9.969 -14.881 -8.483 1.00 31.01 H new ATOM 3136 N GLN B 98 3.169 -15.269 -5.981 1.00 72.23 N ATOM 3137 CA GLN B 98 2.235 -15.895 -6.937 1.00 62.11 C ATOM 3138 C GLN B 98 1.032 -16.474 -6.142 1.00 23.35 C ATOM 3139 O GLN B 98 0.103 -15.701 -5.832 1.00 33.53 O ATOM 3140 CB GLN B 98 2.992 -16.959 -7.806 1.00 11.12 C ATOM 3141 CG GLN B 98 2.128 -17.731 -8.834 1.00 51.33 C ATOM 3142 CD GLN B 98 1.384 -16.852 -9.852 1.00 13.23 C ATOM 3143 OE1 GLN B 98 1.840 -15.773 -10.233 1.00 34.45 O ATOM 3144 NE2 GLN B 98 0.224 -17.314 -10.300 1.00 51.33 N ATOM 3145 OXT GLN B 98 1.013 -17.675 -5.797 1.00 38.34 O ATOM 0 H GLN B 98 3.226 -15.758 -5.088 1.00 72.23 H new ATOM 0 HA GLN B 98 1.838 -15.165 -7.642 1.00 62.11 H new ATOM 0 HB2 GLN B 98 3.797 -16.456 -8.342 1.00 11.12 H new ATOM 0 HB3 GLN B 98 3.458 -17.682 -7.136 1.00 11.12 H new ATOM 0 HG2 GLN B 98 2.770 -18.424 -9.377 1.00 51.33 H new ATOM 0 HG3 GLN B 98 1.397 -18.331 -8.293 1.00 51.33 H new ATOM 0 HE21 GLN B 98 -0.130 -18.211 -9.968 1.00 51.33 H new ATOM 0 HE22 GLN B 98 -0.314 -16.772 -10.977 1.00 51.33 H new TER 3154 GLN B 98