USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1088 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 120 SER OG : rot 180:sc= 0.872 USER MOD Set 1.2: B 123 THR OG1 : rot 89:sc= 1.01 USER MOD Set 2.1: B 97 ASN : amide:sc= 0.775 K(o=1.7,f=-0.85) USER MOD Set 2.2: B 104 TYR OH : rot -10:sc= 0.928 USER MOD Set 3.1: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 57 THR OG1 : rot -170:sc= 0.00393 USER MOD Set 4.1: A 17 SER OG : rot -87:sc= 1.37 USER MOD Set 4.2: B 133 LYS NZ :NH3+ -162:sc= 1.01 (180deg=1.05) USER MOD Set 5.1: A 9 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -102:sc= 0.0625 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= 0.117 K(o=0.12,f=-5.8!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 171:sc= 1.31 USER MOD Single : A 13 MET CE :methyl -176:sc= -0.0601 (180deg=-0.0801) USER MOD Single : A 14 THR OG1 : rot -39:sc= 0.722 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 21 THR OG1 : rot 73:sc= 0.338 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= -0.093 K(o=-0.093,f=-4.1!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= -0.0595 USER MOD Single : A 42 LYS NZ :NH3+ -153:sc= 1.12 (180deg=0.902) USER MOD Single : A 43 ASN : amide:sc= 0.532 K(o=0.53,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -1.6! C(o=-1.6!,f=-4.9!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -0.129 K(o=-0.13,f=-0.93) USER MOD Single : A 65 MET CE :methyl 173:sc=-0.00754 (180deg=-0.0968) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 MET CE :methyl 171:sc= 0 (180deg=-0.11) USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 HIS : no HD1:sc= -0.349 X(o=-0.35,f=-0.021) USER MOD Single : B 80 SER OG : rot 24:sc=0.000871 USER MOD Single : B 83 MET CE :methyl -173:sc= 0 (180deg=-0.0975) USER MOD Single : B 84 THR OG1 : rot -72:sc= 1.36 USER MOD Single : B 88 CYS SG : rot 66:sc= -0.269 USER MOD Single : B 93 SER OG : rot 64:sc= 1.27 USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 LYS NZ :NH3+ 156:sc= 0.841 (180deg=0.465) USER MOD Single : B 110 ASN : amide:sc= 0.926 K(o=0.93,f=0) USER MOD Single : B 111 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.11) USER MOD Single : B 112 LYS NZ :NH3+ -171:sc= 1.12 (180deg=1.05) USER MOD Single : B 114 CYS SG : rot 180:sc= -0.291 USER MOD Single : B 117 SER OG : rot 170:sc= 0.521 USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 127 THR OG1 : rot -140:sc= 0 USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 THR OG1 : rot -69:sc= 1.23 USER MOD Single : B 134 THR OG1 : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.224 -10.011 30.378 1.00 0.00 N ATOM 2 CA MET A 1 -9.504 -9.154 29.414 1.00 0.00 C ATOM 3 C MET A 1 -8.126 -9.733 29.113 1.00 0.00 C ATOM 4 O MET A 1 -7.552 -10.447 29.933 1.00 0.00 O ATOM 5 CB MET A 1 -9.438 -7.693 29.898 1.00 0.00 C ATOM 6 CG MET A 1 -8.861 -6.717 28.861 1.00 0.00 C ATOM 7 SD MET A 1 -9.579 -6.808 27.197 1.00 0.00 S ATOM 8 CE MET A 1 -11.258 -6.224 27.539 1.00 0.00 C ATOM 0 H1 MET A 1 -10.924 -10.591 29.872 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.546 -10.632 30.864 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.710 -9.414 31.077 1.00 0.00 H new ATOM 0 HA MET A 1 -10.063 -9.140 28.478 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.441 -7.366 30.171 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.831 -7.648 30.802 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.990 -5.702 29.236 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.788 -6.894 28.782 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.837 -6.219 26.615 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.734 -6.887 28.261 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.216 -5.214 27.946 1.00 0.00 H new ATOM 20 N GLY A 2 -7.596 -9.444 27.923 1.00 0.00 N ATOM 21 CA GLY A 2 -6.281 -9.896 27.475 1.00 0.00 C ATOM 22 C GLY A 2 -6.022 -9.580 26.006 1.00 0.00 C ATOM 23 O GLY A 2 -6.699 -8.732 25.423 1.00 0.00 O ATOM 0 H GLY A 2 -8.082 -8.876 27.229 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -5.511 -9.424 28.086 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -6.198 -10.971 27.632 1.00 0.00 H new ATOM 27 N VAL A 3 -5.049 -10.272 25.416 1.00 0.00 N ATOM 28 CA VAL A 3 -4.794 -10.250 23.959 1.00 0.00 C ATOM 29 C VAL A 3 -5.931 -10.912 23.157 1.00 0.00 C ATOM 30 O VAL A 3 -6.703 -11.714 23.686 1.00 0.00 O ATOM 31 CB VAL A 3 -3.430 -10.888 23.584 1.00 0.00 C ATOM 32 CG1 VAL A 3 -2.279 -10.059 24.173 1.00 0.00 C ATOM 33 CG2 VAL A 3 -3.304 -12.360 24.018 1.00 0.00 C ATOM 0 H VAL A 3 -4.405 -10.872 25.932 1.00 0.00 H new ATOM 0 HA VAL A 3 -4.755 -9.196 23.685 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.373 -10.882 22.496 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -1.327 -10.516 23.904 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -2.320 -9.045 23.775 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -2.372 -10.027 25.259 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -2.327 -12.743 23.725 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -3.412 -12.431 25.100 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.084 -12.949 23.536 1.00 0.00 H new ATOM 43 N ASN A 4 -6.009 -10.591 21.864 1.00 0.00 N ATOM 44 CA ASN A 4 -6.835 -11.274 20.861 1.00 0.00 C ATOM 45 C ASN A 4 -6.110 -11.217 19.500 1.00 0.00 C ATOM 46 O ASN A 4 -5.283 -10.337 19.266 1.00 0.00 O ATOM 47 CB ASN A 4 -8.233 -10.622 20.826 1.00 0.00 C ATOM 48 CG ASN A 4 -9.323 -11.483 20.185 1.00 0.00 C ATOM 49 OD1 ASN A 4 -9.093 -12.353 19.352 1.00 0.00 O ATOM 50 ND2 ASN A 4 -10.565 -11.284 20.574 1.00 0.00 N ATOM 0 H ASN A 4 -5.477 -9.816 21.469 1.00 0.00 H new ATOM 0 HA ASN A 4 -6.979 -12.325 21.113 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -8.532 -10.381 21.846 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.166 -9.680 20.282 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -11.319 -11.850 20.183 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -10.774 -10.564 21.266 1.00 0.00 H new ATOM 57 N SER A 5 -6.359 -12.146 18.582 1.00 0.00 N ATOM 58 CA SER A 5 -5.576 -12.261 17.344 1.00 0.00 C ATOM 59 C SER A 5 -6.362 -12.861 16.170 1.00 0.00 C ATOM 60 O SER A 5 -7.427 -13.452 16.364 1.00 0.00 O ATOM 61 CB SER A 5 -4.252 -12.999 17.621 1.00 0.00 C ATOM 62 OG SER A 5 -4.413 -14.270 18.228 1.00 0.00 O ATOM 0 H SER A 5 -7.103 -12.839 18.669 1.00 0.00 H new ATOM 0 HA SER A 5 -5.339 -11.249 17.015 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.714 -13.123 16.681 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.630 -12.377 18.265 1.00 0.00 H new ATOM 0 HG SER A 5 -3.533 -14.678 18.371 1.00 0.00 H new ATOM 68 N VAL A 6 -5.885 -12.650 14.939 1.00 0.00 N ATOM 69 CA VAL A 6 -6.605 -13.024 13.702 1.00 0.00 C ATOM 70 C VAL A 6 -5.650 -13.215 12.519 1.00 0.00 C ATOM 71 O VAL A 6 -4.607 -12.559 12.449 1.00 0.00 O ATOM 72 CB VAL A 6 -7.729 -11.993 13.389 1.00 0.00 C ATOM 73 CG1 VAL A 6 -7.188 -10.594 13.043 1.00 0.00 C ATOM 74 CG2 VAL A 6 -8.681 -12.457 12.274 1.00 0.00 C ATOM 0 H VAL A 6 -4.981 -12.211 14.764 1.00 0.00 H new ATOM 0 HA VAL A 6 -7.080 -13.991 13.869 1.00 0.00 H new ATOM 0 HB VAL A 6 -8.293 -11.925 14.319 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -8.021 -9.923 12.835 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -6.612 -10.208 13.884 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -6.547 -10.659 12.164 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.441 -11.695 12.104 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.116 -12.617 11.356 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -9.162 -13.389 12.571 1.00 0.00 H new ATOM 84 N THR A 7 -6.025 -14.110 11.595 1.00 0.00 N ATOM 85 CA THR A 7 -5.354 -14.356 10.308 1.00 0.00 C ATOM 86 C THR A 7 -6.162 -13.743 9.171 1.00 0.00 C ATOM 87 O THR A 7 -7.379 -13.899 9.088 1.00 0.00 O ATOM 88 CB THR A 7 -5.179 -15.853 10.035 1.00 0.00 C ATOM 89 OG1 THR A 7 -4.609 -16.504 11.142 1.00 0.00 O ATOM 90 CG2 THR A 7 -4.250 -16.110 8.846 1.00 0.00 C ATOM 0 H THR A 7 -6.840 -14.709 11.728 1.00 0.00 H new ATOM 0 HA THR A 7 -4.368 -13.895 10.365 1.00 0.00 H new ATOM 0 HB THR A 7 -6.177 -16.237 9.825 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.647 -17.474 11.007 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.153 -17.184 8.686 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.667 -15.646 7.952 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.268 -15.683 9.052 1.00 0.00 H new ATOM 98 N ILE A 8 -5.479 -13.082 8.243 1.00 0.00 N ATOM 99 CA ILE A 8 -6.055 -12.450 7.054 1.00 0.00 C ATOM 100 C ILE A 8 -5.300 -12.952 5.814 1.00 0.00 C ATOM 101 O ILE A 8 -4.105 -12.707 5.645 1.00 0.00 O ATOM 102 CB ILE A 8 -6.022 -10.904 7.202 1.00 0.00 C ATOM 103 CG1 ILE A 8 -6.680 -10.455 8.535 1.00 0.00 C ATOM 104 CG2 ILE A 8 -6.706 -10.240 5.992 1.00 0.00 C ATOM 105 CD1 ILE A 8 -6.882 -8.941 8.723 1.00 0.00 C ATOM 0 H ILE A 8 -4.467 -12.965 8.298 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.104 -12.724 6.938 1.00 0.00 H new ATOM 0 HB ILE A 8 -4.981 -10.582 7.228 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.652 -10.942 8.617 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.068 -10.823 9.359 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.677 -9.156 6.107 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.183 -10.522 5.078 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.743 -10.571 5.933 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.349 -8.754 9.690 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -5.916 -8.437 8.683 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.524 -8.558 7.930 1.00 0.00 H new ATOM 117 N SER A 9 -5.989 -13.636 4.906 1.00 0.00 N ATOM 118 CA SER A 9 -5.476 -13.895 3.558 1.00 0.00 C ATOM 119 C SER A 9 -5.413 -12.564 2.802 1.00 0.00 C ATOM 120 O SER A 9 -6.422 -12.102 2.267 1.00 0.00 O ATOM 121 CB SER A 9 -6.367 -14.884 2.799 1.00 0.00 C ATOM 122 OG SER A 9 -6.253 -16.200 3.306 1.00 0.00 O ATOM 0 H SER A 9 -6.915 -14.026 5.079 1.00 0.00 H new ATOM 0 HA SER A 9 -4.484 -14.341 3.635 1.00 0.00 H new ATOM 0 HB2 SER A 9 -7.406 -14.560 2.864 1.00 0.00 H new ATOM 0 HB3 SER A 9 -6.097 -14.878 1.743 1.00 0.00 H new ATOM 0 HG SER A 9 -6.838 -16.799 2.796 1.00 0.00 H new ATOM 128 N VAL A 10 -4.243 -11.923 2.804 1.00 0.00 N ATOM 129 CA VAL A 10 -3.942 -10.677 2.087 1.00 0.00 C ATOM 130 C VAL A 10 -3.625 -10.983 0.607 1.00 0.00 C ATOM 131 O VAL A 10 -2.509 -10.850 0.116 1.00 0.00 O ATOM 132 CB VAL A 10 -2.891 -9.832 2.844 1.00 0.00 C ATOM 133 CG1 VAL A 10 -1.534 -10.529 3.010 1.00 0.00 C ATOM 134 CG2 VAL A 10 -2.763 -8.420 2.248 1.00 0.00 C ATOM 0 H VAL A 10 -3.441 -12.272 3.329 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.820 -10.031 2.062 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.271 -9.723 3.860 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.852 -9.873 3.550 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.667 -11.455 3.570 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.119 -10.755 2.028 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.016 -7.856 2.806 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.459 -8.492 1.204 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.724 -7.910 2.311 1.00 0.00 H new ATOM 144 N GLU A 11 -4.647 -11.472 -0.091 1.00 0.00 N ATOM 145 CA GLU A 11 -4.602 -12.037 -1.453 1.00 0.00 C ATOM 146 C GLU A 11 -4.032 -11.101 -2.548 1.00 0.00 C ATOM 147 O GLU A 11 -3.633 -11.583 -3.611 1.00 0.00 O ATOM 148 CB GLU A 11 -6.021 -12.521 -1.829 1.00 0.00 C ATOM 149 CG GLU A 11 -6.050 -13.936 -2.425 1.00 0.00 C ATOM 150 CD GLU A 11 -5.478 -14.023 -3.836 1.00 0.00 C ATOM 151 OE1 GLU A 11 -6.100 -13.489 -4.782 1.00 0.00 O ATOM 152 OE2 GLU A 11 -4.428 -14.677 -4.041 1.00 0.00 O ATOM 0 H GLU A 11 -5.591 -11.489 0.296 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.891 -12.862 -1.420 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.651 -12.497 -0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.455 -11.825 -2.546 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.488 -14.606 -1.774 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.080 -14.293 -2.438 1.00 0.00 H new ATOM 159 N GLY A 12 -3.951 -9.786 -2.310 1.00 0.00 N ATOM 160 CA GLY A 12 -3.334 -8.818 -3.240 1.00 0.00 C ATOM 161 C GLY A 12 -1.844 -8.538 -2.993 1.00 0.00 C ATOM 162 O GLY A 12 -1.254 -7.738 -3.717 1.00 0.00 O ATOM 0 H GLY A 12 -4.314 -9.355 -1.460 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.455 -9.188 -4.258 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.880 -7.877 -3.176 1.00 0.00 H new ATOM 166 N MET A 13 -1.240 -9.154 -1.973 1.00 0.00 N ATOM 167 CA MET A 13 0.149 -8.946 -1.535 1.00 0.00 C ATOM 168 C MET A 13 0.953 -10.249 -1.656 1.00 0.00 C ATOM 169 O MET A 13 0.457 -11.316 -1.287 1.00 0.00 O ATOM 170 CB MET A 13 0.127 -8.470 -0.076 1.00 0.00 C ATOM 171 CG MET A 13 1.492 -8.011 0.448 1.00 0.00 C ATOM 172 SD MET A 13 1.695 -8.189 2.237 1.00 0.00 S ATOM 173 CE MET A 13 1.988 -9.976 2.320 1.00 0.00 C ATOM 0 H MET A 13 -1.726 -9.844 -1.401 1.00 0.00 H new ATOM 0 HA MET A 13 0.628 -8.198 -2.167 1.00 0.00 H new ATOM 0 HB2 MET A 13 -0.582 -7.647 0.017 1.00 0.00 H new ATOM 0 HB3 MET A 13 -0.240 -9.280 0.555 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.273 -8.583 -0.054 1.00 0.00 H new ATOM 0 HG3 MET A 13 1.639 -6.965 0.179 1.00 0.00 H new ATOM 0 HE1 MET A 13 2.066 -10.284 3.363 1.00 0.00 H new ATOM 0 HE2 MET A 13 1.159 -10.503 1.847 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.915 -10.217 1.800 1.00 0.00 H new ATOM 183 N THR A 14 2.192 -10.166 -2.156 1.00 0.00 N ATOM 184 CA THR A 14 3.080 -11.318 -2.418 1.00 0.00 C ATOM 185 C THR A 14 4.570 -10.957 -2.527 1.00 0.00 C ATOM 186 O THR A 14 5.351 -11.811 -2.941 1.00 0.00 O ATOM 187 CB THR A 14 2.546 -12.128 -3.602 1.00 0.00 C ATOM 188 OG1 THR A 14 3.226 -13.354 -3.708 1.00 0.00 O ATOM 189 CG2 THR A 14 2.716 -11.365 -4.895 1.00 0.00 C ATOM 0 H THR A 14 2.622 -9.273 -2.398 1.00 0.00 H new ATOM 0 HA THR A 14 3.054 -11.959 -1.537 1.00 0.00 H new ATOM 0 HB THR A 14 1.486 -12.310 -3.425 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.177 -13.219 -3.513 1.00 0.00 H new ATOM 0 HG21 THR A 14 2.330 -11.960 -5.722 1.00 0.00 H new ATOM 0 HG22 THR A 14 2.168 -10.425 -4.837 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.774 -11.159 -5.059 1.00 0.00 H new ATOM 197 N CYS A 15 4.974 -9.735 -2.166 1.00 0.00 N ATOM 198 CA CYS A 15 6.329 -9.216 -2.337 1.00 0.00 C ATOM 199 C CYS A 15 6.945 -8.564 -1.056 1.00 0.00 C ATOM 200 O CYS A 15 6.298 -8.401 -0.017 1.00 0.00 O ATOM 201 CB CYS A 15 6.296 -8.310 -3.583 1.00 0.00 C ATOM 202 SG CYS A 15 6.016 -6.583 -3.112 1.00 0.00 S ATOM 0 H CYS A 15 4.344 -9.060 -1.733 1.00 0.00 H new ATOM 0 HA CYS A 15 7.029 -10.036 -2.498 1.00 0.00 H new ATOM 0 HB2 CYS A 15 7.237 -8.396 -4.126 1.00 0.00 H new ATOM 0 HB3 CYS A 15 5.507 -8.641 -4.258 1.00 0.00 H new ATOM 207 N ASN A 16 8.243 -8.244 -1.146 1.00 0.00 N ATOM 208 CA ASN A 16 9.145 -7.981 -0.016 1.00 0.00 C ATOM 209 C ASN A 16 9.148 -6.511 0.478 1.00 0.00 C ATOM 210 O ASN A 16 9.640 -6.240 1.570 1.00 0.00 O ATOM 211 CB ASN A 16 10.551 -8.473 -0.414 1.00 0.00 C ATOM 212 CG ASN A 16 11.496 -8.658 0.775 1.00 0.00 C ATOM 213 OD1 ASN A 16 12.090 -7.708 1.270 1.00 0.00 O ATOM 214 ND2 ASN A 16 11.700 -9.874 1.243 1.00 0.00 N ATOM 0 H ASN A 16 8.713 -8.158 -2.047 1.00 0.00 H new ATOM 0 HA ASN A 16 8.778 -8.531 0.850 1.00 0.00 H new ATOM 0 HB2 ASN A 16 10.458 -9.421 -0.944 1.00 0.00 H new ATOM 0 HB3 ASN A 16 10.992 -7.760 -1.110 1.00 0.00 H new ATOM 0 HD21 ASN A 16 12.351 -10.021 2.015 1.00 0.00 H new ATOM 0 HD22 ASN A 16 11.207 -10.667 0.833 1.00 0.00 H new ATOM 221 N SER A 17 8.595 -5.548 -0.265 1.00 0.00 N ATOM 222 CA SER A 17 8.400 -4.157 0.210 1.00 0.00 C ATOM 223 C SER A 17 6.942 -3.862 0.605 1.00 0.00 C ATOM 224 O SER A 17 6.651 -2.925 1.360 1.00 0.00 O ATOM 225 CB SER A 17 8.886 -3.154 -0.843 1.00 0.00 C ATOM 226 OG SER A 17 7.938 -2.901 -1.871 1.00 0.00 O ATOM 0 H SER A 17 8.266 -5.702 -1.218 1.00 0.00 H new ATOM 0 HA SER A 17 9.000 -4.046 1.113 1.00 0.00 H new ATOM 0 HB2 SER A 17 9.133 -2.214 -0.350 1.00 0.00 H new ATOM 0 HB3 SER A 17 9.805 -3.530 -1.293 1.00 0.00 H new ATOM 0 HG SER A 17 8.044 -3.565 -2.584 1.00 0.00 H new ATOM 232 N CYS A 18 6.006 -4.676 0.124 1.00 0.00 N ATOM 233 CA CYS A 18 4.612 -4.625 0.495 1.00 0.00 C ATOM 234 C CYS A 18 4.438 -5.082 1.965 1.00 0.00 C ATOM 235 O CYS A 18 3.783 -4.396 2.748 1.00 0.00 O ATOM 236 CB CYS A 18 3.905 -5.485 -0.560 1.00 0.00 C ATOM 237 SG CYS A 18 4.309 -4.868 -2.222 1.00 0.00 S ATOM 0 H CYS A 18 6.213 -5.409 -0.555 1.00 0.00 H new ATOM 0 HA CYS A 18 4.173 -3.627 0.491 1.00 0.00 H new ATOM 0 HB2 CYS A 18 4.215 -6.526 -0.462 1.00 0.00 H new ATOM 0 HB3 CYS A 18 2.827 -5.457 -0.403 1.00 0.00 H new ATOM 242 N VAL A 19 5.129 -6.156 2.365 1.00 0.00 N ATOM 243 CA VAL A 19 5.223 -6.608 3.773 1.00 0.00 C ATOM 244 C VAL A 19 5.746 -5.515 4.726 1.00 0.00 C ATOM 245 O VAL A 19 5.173 -5.320 5.799 1.00 0.00 O ATOM 246 CB VAL A 19 6.066 -7.896 3.940 1.00 0.00 C ATOM 247 CG1 VAL A 19 5.314 -9.104 3.362 1.00 0.00 C ATOM 248 CG2 VAL A 19 7.459 -7.812 3.304 1.00 0.00 C ATOM 0 H VAL A 19 5.648 -6.749 1.717 1.00 0.00 H new ATOM 0 HA VAL A 19 4.195 -6.836 4.054 1.00 0.00 H new ATOM 0 HB VAL A 19 6.216 -8.015 5.013 1.00 0.00 H new ATOM 0 HG11 VAL A 19 5.919 -10.002 3.486 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.367 -9.228 3.887 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.122 -8.940 2.302 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.989 -8.751 3.463 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.360 -7.627 2.234 1.00 0.00 H new ATOM 0 HG23 VAL A 19 8.020 -6.997 3.762 1.00 0.00 H new ATOM 258 N TRP A 20 6.754 -4.731 4.310 1.00 0.00 N ATOM 259 CA TRP A 20 7.238 -3.567 5.066 1.00 0.00 C ATOM 260 C TRP A 20 6.128 -2.519 5.248 1.00 0.00 C ATOM 261 O TRP A 20 5.934 -2.000 6.347 1.00 0.00 O ATOM 262 CB TRP A 20 8.461 -2.971 4.350 1.00 0.00 C ATOM 263 CG TRP A 20 9.040 -1.732 4.968 1.00 0.00 C ATOM 264 CD1 TRP A 20 10.074 -1.700 5.837 1.00 0.00 C ATOM 265 CD2 TRP A 20 8.651 -0.334 4.774 1.00 0.00 C ATOM 266 NE1 TRP A 20 10.355 -0.397 6.191 1.00 0.00 N ATOM 267 CE2 TRP A 20 9.513 0.491 5.561 1.00 0.00 C ATOM 268 CE3 TRP A 20 7.664 0.326 4.008 1.00 0.00 C ATOM 269 CZ2 TRP A 20 9.406 1.888 5.582 1.00 0.00 C ATOM 270 CZ3 TRP A 20 7.536 1.727 4.035 1.00 0.00 C ATOM 271 CH2 TRP A 20 8.409 2.510 4.812 1.00 0.00 C ATOM 0 H TRP A 20 7.257 -4.888 3.437 1.00 0.00 H new ATOM 0 HA TRP A 20 7.534 -3.889 6.064 1.00 0.00 H new ATOM 0 HB2 TRP A 20 9.240 -3.732 4.308 1.00 0.00 H new ATOM 0 HB3 TRP A 20 8.181 -2.744 3.321 1.00 0.00 H new ATOM 0 HD1 TRP A 20 10.603 -2.568 6.201 1.00 0.00 H new ATOM 0 HE1 TRP A 20 11.095 -0.125 6.839 1.00 0.00 H new ATOM 0 HE3 TRP A 20 6.996 -0.256 3.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 10.081 2.479 6.183 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 6.761 2.205 3.454 1.00 0.00 H new ATOM 0 HH2 TRP A 20 8.313 3.586 4.817 1.00 0.00 H new ATOM 282 N THR A 21 5.336 -2.275 4.193 1.00 0.00 N ATOM 283 CA THR A 21 4.184 -1.355 4.221 1.00 0.00 C ATOM 284 C THR A 21 3.153 -1.804 5.254 1.00 0.00 C ATOM 285 O THR A 21 2.680 -0.976 6.029 1.00 0.00 O ATOM 286 CB THR A 21 3.547 -1.196 2.832 1.00 0.00 C ATOM 287 OG1 THR A 21 4.556 -0.927 1.880 1.00 0.00 O ATOM 288 CG2 THR A 21 2.535 -0.046 2.822 1.00 0.00 C ATOM 0 H THR A 21 5.478 -2.716 3.284 1.00 0.00 H new ATOM 0 HA THR A 21 4.556 -0.374 4.518 1.00 0.00 H new ATOM 0 HB THR A 21 3.029 -2.123 2.584 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.074 -1.742 1.713 1.00 0.00 H new ATOM 0 HG21 THR A 21 2.098 0.046 1.828 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.747 -0.249 3.547 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.039 0.884 3.084 1.00 0.00 H new ATOM 296 N ILE A 22 2.859 -3.109 5.342 1.00 0.00 N ATOM 297 CA ILE A 22 1.981 -3.648 6.400 1.00 0.00 C ATOM 298 C ILE A 22 2.548 -3.349 7.795 1.00 0.00 C ATOM 299 O ILE A 22 1.835 -2.793 8.627 1.00 0.00 O ATOM 300 CB ILE A 22 1.706 -5.167 6.238 1.00 0.00 C ATOM 301 CG1 ILE A 22 1.282 -5.622 4.824 1.00 0.00 C ATOM 302 CG2 ILE A 22 0.632 -5.583 7.260 1.00 0.00 C ATOM 303 CD1 ILE A 22 0.045 -4.941 4.232 1.00 0.00 C ATOM 0 H ILE A 22 3.214 -3.813 4.695 1.00 0.00 H new ATOM 0 HA ILE A 22 1.024 -3.138 6.293 1.00 0.00 H new ATOM 0 HB ILE A 22 2.660 -5.664 6.415 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.120 -5.457 4.147 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.100 -6.696 4.851 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.427 -6.649 7.159 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.990 -5.376 8.269 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.282 -5.019 7.077 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -0.152 -5.344 3.238 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -0.815 -5.126 4.875 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.220 -3.868 4.160 1.00 0.00 H new ATOM 315 N GLU A 23 3.820 -3.670 8.045 1.00 0.00 N ATOM 316 CA GLU A 23 4.491 -3.461 9.337 1.00 0.00 C ATOM 317 C GLU A 23 4.447 -1.989 9.791 1.00 0.00 C ATOM 318 O GLU A 23 4.228 -1.700 10.971 1.00 0.00 O ATOM 319 CB GLU A 23 5.937 -3.979 9.210 1.00 0.00 C ATOM 320 CG GLU A 23 6.715 -4.032 10.531 1.00 0.00 C ATOM 321 CD GLU A 23 8.148 -4.527 10.314 1.00 0.00 C ATOM 322 OE1 GLU A 23 8.359 -5.570 9.652 1.00 0.00 O ATOM 323 OE2 GLU A 23 9.124 -3.898 10.791 1.00 0.00 O ATOM 0 H GLU A 23 4.427 -4.091 7.342 1.00 0.00 H new ATOM 0 HA GLU A 23 3.963 -4.016 10.112 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.914 -4.979 8.777 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.477 -3.341 8.511 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.735 -3.041 10.984 1.00 0.00 H new ATOM 0 HG3 GLU A 23 6.202 -4.692 11.231 1.00 0.00 H new ATOM 330 N GLN A 24 4.621 -1.053 8.854 1.00 0.00 N ATOM 331 CA GLN A 24 4.543 0.389 9.097 1.00 0.00 C ATOM 332 C GLN A 24 3.106 0.887 9.346 1.00 0.00 C ATOM 333 O GLN A 24 2.908 1.719 10.233 1.00 0.00 O ATOM 334 CB GLN A 24 5.166 1.133 7.904 1.00 0.00 C ATOM 335 CG GLN A 24 6.680 0.902 7.742 1.00 0.00 C ATOM 336 CD GLN A 24 7.537 1.625 8.777 1.00 0.00 C ATOM 337 OE1 GLN A 24 8.137 1.021 9.662 1.00 0.00 O ATOM 338 NE2 GLN A 24 7.618 2.934 8.718 1.00 0.00 N ATOM 0 H GLN A 24 4.825 -1.283 7.882 1.00 0.00 H new ATOM 0 HA GLN A 24 5.099 0.597 10.011 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.661 0.820 6.990 1.00 0.00 H new ATOM 0 HB3 GLN A 24 4.982 2.201 8.019 1.00 0.00 H new ATOM 0 HG2 GLN A 24 6.882 -0.167 7.803 1.00 0.00 H new ATOM 0 HG3 GLN A 24 6.981 1.227 6.746 1.00 0.00 H new ATOM 0 HE21 GLN A 24 7.123 3.443 7.986 1.00 0.00 H new ATOM 0 HE22 GLN A 24 8.176 3.442 9.404 1.00 0.00 H new ATOM 347 N GLN A 25 2.106 0.464 8.558 1.00 0.00 N ATOM 348 CA GLN A 25 0.715 0.914 8.746 1.00 0.00 C ATOM 349 C GLN A 25 0.016 0.272 9.942 1.00 0.00 C ATOM 350 O GLN A 25 -0.692 0.967 10.671 1.00 0.00 O ATOM 351 CB GLN A 25 -0.135 0.737 7.477 1.00 0.00 C ATOM 352 CG GLN A 25 0.389 1.526 6.260 1.00 0.00 C ATOM 353 CD GLN A 25 0.229 3.046 6.378 1.00 0.00 C ATOM 354 OE1 GLN A 25 0.197 3.645 7.450 1.00 0.00 O ATOM 355 NE2 GLN A 25 0.125 3.743 5.274 1.00 0.00 N ATOM 0 H GLN A 25 2.233 -0.189 7.784 1.00 0.00 H new ATOM 0 HA GLN A 25 0.800 1.979 8.961 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -0.174 -0.322 7.222 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.157 1.051 7.689 1.00 0.00 H new ATOM 0 HG2 GLN A 25 1.444 1.293 6.118 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -0.136 1.185 5.367 1.00 0.00 H new ATOM 0 HE21 GLN A 25 0.148 3.272 4.369 1.00 0.00 H new ATOM 0 HE22 GLN A 25 0.021 4.757 5.319 1.00 0.00 H new ATOM 364 N ILE A 26 0.209 -1.032 10.164 1.00 0.00 N ATOM 365 CA ILE A 26 -0.345 -1.738 11.328 1.00 0.00 C ATOM 366 C ILE A 26 0.276 -1.158 12.603 1.00 0.00 C ATOM 367 O ILE A 26 -0.460 -0.748 13.498 1.00 0.00 O ATOM 368 CB ILE A 26 -0.159 -3.267 11.151 1.00 0.00 C ATOM 369 CG1 ILE A 26 -0.945 -3.816 9.931 1.00 0.00 C ATOM 370 CG2 ILE A 26 -0.544 -4.077 12.396 1.00 0.00 C ATOM 371 CD1 ILE A 26 -2.475 -3.732 10.012 1.00 0.00 C ATOM 0 H ILE A 26 0.754 -1.630 9.543 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.421 -1.586 11.416 1.00 0.00 H new ATOM 0 HB ILE A 26 0.910 -3.394 10.981 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -0.620 -3.274 9.043 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.667 -4.860 9.787 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.389 -5.138 12.202 1.00 0.00 H new ATOM 0 HG22 ILE A 26 0.076 -3.768 13.237 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.593 -3.901 12.634 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.911 -4.146 9.103 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.826 -4.300 10.873 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.777 -2.690 10.118 1.00 0.00 H new ATOM 383 N GLY A 27 1.599 -0.954 12.630 1.00 0.00 N ATOM 384 CA GLY A 27 2.316 -0.288 13.730 1.00 0.00 C ATOM 385 C GLY A 27 1.908 1.166 14.017 1.00 0.00 C ATOM 386 O GLY A 27 2.402 1.739 14.989 1.00 0.00 O ATOM 0 H GLY A 27 2.215 -1.252 11.874 1.00 0.00 H new ATOM 0 HA2 GLY A 27 2.170 -0.872 14.639 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.383 -0.308 13.507 1.00 0.00 H new ATOM 390 N LYS A 28 1.019 1.769 13.219 1.00 0.00 N ATOM 391 CA LYS A 28 0.385 3.073 13.480 1.00 0.00 C ATOM 392 C LYS A 28 -1.056 2.954 14.007 1.00 0.00 C ATOM 393 O LYS A 28 -1.594 3.933 14.529 1.00 0.00 O ATOM 394 CB LYS A 28 0.504 3.904 12.187 1.00 0.00 C ATOM 395 CG LYS A 28 0.037 5.363 12.332 1.00 0.00 C ATOM 396 CD LYS A 28 0.336 6.188 11.076 1.00 0.00 C ATOM 397 CE LYS A 28 1.832 6.484 10.926 1.00 0.00 C ATOM 398 NZ LYS A 28 2.103 7.281 9.709 1.00 0.00 N ATOM 0 H LYS A 28 0.708 1.350 12.342 1.00 0.00 H new ATOM 0 HA LYS A 28 0.902 3.584 14.292 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.543 3.898 11.858 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.081 3.423 11.403 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.034 5.383 12.532 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.530 5.818 13.191 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.017 5.650 10.196 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -0.217 7.126 11.119 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.188 7.024 11.804 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.388 5.547 10.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.124 7.465 9.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 1.785 6.754 8.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.591 8.185 9.765 1.00 0.00 H new ATOM 412 N VAL A 29 -1.658 1.765 13.963 1.00 0.00 N ATOM 413 CA VAL A 29 -2.928 1.509 14.646 1.00 0.00 C ATOM 414 C VAL A 29 -2.621 1.229 16.118 1.00 0.00 C ATOM 415 O VAL A 29 -2.106 0.172 16.477 1.00 0.00 O ATOM 416 CB VAL A 29 -3.731 0.362 14.007 1.00 0.00 C ATOM 417 CG1 VAL A 29 -5.096 0.244 14.694 1.00 0.00 C ATOM 418 CG2 VAL A 29 -3.942 0.572 12.497 1.00 0.00 C ATOM 0 H VAL A 29 -1.285 0.960 13.459 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.565 2.388 14.552 1.00 0.00 H new ATOM 0 HB VAL A 29 -3.155 -0.554 14.141 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.663 -0.569 14.240 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.953 0.038 15.755 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.644 1.179 14.577 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.513 -0.262 12.090 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.488 1.501 12.332 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.974 0.626 11.998 1.00 0.00 H new ATOM 428 N ASN A 30 -2.917 2.215 16.961 1.00 0.00 N ATOM 429 CA ASN A 30 -2.600 2.256 18.401 1.00 0.00 C ATOM 430 C ASN A 30 -2.781 0.907 19.127 1.00 0.00 C ATOM 431 O ASN A 30 -1.903 0.475 19.876 1.00 0.00 O ATOM 432 CB ASN A 30 -3.493 3.317 19.066 1.00 0.00 C ATOM 433 CG ASN A 30 -3.068 3.670 20.491 1.00 0.00 C ATOM 434 OD1 ASN A 30 -1.918 3.521 20.894 1.00 0.00 O ATOM 435 ND2 ASN A 30 -3.988 4.164 21.292 1.00 0.00 N ATOM 0 H ASN A 30 -3.409 3.053 16.651 1.00 0.00 H new ATOM 0 HA ASN A 30 -1.542 2.502 18.486 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.482 4.222 18.458 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -4.521 2.956 19.082 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -3.746 4.423 22.248 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.943 4.288 20.957 1.00 0.00 H new ATOM 442 N GLY A 31 -3.890 0.211 18.855 1.00 0.00 N ATOM 443 CA GLY A 31 -4.291 -1.033 19.513 1.00 0.00 C ATOM 444 C GLY A 31 -3.672 -2.311 18.959 1.00 0.00 C ATOM 445 O GLY A 31 -4.276 -3.364 19.121 1.00 0.00 O ATOM 0 H GLY A 31 -4.556 0.511 18.144 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.038 -0.959 20.571 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.376 -1.121 19.450 1.00 0.00 H new ATOM 449 N VAL A 32 -2.536 -2.272 18.264 1.00 0.00 N ATOM 450 CA VAL A 32 -1.764 -3.486 17.902 1.00 0.00 C ATOM 451 C VAL A 32 -0.768 -3.894 18.999 1.00 0.00 C ATOM 452 O VAL A 32 -0.280 -3.048 19.750 1.00 0.00 O ATOM 453 CB VAL A 32 -1.029 -3.352 16.551 1.00 0.00 C ATOM 454 CG1 VAL A 32 -2.048 -3.034 15.449 1.00 0.00 C ATOM 455 CG2 VAL A 32 0.137 -2.350 16.579 1.00 0.00 C ATOM 0 H VAL A 32 -2.115 -1.405 17.931 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.509 -4.275 17.800 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.555 -4.309 16.334 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.533 -2.939 14.493 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.780 -3.839 15.387 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.556 -2.098 15.682 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.605 -2.309 15.596 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.239 -1.362 16.843 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.872 -2.668 17.318 1.00 0.00 H new ATOM 465 N HIS A 33 -0.424 -5.182 19.063 1.00 0.00 N ATOM 466 CA HIS A 33 0.679 -5.704 19.889 1.00 0.00 C ATOM 467 C HIS A 33 1.758 -6.449 19.071 1.00 0.00 C ATOM 468 O HIS A 33 2.950 -6.250 19.318 1.00 0.00 O ATOM 469 CB HIS A 33 0.095 -6.580 21.011 1.00 0.00 C ATOM 470 CG HIS A 33 -0.492 -5.756 22.135 1.00 0.00 C ATOM 471 ND1 HIS A 33 0.229 -4.968 23.000 1.00 0.00 N ATOM 472 CD2 HIS A 33 -1.812 -5.616 22.472 1.00 0.00 C ATOM 473 CE1 HIS A 33 -0.625 -4.357 23.833 1.00 0.00 C ATOM 474 NE2 HIS A 33 -1.891 -4.723 23.552 1.00 0.00 N ATOM 0 H HIS A 33 -0.909 -5.908 18.535 1.00 0.00 H new ATOM 0 HA HIS A 33 1.203 -4.855 20.328 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -0.677 -7.229 20.598 1.00 0.00 H new ATOM 0 HB3 HIS A 33 0.877 -7.227 21.408 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -2.646 -6.106 21.991 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -0.340 -3.670 24.616 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -2.738 -4.413 24.029 1.00 0.00 H new ATOM 482 N HIS A 34 1.382 -7.247 18.065 1.00 0.00 N ATOM 483 CA HIS A 34 2.337 -7.974 17.214 1.00 0.00 C ATOM 484 C HIS A 34 1.775 -8.211 15.801 1.00 0.00 C ATOM 485 O HIS A 34 0.632 -8.640 15.646 1.00 0.00 O ATOM 486 CB HIS A 34 2.741 -9.295 17.900 1.00 0.00 C ATOM 487 CG HIS A 34 3.458 -10.287 17.010 1.00 0.00 C ATOM 488 ND1 HIS A 34 4.481 -10.025 16.122 1.00 0.00 N ATOM 489 CD2 HIS A 34 3.163 -11.620 16.890 1.00 0.00 C ATOM 490 CE1 HIS A 34 4.762 -11.157 15.457 1.00 0.00 C ATOM 491 NE2 HIS A 34 3.993 -12.169 15.904 1.00 0.00 N ATOM 0 H HIS A 34 0.406 -7.409 17.816 1.00 0.00 H new ATOM 0 HA HIS A 34 3.230 -7.361 17.089 1.00 0.00 H new ATOM 0 HB2 HIS A 34 3.382 -9.063 18.750 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.844 -9.769 18.297 1.00 0.00 H new ATOM 0 HD2 HIS A 34 2.418 -12.156 17.459 1.00 0.00 H new ATOM 0 HE1 HIS A 34 5.501 -11.244 14.674 1.00 0.00 H new ATOM 0 HE2 HIS A 34 4.011 -13.139 15.588 1.00 0.00 H new ATOM 499 N ILE A 35 2.584 -7.960 14.768 1.00 0.00 N ATOM 500 CA ILE A 35 2.283 -8.216 13.354 1.00 0.00 C ATOM 501 C ILE A 35 3.250 -9.254 12.775 1.00 0.00 C ATOM 502 O ILE A 35 4.465 -9.126 12.905 1.00 0.00 O ATOM 503 CB ILE A 35 2.265 -6.879 12.561 1.00 0.00 C ATOM 504 CG1 ILE A 35 1.962 -7.067 11.054 1.00 0.00 C ATOM 505 CG2 ILE A 35 3.494 -5.978 12.803 1.00 0.00 C ATOM 506 CD1 ILE A 35 3.165 -7.231 10.112 1.00 0.00 C ATOM 0 H ILE A 35 3.510 -7.554 14.899 1.00 0.00 H new ATOM 0 HA ILE A 35 1.286 -8.648 13.263 1.00 0.00 H new ATOM 0 HB ILE A 35 1.422 -6.332 12.983 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.325 -7.944 10.944 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.383 -6.208 10.716 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.400 -5.067 12.211 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.553 -5.719 13.860 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.399 -6.510 12.508 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.811 -7.354 9.088 1.00 0.00 H new ATOM 0 HD12 ILE A 35 3.798 -6.346 10.173 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.740 -8.110 10.405 1.00 0.00 H new ATOM 518 N LYS A 36 2.707 -10.264 12.098 1.00 0.00 N ATOM 519 CA LYS A 36 3.431 -11.167 11.195 1.00 0.00 C ATOM 520 C LYS A 36 2.813 -11.039 9.790 1.00 0.00 C ATOM 521 O LYS A 36 1.594 -10.898 9.662 1.00 0.00 O ATOM 522 CB LYS A 36 3.322 -12.616 11.719 1.00 0.00 C ATOM 523 CG LYS A 36 4.165 -13.636 10.927 1.00 0.00 C ATOM 524 CD LYS A 36 3.705 -15.082 11.177 1.00 0.00 C ATOM 525 CE LYS A 36 4.531 -16.049 10.317 1.00 0.00 C ATOM 526 NZ LYS A 36 3.874 -17.370 10.169 1.00 0.00 N ATOM 0 H LYS A 36 1.714 -10.487 12.163 1.00 0.00 H new ATOM 0 HA LYS A 36 4.488 -10.904 11.149 1.00 0.00 H new ATOM 0 HB2 LYS A 36 3.632 -12.638 12.764 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.277 -12.924 11.690 1.00 0.00 H new ATOM 0 HG2 LYS A 36 4.097 -13.413 9.862 1.00 0.00 H new ATOM 0 HG3 LYS A 36 5.213 -13.535 11.208 1.00 0.00 H new ATOM 0 HD2 LYS A 36 3.819 -15.332 12.232 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.646 -15.183 10.938 1.00 0.00 H new ATOM 0 HE2 LYS A 36 4.689 -15.611 9.331 1.00 0.00 H new ATOM 0 HE3 LYS A 36 5.515 -16.183 10.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.468 -17.989 9.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 3.746 -17.801 11.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 2.946 -17.247 9.715 1.00 0.00 H new ATOM 540 N VAL A 37 3.630 -11.099 8.744 1.00 0.00 N ATOM 541 CA VAL A 37 3.189 -11.232 7.349 1.00 0.00 C ATOM 542 C VAL A 37 4.105 -12.199 6.612 1.00 0.00 C ATOM 543 O VAL A 37 5.321 -12.148 6.766 1.00 0.00 O ATOM 544 CB VAL A 37 3.138 -9.883 6.594 1.00 0.00 C ATOM 545 CG1 VAL A 37 1.826 -9.150 6.878 1.00 0.00 C ATOM 546 CG2 VAL A 37 4.325 -8.951 6.887 1.00 0.00 C ATOM 0 H VAL A 37 4.645 -11.056 8.839 1.00 0.00 H new ATOM 0 HA VAL A 37 2.169 -11.616 7.376 1.00 0.00 H new ATOM 0 HB VAL A 37 3.202 -10.144 5.538 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.813 -8.204 6.336 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.987 -9.766 6.553 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.741 -8.957 7.947 1.00 0.00 H new ATOM 0 HG21 VAL A 37 4.212 -8.028 6.318 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.352 -8.720 7.952 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.254 -9.443 6.599 1.00 0.00 H new ATOM 556 N SER A 38 3.513 -13.077 5.806 1.00 0.00 N ATOM 557 CA SER A 38 4.239 -14.049 4.986 1.00 0.00 C ATOM 558 C SER A 38 3.726 -13.992 3.541 1.00 0.00 C ATOM 559 O SER A 38 2.538 -14.188 3.265 1.00 0.00 O ATOM 560 CB SER A 38 4.131 -15.451 5.596 1.00 0.00 C ATOM 561 OG SER A 38 4.815 -15.479 6.843 1.00 0.00 O ATOM 0 H SER A 38 2.500 -13.136 5.701 1.00 0.00 H new ATOM 0 HA SER A 38 5.299 -13.797 4.967 1.00 0.00 H new ATOM 0 HB2 SER A 38 3.084 -15.718 5.737 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.559 -16.189 4.917 1.00 0.00 H new ATOM 0 HG SER A 38 4.745 -16.375 7.234 1.00 0.00 H new ATOM 567 N LEU A 39 4.634 -13.665 2.619 1.00 0.00 N ATOM 568 CA LEU A 39 4.367 -13.307 1.225 1.00 0.00 C ATOM 569 C LEU A 39 4.310 -14.511 0.276 1.00 0.00 C ATOM 570 O LEU A 39 3.537 -14.486 -0.680 1.00 0.00 O ATOM 571 CB LEU A 39 5.430 -12.269 0.810 1.00 0.00 C ATOM 572 CG LEU A 39 6.890 -12.786 0.781 1.00 0.00 C ATOM 573 CD1 LEU A 39 7.347 -13.163 -0.636 1.00 0.00 C ATOM 574 CD2 LEU A 39 7.840 -11.718 1.342 1.00 0.00 C ATOM 0 H LEU A 39 5.630 -13.642 2.837 1.00 0.00 H new ATOM 0 HA LEU A 39 3.367 -12.880 1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 39 5.177 -11.891 -0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.376 -11.424 1.497 1.00 0.00 H new ATOM 0 HG LEU A 39 6.920 -13.684 1.398 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.377 -13.519 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.703 -13.950 -1.029 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.286 -12.288 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.863 -12.092 1.317 1.00 0.00 H new ATOM 0 HD22 LEU A 39 7.769 -10.814 0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 39 7.563 -11.489 2.371 1.00 0.00 H new ATOM 586 N GLU A 40 5.058 -15.585 0.546 1.00 0.00 N ATOM 587 CA GLU A 40 5.025 -16.799 -0.282 1.00 0.00 C ATOM 588 C GLU A 40 3.673 -17.520 -0.155 1.00 0.00 C ATOM 589 O GLU A 40 3.179 -18.097 -1.129 1.00 0.00 O ATOM 590 CB GLU A 40 6.158 -17.765 0.102 1.00 0.00 C ATOM 591 CG GLU A 40 7.560 -17.180 -0.100 1.00 0.00 C ATOM 592 CD GLU A 40 8.635 -18.265 -0.041 1.00 0.00 C ATOM 593 OE1 GLU A 40 8.724 -19.017 0.959 1.00 0.00 O ATOM 594 OE2 GLU A 40 9.416 -18.377 -1.016 1.00 0.00 O ATOM 0 H GLU A 40 5.699 -15.640 1.337 1.00 0.00 H new ATOM 0 HA GLU A 40 5.164 -16.486 -1.317 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.041 -18.052 1.147 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.065 -18.675 -0.491 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.608 -16.671 -1.063 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.756 -16.430 0.666 1.00 0.00 H new ATOM 601 N GLU A 41 3.067 -17.451 1.036 1.00 0.00 N ATOM 602 CA GLU A 41 1.751 -18.024 1.365 1.00 0.00 C ATOM 603 C GLU A 41 0.659 -16.937 1.546 1.00 0.00 C ATOM 604 O GLU A 41 -0.444 -17.228 2.016 1.00 0.00 O ATOM 605 CB GLU A 41 1.876 -18.977 2.575 1.00 0.00 C ATOM 606 CG GLU A 41 2.860 -20.129 2.282 1.00 0.00 C ATOM 607 CD GLU A 41 2.749 -21.308 3.253 1.00 0.00 C ATOM 608 OE1 GLU A 41 1.856 -22.168 3.059 1.00 0.00 O ATOM 609 OE2 GLU A 41 3.603 -21.453 4.159 1.00 0.00 O ATOM 0 H GLU A 41 3.495 -16.976 1.831 1.00 0.00 H new ATOM 0 HA GLU A 41 1.411 -18.618 0.516 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.216 -18.418 3.447 1.00 0.00 H new ATOM 0 HB3 GLU A 41 0.896 -19.386 2.821 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.689 -20.490 1.268 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.878 -19.740 2.314 1.00 0.00 H new ATOM 616 N LYS A 42 0.957 -15.686 1.162 1.00 0.00 N ATOM 617 CA LYS A 42 0.023 -14.557 0.990 1.00 0.00 C ATOM 618 C LYS A 42 -0.948 -14.331 2.174 1.00 0.00 C ATOM 619 O LYS A 42 -2.152 -14.106 1.980 1.00 0.00 O ATOM 620 CB LYS A 42 -0.690 -14.684 -0.374 1.00 0.00 C ATOM 621 CG LYS A 42 0.276 -14.724 -1.569 1.00 0.00 C ATOM 622 CD LYS A 42 -0.451 -14.792 -2.920 1.00 0.00 C ATOM 623 CE LYS A 42 -1.170 -13.496 -3.301 1.00 0.00 C ATOM 624 NZ LYS A 42 -1.856 -13.621 -4.608 1.00 0.00 N ATOM 0 H LYS A 42 1.917 -15.416 0.949 1.00 0.00 H new ATOM 0 HA LYS A 42 0.617 -13.643 0.992 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.295 -15.590 -0.376 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.374 -13.844 -0.497 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.910 -13.838 -1.547 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.932 -15.589 -1.471 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.271 -15.038 -3.698 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.177 -15.604 -2.891 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.897 -13.242 -2.530 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.451 -12.678 -3.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -1.931 -12.683 -5.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -1.311 -14.254 -5.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -2.808 -14.013 -4.464 1.00 0.00 H new ATOM 638 N ASN A 43 -0.450 -14.398 3.414 1.00 0.00 N ATOM 639 CA ASN A 43 -1.269 -14.282 4.629 1.00 0.00 C ATOM 640 C ASN A 43 -0.592 -13.500 5.769 1.00 0.00 C ATOM 641 O ASN A 43 0.622 -13.559 5.971 1.00 0.00 O ATOM 642 CB ASN A 43 -1.778 -15.660 5.086 1.00 0.00 C ATOM 643 CG ASN A 43 -0.703 -16.526 5.729 1.00 0.00 C ATOM 644 OD1 ASN A 43 -0.555 -16.558 6.947 1.00 0.00 O ATOM 645 ND2 ASN A 43 0.060 -17.259 4.946 1.00 0.00 N ATOM 0 H ASN A 43 0.542 -14.536 3.606 1.00 0.00 H new ATOM 0 HA ASN A 43 -2.133 -13.677 4.355 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -2.592 -15.520 5.797 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -2.192 -16.188 4.227 1.00 0.00 H new ATOM 0 HD21 ASN A 43 0.779 -17.858 5.351 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -0.068 -17.228 3.935 1.00 0.00 H new ATOM 652 N ALA A 44 -1.418 -12.758 6.505 1.00 0.00 N ATOM 653 CA ALA A 44 -1.061 -11.781 7.526 1.00 0.00 C ATOM 654 C ALA A 44 -1.674 -12.194 8.878 1.00 0.00 C ATOM 655 O ALA A 44 -2.884 -12.413 8.938 1.00 0.00 O ATOM 656 CB ALA A 44 -1.634 -10.442 7.022 1.00 0.00 C ATOM 0 H ALA A 44 -2.429 -12.832 6.393 1.00 0.00 H new ATOM 0 HA ALA A 44 0.015 -11.707 7.685 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.405 -9.655 7.740 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.188 -10.195 6.058 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -2.715 -10.528 6.910 1.00 0.00 H new ATOM 662 N THR A 45 -0.875 -12.305 9.947 1.00 0.00 N ATOM 663 CA THR A 45 -1.302 -12.861 11.247 1.00 0.00 C ATOM 664 C THR A 45 -0.941 -11.899 12.368 1.00 0.00 C ATOM 665 O THR A 45 0.224 -11.559 12.556 1.00 0.00 O ATOM 666 CB THR A 45 -0.674 -14.240 11.490 1.00 0.00 C ATOM 667 OG1 THR A 45 -0.859 -15.041 10.343 1.00 0.00 O ATOM 668 CG2 THR A 45 -1.337 -14.926 12.683 1.00 0.00 C ATOM 0 H THR A 45 0.101 -12.008 9.938 1.00 0.00 H new ATOM 0 HA THR A 45 -2.384 -12.989 11.229 1.00 0.00 H new ATOM 0 HB THR A 45 0.388 -14.111 11.697 1.00 0.00 H new ATOM 0 HG1 THR A 45 -0.458 -15.923 10.492 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.880 -15.903 12.841 1.00 0.00 H new ATOM 0 HG22 THR A 45 -1.204 -14.314 13.575 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.402 -15.052 12.485 1.00 0.00 H new ATOM 676 N ILE A 46 -1.934 -11.421 13.113 1.00 0.00 N ATOM 677 CA ILE A 46 -1.811 -10.173 13.888 1.00 0.00 C ATOM 678 C ILE A 46 -2.515 -10.279 15.253 1.00 0.00 C ATOM 679 O ILE A 46 -3.624 -10.817 15.348 1.00 0.00 O ATOM 680 CB ILE A 46 -2.285 -9.021 12.958 1.00 0.00 C ATOM 681 CG1 ILE A 46 -1.730 -7.609 13.238 1.00 0.00 C ATOM 682 CG2 ILE A 46 -3.811 -8.988 12.768 1.00 0.00 C ATOM 683 CD1 ILE A 46 -2.125 -6.921 14.544 1.00 0.00 C ATOM 0 H ILE A 46 -2.842 -11.877 13.202 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.782 -9.961 14.177 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.815 -9.302 12.016 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.642 -7.668 13.209 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.036 -6.962 12.416 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -4.078 -8.162 12.109 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -4.143 -9.927 12.325 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.295 -8.852 13.735 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.656 -5.938 14.594 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.208 -6.809 14.583 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.792 -7.525 15.388 1.00 0.00 H new ATOM 695 N ILE A 47 -1.843 -9.795 16.306 1.00 0.00 N ATOM 696 CA ILE A 47 -2.344 -9.665 17.686 1.00 0.00 C ATOM 697 C ILE A 47 -2.703 -8.205 17.974 1.00 0.00 C ATOM 698 O ILE A 47 -1.847 -7.316 17.897 1.00 0.00 O ATOM 699 CB ILE A 47 -1.321 -10.152 18.743 1.00 0.00 C ATOM 700 CG1 ILE A 47 -0.730 -11.541 18.406 1.00 0.00 C ATOM 701 CG2 ILE A 47 -1.989 -10.143 20.136 1.00 0.00 C ATOM 702 CD1 ILE A 47 0.089 -12.163 19.545 1.00 0.00 C ATOM 0 H ILE A 47 -0.882 -9.465 16.216 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.226 -10.300 17.762 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.475 -9.464 18.741 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.544 -12.218 18.146 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -0.096 -11.451 17.524 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.274 -10.485 20.885 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.312 -9.130 20.378 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -2.853 -10.807 20.129 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.469 -13.135 19.231 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.925 -11.509 19.791 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.545 -12.288 20.423 1.00 0.00 H new ATOM 714 N TYR A 48 -3.954 -7.988 18.367 1.00 0.00 N ATOM 715 CA TYR A 48 -4.556 -6.701 18.695 1.00 0.00 C ATOM 716 C TYR A 48 -5.129 -6.660 20.125 1.00 0.00 C ATOM 717 O TYR A 48 -5.461 -7.681 20.724 1.00 0.00 O ATOM 718 CB TYR A 48 -5.646 -6.389 17.657 1.00 0.00 C ATOM 719 CG TYR A 48 -6.830 -7.346 17.596 1.00 0.00 C ATOM 720 CD1 TYR A 48 -6.783 -8.502 16.786 1.00 0.00 C ATOM 721 CD2 TYR A 48 -8.007 -7.046 18.309 1.00 0.00 C ATOM 722 CE1 TYR A 48 -7.903 -9.355 16.693 1.00 0.00 C ATOM 723 CE2 TYR A 48 -9.135 -7.880 18.207 1.00 0.00 C ATOM 724 CZ TYR A 48 -9.086 -9.039 17.402 1.00 0.00 C ATOM 725 OH TYR A 48 -10.184 -9.835 17.324 1.00 0.00 O ATOM 0 H TYR A 48 -4.617 -8.756 18.471 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.777 -5.939 18.663 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -6.028 -5.388 17.856 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -5.180 -6.362 16.672 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -5.884 -8.735 16.234 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.044 -6.169 18.939 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -7.858 -10.245 16.083 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.039 -7.634 18.745 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.900 -9.460 17.878 1.00 0.00 H new ATOM 735 N ASP A 49 -5.275 -5.448 20.655 1.00 0.00 N ATOM 736 CA ASP A 49 -6.016 -5.143 21.872 1.00 0.00 C ATOM 737 C ASP A 49 -7.521 -5.037 21.536 1.00 0.00 C ATOM 738 O ASP A 49 -7.914 -4.110 20.810 1.00 0.00 O ATOM 739 CB ASP A 49 -5.480 -3.829 22.468 1.00 0.00 C ATOM 740 CG ASP A 49 -6.027 -3.520 23.863 1.00 0.00 C ATOM 741 OD1 ASP A 49 -6.954 -4.223 24.327 1.00 0.00 O ATOM 742 OD2 ASP A 49 -5.478 -2.596 24.507 1.00 0.00 O ATOM 0 H ASP A 49 -4.862 -4.618 20.229 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.886 -5.934 22.610 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.392 -3.879 22.517 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.732 -3.007 21.798 1.00 0.00 H new ATOM 747 N PRO A 50 -8.375 -5.952 22.040 1.00 0.00 N ATOM 748 CA PRO A 50 -9.803 -5.963 21.736 1.00 0.00 C ATOM 749 C PRO A 50 -10.573 -4.800 22.383 1.00 0.00 C ATOM 750 O PRO A 50 -11.764 -4.652 22.118 1.00 0.00 O ATOM 751 CB PRO A 50 -10.296 -7.334 22.208 1.00 0.00 C ATOM 752 CG PRO A 50 -9.366 -7.659 23.372 1.00 0.00 C ATOM 753 CD PRO A 50 -8.038 -7.082 22.898 1.00 0.00 C ATOM 0 HA PRO A 50 -9.980 -5.814 20.671 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.339 -7.300 22.524 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.227 -8.081 21.417 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.701 -7.198 24.301 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.302 -8.732 23.554 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.428 -6.762 23.743 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -7.461 -7.828 22.352 1.00 0.00 H new ATOM 761 N LYS A 51 -9.928 -3.955 23.201 1.00 0.00 N ATOM 762 CA LYS A 51 -10.489 -2.680 23.673 1.00 0.00 C ATOM 763 C LYS A 51 -10.443 -1.570 22.601 1.00 0.00 C ATOM 764 O LYS A 51 -11.320 -0.706 22.567 1.00 0.00 O ATOM 765 CB LYS A 51 -9.703 -2.219 24.910 1.00 0.00 C ATOM 766 CG LYS A 51 -9.781 -3.193 26.098 1.00 0.00 C ATOM 767 CD LYS A 51 -9.001 -2.667 27.311 1.00 0.00 C ATOM 768 CE LYS A 51 -7.487 -2.667 27.051 1.00 0.00 C ATOM 769 NZ LYS A 51 -6.749 -1.941 28.108 1.00 0.00 N ATOM 0 H LYS A 51 -8.991 -4.140 23.558 1.00 0.00 H new ATOM 0 HA LYS A 51 -11.538 -2.853 23.912 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.658 -2.082 24.634 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.080 -1.246 25.226 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.824 -3.348 26.374 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.382 -4.163 25.801 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.331 -1.655 27.546 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.222 -3.284 28.182 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -7.127 -3.695 26.997 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.284 -2.207 26.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.731 -1.963 27.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.074 -0.954 28.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.922 -2.396 29.027 1.00 0.00 H new ATOM 783 N LEU A 52 -9.411 -1.555 21.741 1.00 0.00 N ATOM 784 CA LEU A 52 -9.174 -0.511 20.739 1.00 0.00 C ATOM 785 C LEU A 52 -9.557 -0.949 19.313 1.00 0.00 C ATOM 786 O LEU A 52 -9.854 -0.091 18.484 1.00 0.00 O ATOM 787 CB LEU A 52 -7.683 -0.123 20.806 1.00 0.00 C ATOM 788 CG LEU A 52 -7.292 0.869 21.924 1.00 0.00 C ATOM 789 CD1 LEU A 52 -7.615 0.383 23.342 1.00 0.00 C ATOM 790 CD2 LEU A 52 -5.783 1.130 21.843 1.00 0.00 C ATOM 0 H LEU A 52 -8.703 -2.289 21.726 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.812 0.343 20.967 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -7.096 -1.033 20.933 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -7.397 0.309 19.847 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.885 1.768 21.755 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.308 1.139 24.065 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.687 0.209 23.432 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.079 -0.546 23.539 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.492 1.829 22.627 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.244 0.192 21.975 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.539 1.555 20.869 1.00 0.00 H new ATOM 802 N GLN A 53 -9.548 -2.252 19.005 1.00 0.00 N ATOM 803 CA GLN A 53 -9.738 -2.760 17.641 1.00 0.00 C ATOM 804 C GLN A 53 -10.842 -3.821 17.514 1.00 0.00 C ATOM 805 O GLN A 53 -11.342 -4.368 18.502 1.00 0.00 O ATOM 806 CB GLN A 53 -8.418 -3.364 17.131 1.00 0.00 C ATOM 807 CG GLN A 53 -7.281 -2.347 16.988 1.00 0.00 C ATOM 808 CD GLN A 53 -6.276 -2.836 15.953 1.00 0.00 C ATOM 809 OE1 GLN A 53 -6.499 -2.776 14.759 1.00 0.00 O ATOM 810 NE2 GLN A 53 -5.158 -3.396 16.343 1.00 0.00 N ATOM 0 H GLN A 53 -9.408 -2.987 19.698 1.00 0.00 H new ATOM 0 HA GLN A 53 -10.050 -1.904 17.043 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -8.103 -4.152 17.815 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.595 -3.834 16.164 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -7.683 -1.379 16.689 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -6.786 -2.204 17.949 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -4.941 -3.462 17.337 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -4.505 -3.766 15.652 1.00 0.00 H new ATOM 819 N THR A 54 -11.165 -4.123 16.253 1.00 0.00 N ATOM 820 CA THR A 54 -11.872 -5.310 15.747 1.00 0.00 C ATOM 821 C THR A 54 -11.155 -5.767 14.463 1.00 0.00 C ATOM 822 O THR A 54 -10.415 -4.958 13.899 1.00 0.00 O ATOM 823 CB THR A 54 -13.348 -4.995 15.447 1.00 0.00 C ATOM 824 OG1 THR A 54 -13.485 -3.789 14.725 1.00 0.00 O ATOM 825 CG2 THR A 54 -14.173 -4.858 16.722 1.00 0.00 C ATOM 0 H THR A 54 -10.918 -3.490 15.492 1.00 0.00 H new ATOM 0 HA THR A 54 -11.858 -6.097 16.501 1.00 0.00 H new ATOM 0 HB THR A 54 -13.713 -5.835 14.856 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.434 -3.619 14.549 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.208 -4.636 16.463 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.132 -5.791 17.284 1.00 0.00 H new ATOM 0 HG23 THR A 54 -13.770 -4.049 17.331 1.00 0.00 H new ATOM 833 N PRO A 55 -11.345 -7.004 13.952 1.00 0.00 N ATOM 834 CA PRO A 55 -10.828 -7.429 12.647 1.00 0.00 C ATOM 835 C PRO A 55 -11.144 -6.441 11.522 1.00 0.00 C ATOM 836 O PRO A 55 -10.295 -6.208 10.667 1.00 0.00 O ATOM 837 CB PRO A 55 -11.454 -8.795 12.371 1.00 0.00 C ATOM 838 CG PRO A 55 -11.687 -9.353 13.769 1.00 0.00 C ATOM 839 CD PRO A 55 -11.985 -8.120 14.621 1.00 0.00 C ATOM 0 HA PRO A 55 -9.739 -7.475 12.676 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -12.385 -8.707 11.811 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -10.790 -9.433 11.787 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -12.519 -10.057 13.783 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.811 -9.888 14.135 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -13.059 -7.958 14.709 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -11.597 -8.242 15.632 1.00 0.00 H new ATOM 847 N LYS A 56 -12.312 -5.786 11.565 1.00 0.00 N ATOM 848 CA LYS A 56 -12.627 -4.663 10.674 1.00 0.00 C ATOM 849 C LYS A 56 -11.537 -3.568 10.677 1.00 0.00 C ATOM 850 O LYS A 56 -11.119 -3.157 9.596 1.00 0.00 O ATOM 851 CB LYS A 56 -14.021 -4.119 11.036 1.00 0.00 C ATOM 852 CG LYS A 56 -14.462 -2.870 10.250 1.00 0.00 C ATOM 853 CD LYS A 56 -14.561 -3.037 8.725 1.00 0.00 C ATOM 854 CE LYS A 56 -15.651 -4.027 8.291 1.00 0.00 C ATOM 855 NZ LYS A 56 -15.808 -4.020 6.818 1.00 0.00 N ATOM 0 H LYS A 56 -13.062 -6.019 12.216 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.645 -5.025 9.646 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.755 -4.908 10.874 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -14.036 -3.883 12.100 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -15.435 -2.553 10.625 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -13.760 -2.064 10.463 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -14.761 -2.066 8.273 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -13.599 -3.375 8.340 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -15.393 -5.031 8.630 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.597 -3.764 8.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.550 -4.696 6.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.075 -3.066 6.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -14.909 -4.293 6.372 1.00 0.00 H new ATOM 869 N THR A 57 -11.012 -3.140 11.836 1.00 0.00 N ATOM 870 CA THR A 57 -9.891 -2.178 11.941 1.00 0.00 C ATOM 871 C THR A 57 -8.657 -2.686 11.195 1.00 0.00 C ATOM 872 O THR A 57 -8.061 -1.936 10.421 1.00 0.00 O ATOM 873 CB THR A 57 -9.545 -1.896 13.413 1.00 0.00 C ATOM 874 OG1 THR A 57 -10.725 -1.577 14.114 1.00 0.00 O ATOM 875 CG2 THR A 57 -8.574 -0.725 13.573 1.00 0.00 C ATOM 0 H THR A 57 -11.356 -3.454 12.743 1.00 0.00 H new ATOM 0 HA THR A 57 -10.212 -1.246 11.476 1.00 0.00 H new ATOM 0 HB THR A 57 -9.070 -2.794 13.807 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.495 -1.245 15.007 1.00 0.00 H new ATOM 0 HG21 THR A 57 -8.363 -0.569 14.631 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.646 -0.948 13.047 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.020 0.177 13.155 1.00 0.00 H new ATOM 883 N LEU A 58 -8.323 -3.972 11.349 1.00 0.00 N ATOM 884 CA LEU A 58 -7.193 -4.605 10.661 1.00 0.00 C ATOM 885 C LEU A 58 -7.408 -4.655 9.137 1.00 0.00 C ATOM 886 O LEU A 58 -6.469 -4.397 8.390 1.00 0.00 O ATOM 887 CB LEU A 58 -6.918 -6.014 11.246 1.00 0.00 C ATOM 888 CG LEU A 58 -6.355 -6.125 12.683 1.00 0.00 C ATOM 889 CD1 LEU A 58 -5.101 -5.267 12.880 1.00 0.00 C ATOM 890 CD2 LEU A 58 -7.360 -5.831 13.803 1.00 0.00 C ATOM 0 H LEU A 58 -8.834 -4.608 11.960 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.310 -3.990 10.834 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.853 -6.574 11.213 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.220 -6.519 10.578 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.098 -7.180 12.772 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.742 -5.377 13.903 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -4.325 -5.592 12.186 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.342 -4.221 12.691 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.868 -5.936 14.770 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.737 -4.814 13.696 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.190 -6.534 13.741 1.00 0.00 H new ATOM 902 N GLN A 59 -8.628 -4.934 8.666 1.00 0.00 N ATOM 903 CA GLN A 59 -9.001 -4.888 7.241 1.00 0.00 C ATOM 904 C GLN A 59 -8.922 -3.465 6.661 1.00 0.00 C ATOM 905 O GLN A 59 -8.480 -3.286 5.528 1.00 0.00 O ATOM 906 CB GLN A 59 -10.436 -5.421 7.052 1.00 0.00 C ATOM 907 CG GLN A 59 -10.594 -6.905 7.399 1.00 0.00 C ATOM 908 CD GLN A 59 -12.063 -7.326 7.489 1.00 0.00 C ATOM 909 OE1 GLN A 59 -12.664 -7.365 8.556 1.00 0.00 O ATOM 910 NE2 GLN A 59 -12.693 -7.658 6.387 1.00 0.00 N ATOM 0 H GLN A 59 -9.402 -5.204 9.273 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.286 -5.514 6.707 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.115 -4.838 7.674 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.738 -5.265 6.016 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.091 -7.508 6.643 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.101 -7.108 8.350 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -12.204 -7.630 5.492 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.671 -7.944 6.425 1.00 0.00 H new ATOM 919 N GLU A 60 -9.361 -2.443 7.401 1.00 0.00 N ATOM 920 CA GLU A 60 -9.341 -1.040 6.956 1.00 0.00 C ATOM 921 C GLU A 60 -7.926 -0.467 6.899 1.00 0.00 C ATOM 922 O GLU A 60 -7.639 0.385 6.057 1.00 0.00 O ATOM 923 CB GLU A 60 -10.196 -0.181 7.894 1.00 0.00 C ATOM 924 CG GLU A 60 -11.676 -0.544 7.792 1.00 0.00 C ATOM 925 CD GLU A 60 -12.310 -0.060 6.492 1.00 0.00 C ATOM 926 OE1 GLU A 60 -12.646 1.142 6.404 1.00 0.00 O ATOM 927 OE2 GLU A 60 -12.526 -0.876 5.564 1.00 0.00 O ATOM 0 H GLU A 60 -9.746 -2.564 8.338 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.750 -1.020 5.946 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.857 -0.315 8.921 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.061 0.872 7.649 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.787 -1.626 7.865 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -12.212 -0.111 8.637 1.00 0.00 H new ATOM 934 N ALA A 61 -7.024 -0.950 7.755 1.00 0.00 N ATOM 935 CA ALA A 61 -5.606 -0.579 7.680 1.00 0.00 C ATOM 936 C ALA A 61 -4.956 -0.946 6.332 1.00 0.00 C ATOM 937 O ALA A 61 -4.058 -0.230 5.887 1.00 0.00 O ATOM 938 CB ALA A 61 -4.823 -1.200 8.841 1.00 0.00 C ATOM 0 H ALA A 61 -7.248 -1.599 8.509 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.566 0.507 7.760 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.774 -0.913 8.767 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -5.231 -0.844 9.787 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -4.906 -2.286 8.796 1.00 0.00 H new ATOM 944 N ILE A 62 -5.412 -2.029 5.683 1.00 0.00 N ATOM 945 CA ILE A 62 -4.959 -2.463 4.345 1.00 0.00 C ATOM 946 C ILE A 62 -5.459 -1.530 3.234 1.00 0.00 C ATOM 947 O ILE A 62 -4.804 -1.381 2.203 1.00 0.00 O ATOM 948 CB ILE A 62 -5.423 -3.917 4.043 1.00 0.00 C ATOM 949 CG1 ILE A 62 -5.297 -4.917 5.213 1.00 0.00 C ATOM 950 CG2 ILE A 62 -4.682 -4.485 2.818 1.00 0.00 C ATOM 951 CD1 ILE A 62 -3.908 -5.011 5.857 1.00 0.00 C ATOM 0 H ILE A 62 -6.122 -2.644 6.080 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.870 -2.425 4.360 1.00 0.00 H new ATOM 0 HB ILE A 62 -6.491 -3.816 3.849 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -6.017 -4.640 5.983 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.579 -5.907 4.854 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.023 -5.502 2.626 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -4.888 -3.863 1.947 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.610 -4.492 3.013 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.931 -5.741 6.666 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.180 -5.322 5.108 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.625 -4.037 6.255 1.00 0.00 H new ATOM 963 N ASP A 63 -6.634 -0.926 3.412 1.00 0.00 N ATOM 964 CA ASP A 63 -7.348 -0.149 2.390 1.00 0.00 C ATOM 965 C ASP A 63 -6.698 1.214 2.072 1.00 0.00 C ATOM 966 O ASP A 63 -7.122 1.910 1.153 1.00 0.00 O ATOM 967 CB ASP A 63 -8.815 -0.014 2.830 1.00 0.00 C ATOM 968 CG ASP A 63 -9.735 0.352 1.665 1.00 0.00 C ATOM 969 OD1 ASP A 63 -10.086 -0.566 0.881 1.00 0.00 O ATOM 970 OD2 ASP A 63 -10.104 1.541 1.525 1.00 0.00 O ATOM 0 H ASP A 63 -7.134 -0.963 4.300 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.291 -0.688 1.444 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -9.148 -0.953 3.273 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.892 0.749 3.605 1.00 0.00 H new ATOM 975 N ASP A 64 -5.653 1.603 2.806 1.00 0.00 N ATOM 976 CA ASP A 64 -4.768 2.728 2.467 1.00 0.00 C ATOM 977 C ASP A 64 -3.895 2.434 1.232 1.00 0.00 C ATOM 978 O ASP A 64 -3.492 3.358 0.521 1.00 0.00 O ATOM 979 CB ASP A 64 -3.891 3.049 3.685 1.00 0.00 C ATOM 980 CG ASP A 64 -4.634 3.723 4.849 1.00 0.00 C ATOM 981 OD1 ASP A 64 -5.865 3.972 4.794 1.00 0.00 O ATOM 982 OD2 ASP A 64 -3.946 4.019 5.852 1.00 0.00 O ATOM 0 H ASP A 64 -5.390 1.136 3.674 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.386 3.588 2.211 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -3.441 2.124 4.046 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -3.075 3.698 3.368 1.00 0.00 H new ATOM 987 N MET A 65 -3.662 1.151 0.937 1.00 0.00 N ATOM 988 CA MET A 65 -3.014 0.658 -0.281 1.00 0.00 C ATOM 989 C MET A 65 -4.069 0.128 -1.274 1.00 0.00 C ATOM 990 O MET A 65 -5.276 0.263 -1.058 1.00 0.00 O ATOM 991 CB MET A 65 -1.979 -0.425 0.098 1.00 0.00 C ATOM 992 CG MET A 65 -0.843 0.090 0.999 1.00 0.00 C ATOM 993 SD MET A 65 -1.209 0.290 2.766 1.00 0.00 S ATOM 994 CE MET A 65 -1.334 -1.441 3.274 1.00 0.00 C ATOM 0 H MET A 65 -3.932 0.396 1.568 1.00 0.00 H new ATOM 0 HA MET A 65 -2.489 1.473 -0.779 1.00 0.00 H new ATOM 0 HB2 MET A 65 -2.491 -1.242 0.606 1.00 0.00 H new ATOM 0 HB3 MET A 65 -1.548 -0.838 -0.814 1.00 0.00 H new ATOM 0 HG2 MET A 65 -0.000 -0.595 0.904 1.00 0.00 H new ATOM 0 HG3 MET A 65 -0.515 1.054 0.611 1.00 0.00 H new ATOM 0 HE1 MET A 65 -1.433 -1.496 4.358 1.00 0.00 H new ATOM 0 HE2 MET A 65 -2.208 -1.895 2.807 1.00 0.00 H new ATOM 0 HE3 MET A 65 -0.437 -1.977 2.964 1.00 0.00 H new ATOM 1004 N GLY A 66 -3.623 -0.503 -2.367 1.00 0.00 N ATOM 1005 CA GLY A 66 -4.472 -1.179 -3.359 1.00 0.00 C ATOM 1006 C GLY A 66 -4.263 -2.693 -3.374 1.00 0.00 C ATOM 1007 O GLY A 66 -3.890 -3.254 -4.406 1.00 0.00 O ATOM 0 H GLY A 66 -2.630 -0.560 -2.594 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.519 -0.962 -3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.259 -0.776 -4.349 1.00 0.00 H new ATOM 1011 N PHE A 67 -4.489 -3.349 -2.235 1.00 0.00 N ATOM 1012 CA PHE A 67 -4.396 -4.806 -2.088 1.00 0.00 C ATOM 1013 C PHE A 67 -5.799 -5.434 -1.997 1.00 0.00 C ATOM 1014 O PHE A 67 -6.813 -4.751 -2.129 1.00 0.00 O ATOM 1015 CB PHE A 67 -3.508 -5.144 -0.872 1.00 0.00 C ATOM 1016 CG PHE A 67 -2.073 -4.634 -0.922 1.00 0.00 C ATOM 1017 CD1 PHE A 67 -1.277 -4.834 -2.068 1.00 0.00 C ATOM 1018 CD2 PHE A 67 -1.508 -4.011 0.208 1.00 0.00 C ATOM 1019 CE1 PHE A 67 0.065 -4.411 -2.085 1.00 0.00 C ATOM 1020 CE2 PHE A 67 -0.167 -3.582 0.189 1.00 0.00 C ATOM 1021 CZ PHE A 67 0.618 -3.778 -0.960 1.00 0.00 C ATOM 0 H PHE A 67 -4.747 -2.874 -1.370 1.00 0.00 H new ATOM 0 HA PHE A 67 -3.924 -5.239 -2.970 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.984 -4.740 0.022 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.482 -6.228 -0.758 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.700 -5.315 -2.938 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -2.107 -3.862 1.094 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.671 -4.573 -2.964 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.258 -3.102 1.058 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.644 -3.443 -0.978 1.00 0.00 H new ATOM 1031 N ASP A 68 -5.861 -6.749 -1.792 1.00 0.00 N ATOM 1032 CA ASP A 68 -7.087 -7.501 -1.521 1.00 0.00 C ATOM 1033 C ASP A 68 -6.860 -8.314 -0.240 1.00 0.00 C ATOM 1034 O ASP A 68 -5.731 -8.740 0.011 1.00 0.00 O ATOM 1035 CB ASP A 68 -7.423 -8.422 -2.706 1.00 0.00 C ATOM 1036 CG ASP A 68 -7.676 -7.642 -3.999 1.00 0.00 C ATOM 1037 OD1 ASP A 68 -8.708 -6.940 -4.101 1.00 0.00 O ATOM 1038 OD2 ASP A 68 -6.836 -7.704 -4.923 1.00 0.00 O ATOM 0 H ASP A 68 -5.031 -7.341 -1.811 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.931 -6.824 -1.388 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -6.602 -9.122 -2.862 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.306 -9.014 -2.464 1.00 0.00 H new ATOM 1043 N ALA A 69 -7.901 -8.510 0.577 1.00 0.00 N ATOM 1044 CA ALA A 69 -7.774 -9.113 1.907 1.00 0.00 C ATOM 1045 C ALA A 69 -9.080 -9.777 2.379 1.00 0.00 C ATOM 1046 O ALA A 69 -10.153 -9.184 2.237 1.00 0.00 O ATOM 1047 CB ALA A 69 -7.290 -8.035 2.891 1.00 0.00 C ATOM 0 H ALA A 69 -8.858 -8.254 0.333 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.041 -9.918 1.861 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.191 -8.469 3.886 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -6.323 -7.652 2.564 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.012 -7.219 2.921 1.00 0.00 H new ATOM 1053 N VAL A 70 -8.986 -10.980 2.958 1.00 0.00 N ATOM 1054 CA VAL A 70 -10.123 -11.817 3.383 1.00 0.00 C ATOM 1055 C VAL A 70 -9.814 -12.418 4.754 1.00 0.00 C ATOM 1056 O VAL A 70 -8.711 -12.924 4.967 1.00 0.00 O ATOM 1057 CB VAL A 70 -10.388 -12.971 2.379 1.00 0.00 C ATOM 1058 CG1 VAL A 70 -11.634 -13.784 2.767 1.00 0.00 C ATOM 1059 CG2 VAL A 70 -10.570 -12.460 0.938 1.00 0.00 C ATOM 0 H VAL A 70 -8.085 -11.416 3.152 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.012 -11.187 3.425 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.505 -13.608 2.422 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -11.788 -14.583 2.041 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -11.493 -14.216 3.758 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -12.506 -13.130 2.777 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -10.753 -13.304 0.273 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.418 -11.777 0.899 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -9.668 -11.937 0.621 1.00 0.00 H new ATOM 1069 N ILE A 71 -10.762 -12.374 5.694 1.00 0.00 N ATOM 1070 CA ILE A 71 -10.562 -12.936 7.041 1.00 0.00 C ATOM 1071 C ILE A 71 -10.520 -14.478 7.016 1.00 0.00 C ATOM 1072 O ILE A 71 -11.424 -15.143 6.506 1.00 0.00 O ATOM 1073 CB ILE A 71 -11.630 -12.408 8.033 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -11.644 -10.872 8.198 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -11.447 -13.060 9.415 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -10.320 -10.251 8.651 1.00 0.00 C ATOM 0 H ILE A 71 -11.680 -11.954 5.550 1.00 0.00 H new ATOM 0 HA ILE A 71 -9.589 -12.597 7.396 1.00 0.00 H new ATOM 0 HB ILE A 71 -12.589 -12.684 7.595 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -11.930 -10.423 7.247 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -12.416 -10.608 8.920 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -12.204 -12.679 10.100 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -11.551 -14.141 9.324 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -10.456 -12.822 9.801 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -10.435 -9.170 8.736 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -10.037 -10.663 9.620 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -9.543 -10.476 7.920 1.00 0.00 H new ATOM 1088 N HIS A 72 -9.479 -15.070 7.602 1.00 0.00 N ATOM 1089 CA HIS A 72 -9.158 -16.497 7.480 1.00 0.00 C ATOM 1090 C HIS A 72 -8.772 -17.109 8.853 1.00 0.00 C ATOM 1091 O HIS A 72 -9.120 -16.559 9.905 1.00 0.00 O ATOM 1092 CB HIS A 72 -8.077 -16.637 6.376 1.00 0.00 C ATOM 1093 CG HIS A 72 -8.442 -17.602 5.272 1.00 0.00 C ATOM 1094 ND1 HIS A 72 -7.935 -18.867 5.067 1.00 0.00 N ATOM 1095 CD2 HIS A 72 -9.283 -17.337 4.222 1.00 0.00 C ATOM 1096 CE1 HIS A 72 -8.467 -19.350 3.933 1.00 0.00 C ATOM 1097 NE2 HIS A 72 -9.294 -18.450 3.371 1.00 0.00 N ATOM 0 H HIS A 72 -8.818 -14.561 8.189 1.00 0.00 H new ATOM 0 HA HIS A 72 -10.027 -17.080 7.174 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -7.890 -15.656 5.939 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -7.144 -16.964 6.836 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -9.842 -16.425 4.076 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -8.259 -20.329 3.527 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -9.821 -18.556 2.504 1.00 0.00 H new ATOM 1105 N ASN A 73 -8.052 -18.238 8.859 1.00 0.00 N ATOM 1106 CA ASN A 73 -7.494 -18.909 10.045 1.00 0.00 C ATOM 1107 C ASN A 73 -6.073 -19.411 9.752 1.00 0.00 C ATOM 1108 O ASN A 73 -5.887 -20.117 8.732 1.00 0.00 O ATOM 1109 CB ASN A 73 -8.454 -20.050 10.457 1.00 0.00 C ATOM 1110 CG ASN A 73 -7.971 -20.856 11.653 1.00 0.00 C ATOM 1111 OD1 ASN A 73 -7.287 -21.861 11.513 1.00 0.00 O ATOM 1112 ND2 ASN A 73 -8.314 -20.464 12.856 1.00 0.00 N ATOM 1113 OXT ASN A 73 -5.150 -19.039 10.508 1.00 0.00 O ATOM 0 H ASN A 73 -7.831 -18.734 7.996 1.00 0.00 H new ATOM 0 HA ASN A 73 -7.409 -18.213 10.880 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.431 -19.625 10.688 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -8.591 -20.721 9.609 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -8.011 -20.996 13.672 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.884 -19.627 12.976 1.00 0.00 H new TER 1120 ASN A 73 ATOM 1121 N MET B 74 -1.617 17.724 -22.875 1.00 0.00 N ATOM 1122 CA MET B 74 -1.323 17.637 -21.425 1.00 0.00 C ATOM 1123 C MET B 74 0.154 17.310 -21.201 1.00 0.00 C ATOM 1124 O MET B 74 0.683 16.501 -21.964 1.00 0.00 O ATOM 1125 CB MET B 74 -2.195 16.577 -20.730 1.00 0.00 C ATOM 1126 CG MET B 74 -3.636 17.044 -20.513 1.00 0.00 C ATOM 1127 SD MET B 74 -3.781 18.551 -19.524 1.00 0.00 S ATOM 1128 CE MET B 74 -5.586 18.691 -19.489 1.00 0.00 C ATOM 0 HA MET B 74 -1.554 18.608 -20.988 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.199 15.667 -21.330 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.751 16.323 -19.767 1.00 0.00 H new ATOM 0 HG2 MET B 74 -4.102 17.213 -21.484 1.00 0.00 H new ATOM 0 HG3 MET B 74 -4.196 16.246 -20.025 1.00 0.00 H new ATOM 0 HE1 MET B 74 -5.877 19.474 -18.789 1.00 0.00 H new ATOM 0 HE2 MET B 74 -5.951 18.941 -20.485 1.00 0.00 H new ATOM 0 HE3 MET B 74 -6.018 17.742 -19.172 1.00 0.00 H new ATOM 1140 N PRO B 75 0.814 17.894 -20.180 1.00 0.00 N ATOM 1141 CA PRO B 75 2.248 17.738 -19.932 1.00 0.00 C ATOM 1142 C PRO B 75 2.604 16.361 -19.351 1.00 0.00 C ATOM 1143 O PRO B 75 1.802 15.740 -18.654 1.00 0.00 O ATOM 1144 CB PRO B 75 2.608 18.858 -18.947 1.00 0.00 C ATOM 1145 CG PRO B 75 1.317 19.050 -18.153 1.00 0.00 C ATOM 1146 CD PRO B 75 0.232 18.804 -19.202 1.00 0.00 C ATOM 0 HA PRO B 75 2.810 17.803 -20.864 1.00 0.00 H new ATOM 0 HB2 PRO B 75 3.440 18.575 -18.302 1.00 0.00 H new ATOM 0 HB3 PRO B 75 2.902 19.771 -19.465 1.00 0.00 H new ATOM 0 HG2 PRO B 75 1.244 18.346 -17.324 1.00 0.00 H new ATOM 0 HG3 PRO B 75 1.249 20.052 -17.728 1.00 0.00 H new ATOM 0 HD2 PRO B 75 -0.658 18.370 -18.747 1.00 0.00 H new ATOM 0 HD3 PRO B 75 -0.074 19.738 -19.673 1.00 0.00 H new ATOM 1154 N LYS B 76 3.839 15.912 -19.601 1.00 0.00 N ATOM 1155 CA LYS B 76 4.384 14.644 -19.093 1.00 0.00 C ATOM 1156 C LYS B 76 5.468 14.849 -18.020 1.00 0.00 C ATOM 1157 O LYS B 76 6.324 15.731 -18.139 1.00 0.00 O ATOM 1158 CB LYS B 76 4.937 13.809 -20.261 1.00 0.00 C ATOM 1159 CG LYS B 76 3.802 13.301 -21.165 1.00 0.00 C ATOM 1160 CD LYS B 76 4.271 12.299 -22.227 1.00 0.00 C ATOM 1161 CE LYS B 76 4.735 10.976 -21.601 1.00 0.00 C ATOM 1162 NZ LYS B 76 5.026 9.961 -22.645 1.00 0.00 N ATOM 0 H LYS B 76 4.504 16.430 -20.175 1.00 0.00 H new ATOM 0 HA LYS B 76 3.565 14.109 -18.612 1.00 0.00 H new ATOM 0 HB2 LYS B 76 5.630 14.412 -20.847 1.00 0.00 H new ATOM 0 HB3 LYS B 76 5.502 12.962 -19.871 1.00 0.00 H new ATOM 0 HG2 LYS B 76 3.037 12.832 -20.546 1.00 0.00 H new ATOM 0 HG3 LYS B 76 3.334 14.152 -21.660 1.00 0.00 H new ATOM 0 HD2 LYS B 76 3.458 12.104 -22.926 1.00 0.00 H new ATOM 0 HD3 LYS B 76 5.088 12.735 -22.802 1.00 0.00 H new ATOM 0 HE2 LYS B 76 5.627 11.149 -20.999 1.00 0.00 H new ATOM 0 HE3 LYS B 76 3.965 10.599 -20.928 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 5.337 9.078 -22.193 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 4.167 9.781 -23.203 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 5.778 10.313 -23.271 1.00 0.00 H new ATOM 1176 N HIS B 77 5.473 14.003 -16.991 1.00 0.00 N ATOM 1177 CA HIS B 77 6.392 14.056 -15.844 1.00 0.00 C ATOM 1178 C HIS B 77 6.555 12.671 -15.172 1.00 0.00 C ATOM 1179 O HIS B 77 5.920 11.701 -15.610 1.00 0.00 O ATOM 1180 CB HIS B 77 5.928 15.156 -14.868 1.00 0.00 C ATOM 1181 CG HIS B 77 4.500 15.090 -14.381 1.00 0.00 C ATOM 1182 ND1 HIS B 77 3.867 16.069 -13.648 1.00 0.00 N ATOM 1183 CD2 HIS B 77 3.585 14.094 -14.591 1.00 0.00 C ATOM 1184 CE1 HIS B 77 2.609 15.664 -13.412 1.00 0.00 C ATOM 1185 NE2 HIS B 77 2.387 14.465 -13.980 1.00 0.00 N ATOM 0 H HIS B 77 4.812 13.229 -16.926 1.00 0.00 H new ATOM 0 HA HIS B 77 7.390 14.320 -16.193 1.00 0.00 H new ATOM 0 HB2 HIS B 77 6.583 15.133 -13.997 1.00 0.00 H new ATOM 0 HB3 HIS B 77 6.075 16.121 -15.352 1.00 0.00 H new ATOM 0 HD2 HIS B 77 3.760 13.178 -15.136 1.00 0.00 H new ATOM 0 HE1 HIS B 77 1.878 16.222 -12.846 1.00 0.00 H new ATOM 0 HE2 HIS B 77 1.517 13.933 -13.967 1.00 0.00 H new ATOM 1193 N GLU B 78 7.430 12.553 -14.161 1.00 0.00 N ATOM 1194 CA GLU B 78 7.859 11.266 -13.588 1.00 0.00 C ATOM 1195 C GLU B 78 8.027 11.319 -12.057 1.00 0.00 C ATOM 1196 O GLU B 78 8.364 12.355 -11.485 1.00 0.00 O ATOM 1197 CB GLU B 78 9.170 10.790 -14.253 1.00 0.00 C ATOM 1198 CG GLU B 78 8.993 10.585 -15.767 1.00 0.00 C ATOM 1199 CD GLU B 78 10.222 10.068 -16.506 1.00 0.00 C ATOM 1200 OE1 GLU B 78 11.141 9.447 -15.920 1.00 0.00 O ATOM 1201 OE2 GLU B 78 10.293 10.320 -17.731 1.00 0.00 O ATOM 0 H GLU B 78 7.865 13.359 -13.712 1.00 0.00 H new ATOM 0 HA GLU B 78 7.064 10.550 -13.796 1.00 0.00 H new ATOM 0 HB2 GLU B 78 9.957 11.523 -14.074 1.00 0.00 H new ATOM 0 HB3 GLU B 78 9.494 9.856 -13.794 1.00 0.00 H new ATOM 0 HG2 GLU B 78 8.173 9.886 -15.928 1.00 0.00 H new ATOM 0 HG3 GLU B 78 8.695 11.534 -16.212 1.00 0.00 H new ATOM 1208 N PHE B 79 7.795 10.178 -11.400 1.00 0.00 N ATOM 1209 CA PHE B 79 7.807 9.989 -9.943 1.00 0.00 C ATOM 1210 C PHE B 79 8.451 8.634 -9.603 1.00 0.00 C ATOM 1211 O PHE B 79 8.166 7.649 -10.283 1.00 0.00 O ATOM 1212 CB PHE B 79 6.362 9.991 -9.398 1.00 0.00 C ATOM 1213 CG PHE B 79 5.503 11.207 -9.709 1.00 0.00 C ATOM 1214 CD1 PHE B 79 4.930 11.358 -10.988 1.00 0.00 C ATOM 1215 CD2 PHE B 79 5.214 12.151 -8.704 1.00 0.00 C ATOM 1216 CE1 PHE B 79 4.115 12.464 -11.275 1.00 0.00 C ATOM 1217 CE2 PHE B 79 4.364 13.239 -8.980 1.00 0.00 C ATOM 1218 CZ PHE B 79 3.827 13.401 -10.269 1.00 0.00 C ATOM 0 H PHE B 79 7.582 9.313 -11.897 1.00 0.00 H new ATOM 0 HA PHE B 79 8.375 10.802 -9.491 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.853 9.109 -9.788 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.409 9.879 -8.315 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.119 10.618 -11.752 1.00 0.00 H new ATOM 0 HD2 PHE B 79 5.645 12.040 -7.720 1.00 0.00 H new ATOM 0 HE1 PHE B 79 3.710 12.594 -12.268 1.00 0.00 H new ATOM 0 HE2 PHE B 79 4.125 13.949 -8.202 1.00 0.00 H new ATOM 0 HZ PHE B 79 3.192 14.247 -10.486 1.00 0.00 H new ATOM 1228 N SER B 80 9.263 8.541 -8.551 1.00 0.00 N ATOM 1229 CA SER B 80 9.836 7.276 -8.058 1.00 0.00 C ATOM 1230 C SER B 80 9.179 6.819 -6.744 1.00 0.00 C ATOM 1231 O SER B 80 9.035 7.604 -5.800 1.00 0.00 O ATOM 1232 CB SER B 80 11.357 7.367 -7.896 1.00 0.00 C ATOM 1233 OG SER B 80 11.849 6.060 -7.666 1.00 0.00 O ATOM 0 H SER B 80 9.550 9.353 -8.004 1.00 0.00 H new ATOM 0 HA SER B 80 9.622 6.523 -8.816 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.811 7.794 -8.790 1.00 0.00 H new ATOM 0 HB3 SER B 80 11.614 8.023 -7.064 1.00 0.00 H new ATOM 0 HG SER B 80 11.222 5.404 -8.036 1.00 0.00 H new ATOM 1239 N VAL B 81 8.801 5.540 -6.676 1.00 0.00 N ATOM 1240 CA VAL B 81 8.072 4.909 -5.562 1.00 0.00 C ATOM 1241 C VAL B 81 8.906 3.751 -5.026 1.00 0.00 C ATOM 1242 O VAL B 81 9.490 3.002 -5.804 1.00 0.00 O ATOM 1243 CB VAL B 81 6.675 4.374 -5.985 1.00 0.00 C ATOM 1244 CG1 VAL B 81 5.643 5.509 -6.056 1.00 0.00 C ATOM 1245 CG2 VAL B 81 6.661 3.645 -7.343 1.00 0.00 C ATOM 0 H VAL B 81 9.002 4.882 -7.429 1.00 0.00 H new ATOM 0 HA VAL B 81 7.910 5.671 -4.799 1.00 0.00 H new ATOM 0 HB VAL B 81 6.418 3.652 -5.210 1.00 0.00 H new ATOM 0 HG11 VAL B 81 4.676 5.104 -6.354 1.00 0.00 H new ATOM 0 HG12 VAL B 81 5.553 5.980 -5.077 1.00 0.00 H new ATOM 0 HG13 VAL B 81 5.967 6.250 -6.787 1.00 0.00 H new ATOM 0 HG21 VAL B 81 5.649 3.304 -7.562 1.00 0.00 H new ATOM 0 HG22 VAL B 81 6.992 4.328 -8.126 1.00 0.00 H new ATOM 0 HG23 VAL B 81 7.332 2.787 -7.302 1.00 0.00 H new ATOM 1255 N ASP B 82 8.948 3.573 -3.703 1.00 0.00 N ATOM 1256 CA ASP B 82 9.725 2.510 -3.054 1.00 0.00 C ATOM 1257 C ASP B 82 9.051 1.122 -3.137 1.00 0.00 C ATOM 1258 O ASP B 82 8.865 0.424 -2.142 1.00 0.00 O ATOM 1259 CB ASP B 82 10.095 2.937 -1.627 1.00 0.00 C ATOM 1260 CG ASP B 82 11.051 1.963 -0.927 1.00 0.00 C ATOM 1261 OD1 ASP B 82 11.907 1.337 -1.604 1.00 0.00 O ATOM 1262 OD2 ASP B 82 10.947 1.844 0.316 1.00 0.00 O ATOM 0 H ASP B 82 8.441 4.166 -3.046 1.00 0.00 H new ATOM 0 HA ASP B 82 10.653 2.377 -3.610 1.00 0.00 H new ATOM 0 HB2 ASP B 82 10.554 3.925 -1.659 1.00 0.00 H new ATOM 0 HB3 ASP B 82 9.184 3.028 -1.035 1.00 0.00 H new ATOM 1267 N MET B 83 8.691 0.697 -4.351 1.00 0.00 N ATOM 1268 CA MET B 83 8.375 -0.696 -4.691 1.00 0.00 C ATOM 1269 C MET B 83 9.671 -1.520 -4.771 1.00 0.00 C ATOM 1270 O MET B 83 10.053 -1.999 -5.840 1.00 0.00 O ATOM 1271 CB MET B 83 7.500 -0.762 -5.961 1.00 0.00 C ATOM 1272 CG MET B 83 8.097 -0.093 -7.210 1.00 0.00 C ATOM 1273 SD MET B 83 7.035 -0.143 -8.675 1.00 0.00 S ATOM 1274 CE MET B 83 7.263 -1.876 -9.149 1.00 0.00 C ATOM 0 H MET B 83 8.609 1.329 -5.148 1.00 0.00 H new ATOM 0 HA MET B 83 7.773 -1.149 -3.903 1.00 0.00 H new ATOM 0 HB2 MET B 83 7.301 -1.809 -6.191 1.00 0.00 H new ATOM 0 HB3 MET B 83 6.539 -0.295 -5.744 1.00 0.00 H new ATOM 0 HG2 MET B 83 8.321 0.948 -6.976 1.00 0.00 H new ATOM 0 HG3 MET B 83 9.044 -0.578 -7.448 1.00 0.00 H new ATOM 0 HE1 MET B 83 6.778 -2.058 -10.108 1.00 0.00 H new ATOM 0 HE2 MET B 83 8.328 -2.093 -9.234 1.00 0.00 H new ATOM 0 HE3 MET B 83 6.820 -2.522 -8.391 1.00 0.00 H new ATOM 1284 N THR B 84 10.384 -1.624 -3.639 1.00 0.00 N ATOM 1285 CA THR B 84 11.717 -2.248 -3.507 1.00 0.00 C ATOM 1286 C THR B 84 11.732 -3.659 -4.098 1.00 0.00 C ATOM 1287 O THR B 84 12.726 -4.055 -4.705 1.00 0.00 O ATOM 1288 CB THR B 84 12.171 -2.293 -2.035 1.00 0.00 C ATOM 1289 OG1 THR B 84 11.514 -1.332 -1.230 1.00 0.00 O ATOM 1290 CG2 THR B 84 13.673 -2.073 -1.888 1.00 0.00 C ATOM 0 H THR B 84 10.036 -1.262 -2.751 1.00 0.00 H new ATOM 0 HA THR B 84 12.417 -1.629 -4.068 1.00 0.00 H new ATOM 0 HB THR B 84 11.906 -3.294 -1.694 1.00 0.00 H new ATOM 0 HG1 THR B 84 11.852 -0.438 -1.446 1.00 0.00 H new ATOM 0 HG21 THR B 84 13.945 -2.113 -0.833 1.00 0.00 H new ATOM 0 HG22 THR B 84 14.210 -2.851 -2.431 1.00 0.00 H new ATOM 0 HG23 THR B 84 13.939 -1.097 -2.294 1.00 0.00 H new ATOM 1298 N CYS B 85 10.611 -4.371 -3.964 1.00 0.00 N ATOM 1299 CA CYS B 85 10.259 -5.604 -4.639 1.00 0.00 C ATOM 1300 C CYS B 85 9.608 -5.355 -6.038 1.00 0.00 C ATOM 1301 O CYS B 85 10.255 -4.828 -6.948 1.00 0.00 O ATOM 1302 CB CYS B 85 9.390 -6.356 -3.610 1.00 0.00 C ATOM 1303 SG CYS B 85 7.837 -5.475 -3.235 1.00 0.00 S ATOM 0 H CYS B 85 9.873 -4.069 -3.328 1.00 0.00 H new ATOM 0 HA CYS B 85 11.119 -6.214 -4.916 1.00 0.00 H new ATOM 0 HB2 CYS B 85 9.157 -7.350 -3.992 1.00 0.00 H new ATOM 0 HB3 CYS B 85 9.958 -6.493 -2.690 1.00 0.00 H new ATOM 1308 N GLY B 86 8.331 -5.738 -6.195 1.00 0.00 N ATOM 1309 CA GLY B 86 7.535 -5.586 -7.421 1.00 0.00 C ATOM 1310 C GLY B 86 6.007 -5.621 -7.270 1.00 0.00 C ATOM 1311 O GLY B 86 5.314 -5.080 -8.134 1.00 0.00 O ATOM 0 H GLY B 86 7.805 -6.179 -5.441 1.00 0.00 H new ATOM 0 HA2 GLY B 86 7.808 -4.639 -7.886 1.00 0.00 H new ATOM 0 HA3 GLY B 86 7.825 -6.376 -8.113 1.00 0.00 H new ATOM 1315 N GLY B 87 5.444 -6.208 -6.204 1.00 0.00 N ATOM 1316 CA GLY B 87 3.989 -6.426 -6.050 1.00 0.00 C ATOM 1317 C GLY B 87 3.159 -5.168 -5.778 1.00 0.00 C ATOM 1318 O GLY B 87 1.930 -5.207 -5.854 1.00 0.00 O ATOM 0 H GLY B 87 5.988 -6.551 -5.412 1.00 0.00 H new ATOM 0 HA2 GLY B 87 3.612 -6.900 -6.957 1.00 0.00 H new ATOM 0 HA3 GLY B 87 3.829 -7.129 -5.233 1.00 0.00 H new ATOM 1322 N CYS B 88 3.813 -4.038 -5.499 1.00 0.00 N ATOM 1323 CA CYS B 88 3.169 -2.731 -5.347 1.00 0.00 C ATOM 1324 C CYS B 88 2.648 -2.111 -6.658 1.00 0.00 C ATOM 1325 O CYS B 88 1.865 -1.165 -6.576 1.00 0.00 O ATOM 1326 CB CYS B 88 4.124 -1.772 -4.611 1.00 0.00 C ATOM 1327 SG CYS B 88 3.576 -1.603 -2.890 1.00 0.00 S ATOM 0 H CYS B 88 4.824 -4.005 -5.370 1.00 0.00 H new ATOM 0 HA CYS B 88 2.270 -2.896 -4.753 1.00 0.00 H new ATOM 0 HB2 CYS B 88 5.144 -2.155 -4.646 1.00 0.00 H new ATOM 0 HB3 CYS B 88 4.132 -0.799 -5.101 1.00 0.00 H new ATOM 0 HG CYS B 88 3.718 -2.740 -2.276 1.00 0.00 H new ATOM 1333 N ALA B 89 3.039 -2.592 -7.844 1.00 0.00 N ATOM 1334 CA ALA B 89 2.678 -1.958 -9.122 1.00 0.00 C ATOM 1335 C ALA B 89 1.152 -1.825 -9.311 1.00 0.00 C ATOM 1336 O ALA B 89 0.646 -0.724 -9.549 1.00 0.00 O ATOM 1337 CB ALA B 89 3.345 -2.739 -10.263 1.00 0.00 C ATOM 0 H ALA B 89 3.613 -3.429 -7.947 1.00 0.00 H new ATOM 0 HA ALA B 89 3.049 -0.933 -9.125 1.00 0.00 H new ATOM 0 HB1 ALA B 89 3.086 -2.281 -11.217 1.00 0.00 H new ATOM 0 HB2 ALA B 89 4.427 -2.720 -10.133 1.00 0.00 H new ATOM 0 HB3 ALA B 89 2.996 -3.771 -10.250 1.00 0.00 H new ATOM 1343 N GLU B 90 0.398 -2.908 -9.121 1.00 0.00 N ATOM 1344 CA GLU B 90 -1.067 -2.873 -9.147 1.00 0.00 C ATOM 1345 C GLU B 90 -1.636 -2.033 -7.995 1.00 0.00 C ATOM 1346 O GLU B 90 -2.594 -1.294 -8.197 1.00 0.00 O ATOM 1347 CB GLU B 90 -1.619 -4.301 -9.094 1.00 0.00 C ATOM 1348 CG GLU B 90 -3.133 -4.333 -9.359 1.00 0.00 C ATOM 1349 CD GLU B 90 -3.693 -5.743 -9.539 1.00 0.00 C ATOM 1350 OE1 GLU B 90 -2.935 -6.735 -9.441 1.00 0.00 O ATOM 1351 OE2 GLU B 90 -4.918 -5.865 -9.790 1.00 0.00 O ATOM 0 H GLU B 90 0.785 -3.835 -8.945 1.00 0.00 H new ATOM 0 HA GLU B 90 -1.378 -2.399 -10.078 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -1.107 -4.917 -9.833 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -1.411 -4.736 -8.116 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -3.649 -3.849 -8.529 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -3.349 -3.748 -10.253 1.00 0.00 H new ATOM 1358 N ALA B 91 -1.033 -2.080 -6.802 1.00 0.00 N ATOM 1359 CA ALA B 91 -1.487 -1.283 -5.662 1.00 0.00 C ATOM 1360 C ALA B 91 -1.369 0.226 -5.933 1.00 0.00 C ATOM 1361 O ALA B 91 -2.351 0.953 -5.776 1.00 0.00 O ATOM 1362 CB ALA B 91 -0.730 -1.730 -4.404 1.00 0.00 C ATOM 0 H ALA B 91 -0.223 -2.667 -6.602 1.00 0.00 H new ATOM 0 HA ALA B 91 -2.550 -1.459 -5.498 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -1.063 -1.140 -3.550 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -0.928 -2.785 -4.216 1.00 0.00 H new ATOM 0 HB3 ALA B 91 0.340 -1.583 -4.551 1.00 0.00 H new ATOM 1368 N VAL B 92 -0.205 0.674 -6.415 1.00 0.00 N ATOM 1369 CA VAL B 92 0.037 2.049 -6.890 1.00 0.00 C ATOM 1370 C VAL B 92 -0.970 2.424 -7.980 1.00 0.00 C ATOM 1371 O VAL B 92 -1.511 3.524 -7.957 1.00 0.00 O ATOM 1372 CB VAL B 92 1.483 2.208 -7.425 1.00 0.00 C ATOM 1373 CG1 VAL B 92 1.726 3.530 -8.174 1.00 0.00 C ATOM 1374 CG2 VAL B 92 2.494 2.138 -6.271 1.00 0.00 C ATOM 0 H VAL B 92 0.619 0.078 -6.489 1.00 0.00 H new ATOM 0 HA VAL B 92 -0.091 2.723 -6.043 1.00 0.00 H new ATOM 0 HB VAL B 92 1.618 1.387 -8.129 1.00 0.00 H new ATOM 0 HG11 VAL B 92 2.760 3.569 -8.518 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.056 3.591 -9.031 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.535 4.368 -7.504 1.00 0.00 H new ATOM 0 HG21 VAL B 92 3.504 2.251 -6.665 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.290 2.938 -5.559 1.00 0.00 H new ATOM 0 HG23 VAL B 92 2.407 1.175 -5.769 1.00 0.00 H new ATOM 1384 N SER B 93 -1.274 1.502 -8.896 1.00 0.00 N ATOM 1385 CA SER B 93 -2.248 1.734 -9.969 1.00 0.00 C ATOM 1386 C SER B 93 -3.669 1.952 -9.419 1.00 0.00 C ATOM 1387 O SER B 93 -4.295 2.975 -9.702 1.00 0.00 O ATOM 1388 CB SER B 93 -2.204 0.579 -10.982 1.00 0.00 C ATOM 1389 OG SER B 93 -0.889 0.355 -11.475 1.00 0.00 O ATOM 0 H SER B 93 -0.853 0.573 -8.916 1.00 0.00 H new ATOM 0 HA SER B 93 -1.971 2.654 -10.483 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.575 -0.331 -10.511 1.00 0.00 H new ATOM 0 HB3 SER B 93 -2.871 0.801 -11.815 1.00 0.00 H new ATOM 0 HG SER B 93 -0.308 0.069 -10.739 1.00 0.00 H new ATOM 1395 N ARG B 94 -4.153 1.068 -8.535 1.00 0.00 N ATOM 1396 CA ARG B 94 -5.446 1.235 -7.856 1.00 0.00 C ATOM 1397 C ARG B 94 -5.500 2.513 -7.004 1.00 0.00 C ATOM 1398 O ARG B 94 -6.537 3.177 -6.996 1.00 0.00 O ATOM 1399 CB ARG B 94 -5.758 0.019 -6.975 1.00 0.00 C ATOM 1400 CG ARG B 94 -6.035 -1.275 -7.756 1.00 0.00 C ATOM 1401 CD ARG B 94 -6.520 -2.350 -6.778 1.00 0.00 C ATOM 1402 NE ARG B 94 -6.413 -3.708 -7.325 1.00 0.00 N ATOM 1403 CZ ARG B 94 -6.630 -4.824 -6.644 1.00 0.00 C ATOM 1404 NH1 ARG B 94 -7.097 -4.807 -5.414 1.00 0.00 N ATOM 1405 NH2 ARG B 94 -6.381 -5.996 -7.181 1.00 0.00 N ATOM 0 H ARG B 94 -3.658 0.216 -8.270 1.00 0.00 H new ATOM 0 HA ARG B 94 -6.199 1.323 -8.639 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -4.919 -0.151 -6.300 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -6.625 0.248 -6.355 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -6.787 -1.098 -8.525 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -5.131 -1.609 -8.265 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -5.938 -2.287 -5.858 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -7.558 -2.151 -6.513 1.00 0.00 H new ATOM 0 HE ARG B 94 -6.151 -3.800 -8.306 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -7.302 -3.918 -4.959 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -7.254 -5.683 -4.916 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -6.017 -6.054 -8.132 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -6.552 -6.848 -6.647 1.00 0.00 H new ATOM 1419 N VAL B 95 -4.412 2.862 -6.311 1.00 0.00 N ATOM 1420 CA VAL B 95 -4.292 4.093 -5.500 1.00 0.00 C ATOM 1421 C VAL B 95 -4.402 5.352 -6.377 1.00 0.00 C ATOM 1422 O VAL B 95 -5.130 6.279 -6.027 1.00 0.00 O ATOM 1423 CB VAL B 95 -2.970 4.079 -4.690 1.00 0.00 C ATOM 1424 CG1 VAL B 95 -2.528 5.455 -4.159 1.00 0.00 C ATOM 1425 CG2 VAL B 95 -3.085 3.114 -3.497 1.00 0.00 C ATOM 0 H VAL B 95 -3.568 2.289 -6.293 1.00 0.00 H new ATOM 0 HA VAL B 95 -5.122 4.120 -4.794 1.00 0.00 H new ATOM 0 HB VAL B 95 -2.210 3.752 -5.400 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -1.595 5.349 -3.605 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -2.378 6.137 -4.996 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -3.298 5.855 -3.499 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -2.150 3.114 -2.937 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -3.898 3.436 -2.846 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -3.289 2.107 -3.862 1.00 0.00 H new ATOM 1435 N LEU B 96 -3.728 5.380 -7.534 1.00 0.00 N ATOM 1436 CA LEU B 96 -3.779 6.488 -8.494 1.00 0.00 C ATOM 1437 C LEU B 96 -5.187 6.618 -9.096 1.00 0.00 C ATOM 1438 O LEU B 96 -5.763 7.706 -9.125 1.00 0.00 O ATOM 1439 CB LEU B 96 -2.679 6.222 -9.551 1.00 0.00 C ATOM 1440 CG LEU B 96 -2.183 7.408 -10.401 1.00 0.00 C ATOM 1441 CD1 LEU B 96 -3.253 7.983 -11.333 1.00 0.00 C ATOM 1442 CD2 LEU B 96 -1.577 8.524 -9.536 1.00 0.00 C ATOM 0 H LEU B 96 -3.120 4.618 -7.834 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.584 7.448 -8.016 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -1.817 5.799 -9.035 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -3.050 5.456 -10.232 1.00 0.00 H new ATOM 0 HG LEU B 96 -1.399 6.992 -11.034 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -2.833 8.814 -11.900 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -3.591 7.208 -12.021 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -4.098 8.337 -10.742 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -1.241 9.339 -10.177 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -2.330 8.896 -8.841 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -0.729 8.130 -8.975 1.00 0.00 H new ATOM 1454 N ASN B 97 -5.793 5.493 -9.482 1.00 0.00 N ATOM 1455 CA ASN B 97 -7.143 5.424 -10.049 1.00 0.00 C ATOM 1456 C ASN B 97 -8.272 5.888 -9.101 1.00 0.00 C ATOM 1457 O ASN B 97 -9.404 6.060 -9.555 1.00 0.00 O ATOM 1458 CB ASN B 97 -7.399 4.001 -10.573 1.00 0.00 C ATOM 1459 CG ASN B 97 -6.638 3.668 -11.855 1.00 0.00 C ATOM 1460 OD1 ASN B 97 -5.922 4.479 -12.437 1.00 0.00 O ATOM 1461 ND2 ASN B 97 -6.812 2.461 -12.352 1.00 0.00 N ATOM 0 H ASN B 97 -5.346 4.579 -9.407 1.00 0.00 H new ATOM 0 HA ASN B 97 -7.173 6.142 -10.868 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -7.121 3.284 -9.800 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -8.467 3.877 -10.753 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -6.352 2.197 -13.223 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -7.407 1.790 -11.866 1.00 0.00 H new ATOM 1468 N LYS B 98 -8.000 6.184 -7.820 1.00 0.00 N ATOM 1469 CA LYS B 98 -8.931 6.949 -6.970 1.00 0.00 C ATOM 1470 C LYS B 98 -9.209 8.351 -7.560 1.00 0.00 C ATOM 1471 O LYS B 98 -10.373 8.756 -7.626 1.00 0.00 O ATOM 1472 CB LYS B 98 -8.388 7.043 -5.528 1.00 0.00 C ATOM 1473 CG LYS B 98 -8.191 5.693 -4.807 1.00 0.00 C ATOM 1474 CD LYS B 98 -9.480 4.917 -4.482 1.00 0.00 C ATOM 1475 CE LYS B 98 -10.296 5.592 -3.370 1.00 0.00 C ATOM 1476 NZ LYS B 98 -11.526 4.829 -3.047 1.00 0.00 N ATOM 0 H LYS B 98 -7.140 5.905 -7.347 1.00 0.00 H new ATOM 0 HA LYS B 98 -9.882 6.418 -6.942 1.00 0.00 H new ATOM 0 HB2 LYS B 98 -7.432 7.567 -5.551 1.00 0.00 H new ATOM 0 HB3 LYS B 98 -9.072 7.654 -4.939 1.00 0.00 H new ATOM 0 HG2 LYS B 98 -7.554 5.061 -5.426 1.00 0.00 H new ATOM 0 HG3 LYS B 98 -7.653 5.874 -3.876 1.00 0.00 H new ATOM 0 HD2 LYS B 98 -10.091 4.837 -5.381 1.00 0.00 H new ATOM 0 HD3 LYS B 98 -9.225 3.902 -4.178 1.00 0.00 H new ATOM 0 HE2 LYS B 98 -9.681 5.686 -2.475 1.00 0.00 H new ATOM 0 HE3 LYS B 98 -10.566 6.602 -3.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 -12.049 5.317 -2.292 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 -12.125 4.761 -3.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 -11.268 3.874 -2.727 1.00 0.00 H new ATOM 1490 N LEU B 99 -8.182 9.044 -8.082 1.00 0.00 N ATOM 1491 CA LEU B 99 -8.318 10.319 -8.814 1.00 0.00 C ATOM 1492 C LEU B 99 -8.994 10.122 -10.182 1.00 0.00 C ATOM 1493 O LEU B 99 -9.822 10.946 -10.575 1.00 0.00 O ATOM 1494 CB LEU B 99 -6.931 10.970 -9.004 1.00 0.00 C ATOM 1495 CG LEU B 99 -6.207 11.397 -7.709 1.00 0.00 C ATOM 1496 CD1 LEU B 99 -4.795 11.887 -8.057 1.00 0.00 C ATOM 1497 CD2 LEU B 99 -6.963 12.507 -6.962 1.00 0.00 C ATOM 0 H LEU B 99 -7.215 8.729 -8.006 1.00 0.00 H new ATOM 0 HA LEU B 99 -8.953 10.976 -8.219 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -6.292 10.269 -9.541 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -7.046 11.848 -9.640 1.00 0.00 H new ATOM 0 HG LEU B 99 -6.161 10.529 -7.051 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -4.280 12.190 -7.145 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.239 11.082 -8.538 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -4.862 12.738 -8.735 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.416 12.775 -6.058 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -7.052 13.383 -7.605 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -7.958 12.152 -6.693 1.00 0.00 H new ATOM 1509 N GLY B 100 -8.677 9.018 -10.866 1.00 0.00 N ATOM 1510 CA GLY B 100 -9.417 8.494 -12.022 1.00 0.00 C ATOM 1511 C GLY B 100 -9.109 9.183 -13.356 1.00 0.00 C ATOM 1512 O GLY B 100 -8.907 10.398 -13.422 1.00 0.00 O ATOM 0 H GLY B 100 -7.870 8.443 -10.623 1.00 0.00 H new ATOM 0 HA2 GLY B 100 -9.200 7.430 -12.121 1.00 0.00 H new ATOM 0 HA3 GLY B 100 -10.485 8.584 -11.822 1.00 0.00 H new ATOM 1516 N GLY B 101 -9.106 8.387 -14.432 1.00 0.00 N ATOM 1517 CA GLY B 101 -8.964 8.857 -15.815 1.00 0.00 C ATOM 1518 C GLY B 101 -7.592 9.455 -16.118 1.00 0.00 C ATOM 1519 O GLY B 101 -7.530 10.533 -16.705 1.00 0.00 O ATOM 0 H GLY B 101 -9.205 7.374 -14.363 1.00 0.00 H new ATOM 0 HA2 GLY B 101 -9.146 8.024 -16.494 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -9.730 9.606 -16.016 1.00 0.00 H new ATOM 1523 N VAL B 102 -6.512 8.794 -15.694 1.00 0.00 N ATOM 1524 CA VAL B 102 -5.126 9.282 -15.829 1.00 0.00 C ATOM 1525 C VAL B 102 -4.307 8.327 -16.711 1.00 0.00 C ATOM 1526 O VAL B 102 -4.542 7.122 -16.697 1.00 0.00 O ATOM 1527 CB VAL B 102 -4.447 9.437 -14.448 1.00 0.00 C ATOM 1528 CG1 VAL B 102 -3.092 10.149 -14.583 1.00 0.00 C ATOM 1529 CG2 VAL B 102 -5.316 10.217 -13.441 1.00 0.00 C ATOM 0 H VAL B 102 -6.572 7.884 -15.237 1.00 0.00 H new ATOM 0 HA VAL B 102 -5.164 10.263 -16.302 1.00 0.00 H new ATOM 0 HB VAL B 102 -4.306 8.426 -14.067 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -2.633 10.247 -13.599 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -2.438 9.567 -15.232 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -3.243 11.139 -15.013 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -4.789 10.295 -12.490 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -5.514 11.216 -13.829 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -6.259 9.692 -13.291 1.00 0.00 H new ATOM 1539 N LYS B 103 -3.335 8.856 -17.464 1.00 0.00 N ATOM 1540 CA LYS B 103 -2.444 8.074 -18.335 1.00 0.00 C ATOM 1541 C LYS B 103 -1.096 7.786 -17.654 1.00 0.00 C ATOM 1542 O LYS B 103 -0.388 8.728 -17.288 1.00 0.00 O ATOM 1543 CB LYS B 103 -2.208 8.867 -19.632 1.00 0.00 C ATOM 1544 CG LYS B 103 -1.913 7.954 -20.830 1.00 0.00 C ATOM 1545 CD LYS B 103 -1.637 8.769 -22.101 1.00 0.00 C ATOM 1546 CE LYS B 103 -2.914 9.412 -22.656 1.00 0.00 C ATOM 1547 NZ LYS B 103 -2.617 10.353 -23.756 1.00 0.00 N ATOM 0 H LYS B 103 -3.141 9.857 -17.487 1.00 0.00 H new ATOM 0 HA LYS B 103 -2.917 7.116 -18.549 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -3.087 9.474 -19.849 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -1.374 9.554 -19.488 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -1.052 7.324 -20.606 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -2.760 7.289 -20.999 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -0.905 9.546 -21.882 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -1.197 8.121 -22.859 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -3.587 8.634 -23.015 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -3.434 9.939 -21.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -3.456 10.455 -24.362 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -2.362 11.280 -23.360 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -1.824 9.987 -24.321 1.00 0.00 H new ATOM 1561 N TYR B 104 -0.702 6.517 -17.511 1.00 0.00 N ATOM 1562 CA TYR B 104 0.585 6.149 -16.901 1.00 0.00 C ATOM 1563 C TYR B 104 1.128 4.755 -17.270 1.00 0.00 C ATOM 1564 O TYR B 104 0.389 3.861 -17.680 1.00 0.00 O ATOM 1565 CB TYR B 104 0.534 6.360 -15.374 1.00 0.00 C ATOM 1566 CG TYR B 104 -0.493 5.529 -14.626 1.00 0.00 C ATOM 1567 CD1 TYR B 104 -1.844 5.928 -14.616 1.00 0.00 C ATOM 1568 CD2 TYR B 104 -0.099 4.382 -13.909 1.00 0.00 C ATOM 1569 CE1 TYR B 104 -2.805 5.171 -13.924 1.00 0.00 C ATOM 1570 CE2 TYR B 104 -1.051 3.633 -13.191 1.00 0.00 C ATOM 1571 CZ TYR B 104 -2.411 4.020 -13.210 1.00 0.00 C ATOM 1572 OH TYR B 104 -3.342 3.285 -12.553 1.00 0.00 O ATOM 0 H TYR B 104 -1.260 5.718 -17.812 1.00 0.00 H new ATOM 0 HA TYR B 104 1.314 6.829 -17.342 1.00 0.00 H new ATOM 0 HB2 TYR B 104 1.520 6.141 -14.963 1.00 0.00 H new ATOM 0 HB3 TYR B 104 0.333 7.413 -15.178 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -2.143 6.822 -15.144 1.00 0.00 H new ATOM 0 HD2 TYR B 104 0.937 4.076 -13.910 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -3.843 5.470 -13.939 1.00 0.00 H new ATOM 0 HE2 TYR B 104 -0.743 2.765 -12.627 1.00 0.00 H new ATOM 0 HH TYR B 104 -4.194 3.770 -12.543 1.00 0.00 H new ATOM 1582 N ASP B 105 2.436 4.567 -17.074 1.00 0.00 N ATOM 1583 CA ASP B 105 3.149 3.283 -17.132 1.00 0.00 C ATOM 1584 C ASP B 105 4.136 3.185 -15.954 1.00 0.00 C ATOM 1585 O ASP B 105 4.853 4.150 -15.669 1.00 0.00 O ATOM 1586 CB ASP B 105 3.932 3.164 -18.453 1.00 0.00 C ATOM 1587 CG ASP B 105 3.060 2.883 -19.677 1.00 0.00 C ATOM 1588 OD1 ASP B 105 2.514 1.753 -19.773 1.00 0.00 O ATOM 1589 OD2 ASP B 105 2.973 3.754 -20.572 1.00 0.00 O ATOM 0 H ASP B 105 3.060 5.345 -16.859 1.00 0.00 H new ATOM 0 HA ASP B 105 2.418 2.477 -17.073 1.00 0.00 H new ATOM 0 HB2 ASP B 105 4.484 4.089 -18.619 1.00 0.00 H new ATOM 0 HB3 ASP B 105 4.668 2.366 -18.355 1.00 0.00 H new ATOM 1594 N ILE B 106 4.196 2.024 -15.286 1.00 0.00 N ATOM 1595 CA ILE B 106 5.074 1.764 -14.128 1.00 0.00 C ATOM 1596 C ILE B 106 6.227 0.846 -14.543 1.00 0.00 C ATOM 1597 O ILE B 106 6.007 -0.171 -15.206 1.00 0.00 O ATOM 1598 CB ILE B 106 4.276 1.139 -12.954 1.00 0.00 C ATOM 1599 CG1 ILE B 106 3.032 1.998 -12.619 1.00 0.00 C ATOM 1600 CG2 ILE B 106 5.186 0.964 -11.718 1.00 0.00 C ATOM 1601 CD1 ILE B 106 2.219 1.523 -11.411 1.00 0.00 C ATOM 0 H ILE B 106 3.623 1.219 -15.539 1.00 0.00 H new ATOM 0 HA ILE B 106 5.483 2.714 -13.785 1.00 0.00 H new ATOM 0 HB ILE B 106 3.925 0.152 -13.257 1.00 0.00 H new ATOM 0 HG12 ILE B 106 3.356 3.023 -12.439 1.00 0.00 H new ATOM 0 HG13 ILE B 106 2.379 2.019 -13.491 1.00 0.00 H new ATOM 0 HG21 ILE B 106 4.612 0.524 -10.903 1.00 0.00 H new ATOM 0 HG22 ILE B 106 6.019 0.308 -11.970 1.00 0.00 H new ATOM 0 HG23 ILE B 106 5.570 1.936 -11.408 1.00 0.00 H new ATOM 0 HD11 ILE B 106 1.370 2.190 -11.259 1.00 0.00 H new ATOM 0 HD12 ILE B 106 1.858 0.510 -11.591 1.00 0.00 H new ATOM 0 HD13 ILE B 106 2.850 1.531 -10.522 1.00 0.00 H new ATOM 1613 N ASP B 107 7.453 1.170 -14.132 1.00 0.00 N ATOM 1614 CA ASP B 107 8.645 0.368 -14.412 1.00 0.00 C ATOM 1615 C ASP B 107 9.148 -0.403 -13.180 1.00 0.00 C ATOM 1616 O ASP B 107 9.368 0.179 -12.120 1.00 0.00 O ATOM 1617 CB ASP B 107 9.746 1.267 -14.976 1.00 0.00 C ATOM 1618 CG ASP B 107 10.890 0.440 -15.559 1.00 0.00 C ATOM 1619 OD1 ASP B 107 10.625 -0.426 -16.427 1.00 0.00 O ATOM 1620 OD2 ASP B 107 12.053 0.692 -15.182 1.00 0.00 O ATOM 0 H ASP B 107 7.649 2.010 -13.587 1.00 0.00 H new ATOM 0 HA ASP B 107 8.369 -0.384 -15.151 1.00 0.00 H new ATOM 0 HB2 ASP B 107 9.331 1.914 -15.749 1.00 0.00 H new ATOM 0 HB3 ASP B 107 10.128 1.916 -14.188 1.00 0.00 H new ATOM 1625 N LEU B 108 9.369 -1.712 -13.341 1.00 0.00 N ATOM 1626 CA LEU B 108 9.794 -2.626 -12.274 1.00 0.00 C ATOM 1627 C LEU B 108 11.230 -2.369 -11.751 1.00 0.00 C ATOM 1628 O LEU B 108 11.363 -2.205 -10.534 1.00 0.00 O ATOM 1629 CB LEU B 108 9.545 -4.071 -12.763 1.00 0.00 C ATOM 1630 CG LEU B 108 10.085 -5.190 -11.845 1.00 0.00 C ATOM 1631 CD1 LEU B 108 9.375 -5.206 -10.484 1.00 0.00 C ATOM 1632 CD2 LEU B 108 9.914 -6.542 -12.550 1.00 0.00 C ATOM 0 H LEU B 108 9.254 -2.178 -14.241 1.00 0.00 H new ATOM 0 HA LEU B 108 9.193 -2.441 -11.383 1.00 0.00 H new ATOM 0 HB2 LEU B 108 8.471 -4.214 -12.886 1.00 0.00 H new ATOM 0 HB3 LEU B 108 9.997 -4.185 -13.748 1.00 0.00 H new ATOM 0 HG LEU B 108 11.141 -4.999 -11.654 1.00 0.00 H new ATOM 0 HD11 LEU B 108 9.785 -6.008 -9.869 1.00 0.00 H new ATOM 0 HD12 LEU B 108 9.528 -4.250 -9.983 1.00 0.00 H new ATOM 0 HD13 LEU B 108 8.308 -5.372 -10.632 1.00 0.00 H new ATOM 0 HD21 LEU B 108 10.293 -7.337 -11.908 1.00 0.00 H new ATOM 0 HD22 LEU B 108 8.858 -6.714 -12.756 1.00 0.00 H new ATOM 0 HD23 LEU B 108 10.470 -6.536 -13.488 1.00 0.00 H new ATOM 1644 N PRO B 109 12.293 -2.339 -12.590 1.00 0.00 N ATOM 1645 CA PRO B 109 13.668 -2.207 -12.106 1.00 0.00 C ATOM 1646 C PRO B 109 14.041 -0.773 -11.703 1.00 0.00 C ATOM 1647 O PRO B 109 14.744 -0.605 -10.708 1.00 0.00 O ATOM 1648 CB PRO B 109 14.557 -2.728 -13.239 1.00 0.00 C ATOM 1649 CG PRO B 109 13.736 -2.455 -14.496 1.00 0.00 C ATOM 1650 CD PRO B 109 12.306 -2.678 -14.011 1.00 0.00 C ATOM 0 HA PRO B 109 13.800 -2.779 -11.188 1.00 0.00 H new ATOM 0 HB2 PRO B 109 15.516 -2.210 -13.266 1.00 0.00 H new ATOM 0 HB3 PRO B 109 14.772 -3.790 -13.124 1.00 0.00 H new ATOM 0 HG2 PRO B 109 13.886 -1.441 -14.866 1.00 0.00 H new ATOM 0 HG3 PRO B 109 14.000 -3.133 -15.308 1.00 0.00 H new ATOM 0 HD2 PRO B 109 11.606 -2.053 -14.566 1.00 0.00 H new ATOM 0 HD3 PRO B 109 12.001 -3.713 -14.166 1.00 0.00 H new ATOM 1658 N ASN B 110 13.578 0.262 -12.420 1.00 0.00 N ATOM 1659 CA ASN B 110 13.871 1.669 -12.080 1.00 0.00 C ATOM 1660 C ASN B 110 12.779 2.322 -11.201 1.00 0.00 C ATOM 1661 O ASN B 110 12.888 3.496 -10.842 1.00 0.00 O ATOM 1662 CB ASN B 110 14.159 2.479 -13.355 1.00 0.00 C ATOM 1663 CG ASN B 110 15.256 1.837 -14.202 1.00 0.00 C ATOM 1664 OD1 ASN B 110 16.448 2.000 -13.957 1.00 0.00 O ATOM 1665 ND2 ASN B 110 14.890 1.053 -15.197 1.00 0.00 N ATOM 0 H ASN B 110 12.993 0.152 -13.248 1.00 0.00 H new ATOM 0 HA ASN B 110 14.770 1.674 -11.464 1.00 0.00 H new ATOM 0 HB2 ASN B 110 13.247 2.563 -13.946 1.00 0.00 H new ATOM 0 HB3 ASN B 110 14.457 3.492 -13.082 1.00 0.00 H new ATOM 0 HD21 ASN B 110 15.597 0.583 -15.762 1.00 0.00 H new ATOM 0 HD22 ASN B 110 13.900 0.917 -15.401 1.00 0.00 H new ATOM 1672 N LYS B 111 11.722 1.567 -10.862 1.00 0.00 N ATOM 1673 CA LYS B 111 10.782 1.817 -9.749 1.00 0.00 C ATOM 1674 C LYS B 111 10.032 3.162 -9.840 1.00 0.00 C ATOM 1675 O LYS B 111 9.659 3.783 -8.838 1.00 0.00 O ATOM 1676 CB LYS B 111 11.496 1.543 -8.407 1.00 0.00 C ATOM 1677 CG LYS B 111 11.947 0.073 -8.371 1.00 0.00 C ATOM 1678 CD LYS B 111 12.596 -0.370 -7.058 1.00 0.00 C ATOM 1679 CE LYS B 111 13.166 -1.797 -7.190 1.00 0.00 C ATOM 1680 NZ LYS B 111 12.187 -2.791 -7.706 1.00 0.00 N ATOM 0 H LYS B 111 11.485 0.722 -11.381 1.00 0.00 H new ATOM 0 HA LYS B 111 9.957 1.109 -9.826 1.00 0.00 H new ATOM 0 HB2 LYS B 111 12.356 2.203 -8.296 1.00 0.00 H new ATOM 0 HB3 LYS B 111 10.825 1.751 -7.574 1.00 0.00 H new ATOM 0 HG2 LYS B 111 11.082 -0.562 -8.564 1.00 0.00 H new ATOM 0 HG3 LYS B 111 12.654 -0.095 -9.184 1.00 0.00 H new ATOM 0 HD2 LYS B 111 13.393 0.323 -6.788 1.00 0.00 H new ATOM 0 HD3 LYS B 111 11.861 -0.339 -6.254 1.00 0.00 H new ATOM 0 HE2 LYS B 111 14.029 -1.773 -7.855 1.00 0.00 H new ATOM 0 HE3 LYS B 111 13.524 -2.127 -6.215 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 12.594 -3.746 -7.640 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 11.316 -2.747 -7.140 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 11.965 -2.577 -8.699 1.00 0.00 H new ATOM 1694 N LYS B 112 9.797 3.618 -11.075 1.00 0.00 N ATOM 1695 CA LYS B 112 9.143 4.890 -11.377 1.00 0.00 C ATOM 1696 C LYS B 112 7.776 4.736 -12.057 1.00 0.00 C ATOM 1697 O LYS B 112 7.510 3.745 -12.736 1.00 0.00 O ATOM 1698 CB LYS B 112 10.101 5.797 -12.172 1.00 0.00 C ATOM 1699 CG LYS B 112 10.392 5.329 -13.606 1.00 0.00 C ATOM 1700 CD LYS B 112 11.340 6.328 -14.281 1.00 0.00 C ATOM 1701 CE LYS B 112 11.592 5.942 -15.739 1.00 0.00 C ATOM 1702 NZ LYS B 112 12.411 6.950 -16.443 1.00 0.00 N ATOM 0 H LYS B 112 10.064 3.098 -11.911 1.00 0.00 H new ATOM 0 HA LYS B 112 8.917 5.372 -10.426 1.00 0.00 H new ATOM 0 HB2 LYS B 112 9.679 6.801 -12.211 1.00 0.00 H new ATOM 0 HB3 LYS B 112 11.044 5.869 -11.630 1.00 0.00 H new ATOM 0 HG2 LYS B 112 10.841 4.336 -13.593 1.00 0.00 H new ATOM 0 HG3 LYS B 112 9.463 5.252 -14.171 1.00 0.00 H new ATOM 0 HD2 LYS B 112 10.912 7.330 -14.235 1.00 0.00 H new ATOM 0 HD3 LYS B 112 12.286 6.360 -13.740 1.00 0.00 H new ATOM 0 HE2 LYS B 112 12.095 4.975 -15.777 1.00 0.00 H new ATOM 0 HE3 LYS B 112 10.638 5.826 -16.254 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 12.432 6.732 -17.460 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 11.999 7.894 -16.300 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 13.380 6.935 -16.066 1.00 0.00 H new ATOM 1716 N VAL B 113 6.940 5.758 -11.895 1.00 0.00 N ATOM 1717 CA VAL B 113 5.664 5.955 -12.587 1.00 0.00 C ATOM 1718 C VAL B 113 5.823 7.176 -13.492 1.00 0.00 C ATOM 1719 O VAL B 113 6.262 8.227 -13.026 1.00 0.00 O ATOM 1720 CB VAL B 113 4.497 6.204 -11.598 1.00 0.00 C ATOM 1721 CG1 VAL B 113 3.151 6.178 -12.342 1.00 0.00 C ATOM 1722 CG2 VAL B 113 4.468 5.188 -10.443 1.00 0.00 C ATOM 0 H VAL B 113 7.144 6.514 -11.242 1.00 0.00 H new ATOM 0 HA VAL B 113 5.422 5.055 -13.152 1.00 0.00 H new ATOM 0 HB VAL B 113 4.663 7.189 -11.162 1.00 0.00 H new ATOM 0 HG11 VAL B 113 2.341 6.354 -11.635 1.00 0.00 H new ATOM 0 HG12 VAL B 113 3.142 6.956 -13.105 1.00 0.00 H new ATOM 0 HG13 VAL B 113 3.015 5.205 -12.814 1.00 0.00 H new ATOM 0 HG21 VAL B 113 3.630 5.412 -9.783 1.00 0.00 H new ATOM 0 HG22 VAL B 113 4.354 4.182 -10.846 1.00 0.00 H new ATOM 0 HG23 VAL B 113 5.400 5.250 -9.881 1.00 0.00 H new ATOM 1732 N CYS B 114 5.479 7.041 -14.773 1.00 0.00 N ATOM 1733 CA CYS B 114 5.572 8.120 -15.762 1.00 0.00 C ATOM 1734 C CYS B 114 4.157 8.545 -16.190 1.00 0.00 C ATOM 1735 O CYS B 114 3.426 7.719 -16.736 1.00 0.00 O ATOM 1736 CB CYS B 114 6.412 7.611 -16.945 1.00 0.00 C ATOM 1737 SG CYS B 114 8.066 7.088 -16.393 1.00 0.00 S ATOM 0 H CYS B 114 5.123 6.167 -15.160 1.00 0.00 H new ATOM 0 HA CYS B 114 6.059 9.002 -15.346 1.00 0.00 H new ATOM 0 HB2 CYS B 114 5.903 6.774 -17.424 1.00 0.00 H new ATOM 0 HB3 CYS B 114 6.506 8.397 -17.694 1.00 0.00 H new ATOM 0 HG CYS B 114 8.749 6.662 -17.413 1.00 0.00 H new ATOM 1743 N ILE B 115 3.750 9.799 -15.957 1.00 0.00 N ATOM 1744 CA ILE B 115 2.334 10.239 -16.008 1.00 0.00 C ATOM 1745 C ILE B 115 2.081 11.339 -17.065 1.00 0.00 C ATOM 1746 O ILE B 115 2.910 12.239 -17.229 1.00 0.00 O ATOM 1747 CB ILE B 115 1.869 10.688 -14.589 1.00 0.00 C ATOM 1748 CG1 ILE B 115 2.146 9.580 -13.539 1.00 0.00 C ATOM 1749 CG2 ILE B 115 0.380 11.084 -14.592 1.00 0.00 C ATOM 1750 CD1 ILE B 115 1.612 9.837 -12.123 1.00 0.00 C ATOM 0 H ILE B 115 4.397 10.553 -15.724 1.00 0.00 H new ATOM 0 HA ILE B 115 1.735 9.385 -16.325 1.00 0.00 H new ATOM 0 HB ILE B 115 2.448 11.569 -14.311 1.00 0.00 H new ATOM 0 HG12 ILE B 115 1.715 8.648 -13.903 1.00 0.00 H new ATOM 0 HG13 ILE B 115 3.224 9.430 -13.476 1.00 0.00 H new ATOM 0 HG21 ILE B 115 0.084 11.393 -13.590 1.00 0.00 H new ATOM 0 HG22 ILE B 115 0.224 11.909 -15.287 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -0.223 10.230 -14.902 1.00 0.00 H new ATOM 0 HD11 ILE B 115 1.866 8.995 -11.480 1.00 0.00 H new ATOM 0 HD12 ILE B 115 2.061 10.747 -11.724 1.00 0.00 H new ATOM 0 HD13 ILE B 115 0.529 9.952 -12.158 1.00 0.00 H new ATOM 1762 N GLU B 116 0.911 11.289 -17.721 1.00 0.00 N ATOM 1763 CA GLU B 116 0.259 12.414 -18.411 1.00 0.00 C ATOM 1764 C GLU B 116 -1.140 12.646 -17.802 1.00 0.00 C ATOM 1765 O GLU B 116 -2.014 11.787 -17.917 1.00 0.00 O ATOM 1766 CB GLU B 116 0.147 12.158 -19.930 1.00 0.00 C ATOM 1767 CG GLU B 116 -0.241 13.426 -20.708 1.00 0.00 C ATOM 1768 CD GLU B 116 -0.836 13.105 -22.080 1.00 0.00 C ATOM 1769 OE1 GLU B 116 -2.017 12.693 -22.147 1.00 0.00 O ATOM 1770 OE2 GLU B 116 -0.143 13.249 -23.117 1.00 0.00 O ATOM 0 H GLU B 116 0.370 10.427 -17.788 1.00 0.00 H new ATOM 0 HA GLU B 116 0.872 13.305 -18.274 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.099 11.782 -20.304 1.00 0.00 H new ATOM 0 HB3 GLU B 116 -0.596 11.381 -20.112 1.00 0.00 H new ATOM 0 HG2 GLU B 116 -0.963 14.000 -20.127 1.00 0.00 H new ATOM 0 HG3 GLU B 116 0.640 14.056 -20.834 1.00 0.00 H new ATOM 1777 N SER B 117 -1.383 13.805 -17.184 1.00 0.00 N ATOM 1778 CA SER B 117 -2.610 14.116 -16.433 1.00 0.00 C ATOM 1779 C SER B 117 -3.050 15.587 -16.589 1.00 0.00 C ATOM 1780 O SER B 117 -2.251 16.438 -16.982 1.00 0.00 O ATOM 1781 CB SER B 117 -2.346 13.824 -14.943 1.00 0.00 C ATOM 1782 OG SER B 117 -3.502 13.988 -14.131 1.00 0.00 O ATOM 0 H SER B 117 -0.716 14.576 -17.190 1.00 0.00 H new ATOM 0 HA SER B 117 -3.415 13.498 -16.831 1.00 0.00 H new ATOM 0 HB2 SER B 117 -1.977 12.804 -14.838 1.00 0.00 H new ATOM 0 HB3 SER B 117 -1.559 14.486 -14.583 1.00 0.00 H new ATOM 0 HG SER B 117 -3.323 13.638 -13.233 1.00 0.00 H new ATOM 1788 N GLU B 118 -4.296 15.917 -16.208 1.00 0.00 N ATOM 1789 CA GLU B 118 -4.715 17.306 -15.949 1.00 0.00 C ATOM 1790 C GLU B 118 -4.288 17.825 -14.562 1.00 0.00 C ATOM 1791 O GLU B 118 -4.329 19.028 -14.300 1.00 0.00 O ATOM 1792 CB GLU B 118 -6.238 17.482 -16.158 1.00 0.00 C ATOM 1793 CG GLU B 118 -7.136 17.041 -14.988 1.00 0.00 C ATOM 1794 CD GLU B 118 -8.590 17.468 -15.192 1.00 0.00 C ATOM 1795 OE1 GLU B 118 -8.912 18.668 -14.989 1.00 0.00 O ATOM 1796 OE2 GLU B 118 -9.438 16.611 -15.536 1.00 0.00 O ATOM 0 H GLU B 118 -5.039 15.231 -16.071 1.00 0.00 H new ATOM 0 HA GLU B 118 -4.189 17.918 -16.682 1.00 0.00 H new ATOM 0 HB2 GLU B 118 -6.437 18.533 -16.366 1.00 0.00 H new ATOM 0 HB3 GLU B 118 -6.530 16.921 -17.046 1.00 0.00 H new ATOM 0 HG2 GLU B 118 -7.088 15.957 -14.882 1.00 0.00 H new ATOM 0 HG3 GLU B 118 -6.759 17.469 -14.059 1.00 0.00 H new ATOM 1803 N HIS B 119 -3.931 16.920 -13.653 1.00 0.00 N ATOM 1804 CA HIS B 119 -3.715 17.206 -12.236 1.00 0.00 C ATOM 1805 C HIS B 119 -2.252 17.568 -11.926 1.00 0.00 C ATOM 1806 O HIS B 119 -1.321 17.078 -12.567 1.00 0.00 O ATOM 1807 CB HIS B 119 -4.183 16.010 -11.388 1.00 0.00 C ATOM 1808 CG HIS B 119 -5.641 15.657 -11.581 1.00 0.00 C ATOM 1809 ND1 HIS B 119 -6.719 16.472 -11.318 1.00 0.00 N ATOM 1810 CD2 HIS B 119 -6.141 14.477 -12.068 1.00 0.00 C ATOM 1811 CE1 HIS B 119 -7.832 15.813 -11.672 1.00 0.00 C ATOM 1812 NE2 HIS B 119 -7.539 14.578 -12.126 1.00 0.00 N ATOM 0 H HIS B 119 -3.780 15.939 -13.889 1.00 0.00 H new ATOM 0 HA HIS B 119 -4.308 18.083 -11.978 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -3.573 15.141 -11.635 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -4.009 16.233 -10.335 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -5.557 13.616 -12.358 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -8.831 16.218 -11.603 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -8.196 13.866 -12.445 1.00 0.00 H new ATOM 1820 N SER B 120 -2.038 18.423 -10.926 1.00 0.00 N ATOM 1821 CA SER B 120 -0.697 18.863 -10.534 1.00 0.00 C ATOM 1822 C SER B 120 0.112 17.768 -9.822 1.00 0.00 C ATOM 1823 O SER B 120 -0.437 16.879 -9.161 1.00 0.00 O ATOM 1824 CB SER B 120 -0.778 20.129 -9.668 1.00 0.00 C ATOM 1825 OG SER B 120 -1.380 19.900 -8.401 1.00 0.00 O ATOM 0 H SER B 120 -2.787 18.830 -10.365 1.00 0.00 H new ATOM 0 HA SER B 120 -0.161 19.092 -11.455 1.00 0.00 H new ATOM 0 HB2 SER B 120 0.226 20.526 -9.520 1.00 0.00 H new ATOM 0 HB3 SER B 120 -1.346 20.891 -10.201 1.00 0.00 H new ATOM 0 HG SER B 120 -1.403 20.738 -7.894 1.00 0.00 H new ATOM 1831 N MET B 121 1.444 17.859 -9.904 1.00 0.00 N ATOM 1832 CA MET B 121 2.363 16.918 -9.257 1.00 0.00 C ATOM 1833 C MET B 121 2.174 16.827 -7.739 1.00 0.00 C ATOM 1834 O MET B 121 2.288 15.738 -7.186 1.00 0.00 O ATOM 1835 CB MET B 121 3.820 17.234 -9.647 1.00 0.00 C ATOM 1836 CG MET B 121 4.408 18.529 -9.063 1.00 0.00 C ATOM 1837 SD MET B 121 3.573 20.069 -9.531 1.00 0.00 S ATOM 1838 CE MET B 121 4.610 21.249 -8.638 1.00 0.00 C ATOM 0 H MET B 121 1.918 18.595 -10.427 1.00 0.00 H new ATOM 0 HA MET B 121 2.117 15.924 -9.631 1.00 0.00 H new ATOM 0 HB2 MET B 121 4.448 16.400 -9.334 1.00 0.00 H new ATOM 0 HB3 MET B 121 3.881 17.289 -10.734 1.00 0.00 H new ATOM 0 HG2 MET B 121 4.398 18.450 -7.976 1.00 0.00 H new ATOM 0 HG3 MET B 121 5.452 18.599 -9.368 1.00 0.00 H new ATOM 0 HE1 MET B 121 4.242 22.260 -8.811 1.00 0.00 H new ATOM 0 HE2 MET B 121 4.577 21.028 -7.571 1.00 0.00 H new ATOM 0 HE3 MET B 121 5.638 21.171 -8.993 1.00 0.00 H new ATOM 1848 N ASP B 122 1.820 17.927 -7.070 1.00 0.00 N ATOM 1849 CA ASP B 122 1.486 17.931 -5.642 1.00 0.00 C ATOM 1850 C ASP B 122 0.180 17.172 -5.343 1.00 0.00 C ATOM 1851 O ASP B 122 0.114 16.458 -4.339 1.00 0.00 O ATOM 1852 CB ASP B 122 1.401 19.381 -5.145 1.00 0.00 C ATOM 1853 CG ASP B 122 1.071 19.444 -3.651 1.00 0.00 C ATOM 1854 OD1 ASP B 122 -0.132 19.458 -3.306 1.00 0.00 O ATOM 1855 OD2 ASP B 122 2.024 19.427 -2.832 1.00 0.00 O ATOM 0 H ASP B 122 1.756 18.847 -7.506 1.00 0.00 H new ATOM 0 HA ASP B 122 2.278 17.405 -5.108 1.00 0.00 H new ATOM 0 HB2 ASP B 122 2.349 19.887 -5.331 1.00 0.00 H new ATOM 0 HB3 ASP B 122 0.638 19.916 -5.710 1.00 0.00 H new ATOM 1860 N THR B 123 -0.834 17.293 -6.214 1.00 0.00 N ATOM 1861 CA THR B 123 -2.124 16.590 -6.091 1.00 0.00 C ATOM 1862 C THR B 123 -1.920 15.087 -6.245 1.00 0.00 C ATOM 1863 O THR B 123 -2.422 14.316 -5.425 1.00 0.00 O ATOM 1864 CB THR B 123 -3.124 17.117 -7.131 1.00 0.00 C ATOM 1865 OG1 THR B 123 -3.323 18.496 -6.911 1.00 0.00 O ATOM 1866 CG2 THR B 123 -4.489 16.432 -7.033 1.00 0.00 C ATOM 0 H THR B 123 -0.781 17.892 -7.038 1.00 0.00 H new ATOM 0 HA THR B 123 -2.536 16.781 -5.100 1.00 0.00 H new ATOM 0 HB THR B 123 -2.705 16.912 -8.116 1.00 0.00 H new ATOM 0 HG1 THR B 123 -2.658 19.007 -7.417 1.00 0.00 H new ATOM 0 HG21 THR B 123 -5.157 16.842 -7.790 1.00 0.00 H new ATOM 0 HG22 THR B 123 -4.371 15.361 -7.195 1.00 0.00 H new ATOM 0 HG23 THR B 123 -4.913 16.605 -6.044 1.00 0.00 H new ATOM 1874 N LEU B 124 -1.144 14.683 -7.255 1.00 0.00 N ATOM 1875 CA LEU B 124 -0.747 13.293 -7.502 1.00 0.00 C ATOM 1876 C LEU B 124 0.065 12.735 -6.319 1.00 0.00 C ATOM 1877 O LEU B 124 -0.279 11.682 -5.777 1.00 0.00 O ATOM 1878 CB LEU B 124 0.043 13.240 -8.830 1.00 0.00 C ATOM 1879 CG LEU B 124 -0.783 13.592 -10.093 1.00 0.00 C ATOM 1880 CD1 LEU B 124 0.147 13.868 -11.282 1.00 0.00 C ATOM 1881 CD2 LEU B 124 -1.755 12.465 -10.472 1.00 0.00 C ATOM 0 H LEU B 124 -0.764 15.332 -7.943 1.00 0.00 H new ATOM 0 HA LEU B 124 -1.629 12.660 -7.592 1.00 0.00 H new ATOM 0 HB2 LEU B 124 0.887 13.927 -8.762 1.00 0.00 H new ATOM 0 HB3 LEU B 124 0.456 12.239 -8.951 1.00 0.00 H new ATOM 0 HG LEU B 124 -1.362 14.485 -9.857 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -0.449 14.114 -12.161 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.804 14.705 -11.044 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.748 12.982 -11.487 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -2.315 12.751 -11.362 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -1.193 11.553 -10.674 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -2.448 12.290 -9.649 1.00 0.00 H new ATOM 1893 N LEU B 125 1.092 13.462 -5.861 1.00 0.00 N ATOM 1894 CA LEU B 125 1.948 13.061 -4.738 1.00 0.00 C ATOM 1895 C LEU B 125 1.177 12.953 -3.412 1.00 0.00 C ATOM 1896 O LEU B 125 1.490 12.080 -2.607 1.00 0.00 O ATOM 1897 CB LEU B 125 3.131 14.046 -4.650 1.00 0.00 C ATOM 1898 CG LEU B 125 4.220 13.687 -3.618 1.00 0.00 C ATOM 1899 CD1 LEU B 125 4.914 12.356 -3.942 1.00 0.00 C ATOM 1900 CD2 LEU B 125 5.267 14.809 -3.563 1.00 0.00 C ATOM 0 H LEU B 125 1.355 14.360 -6.267 1.00 0.00 H new ATOM 0 HA LEU B 125 2.327 12.056 -4.922 1.00 0.00 H new ATOM 0 HB2 LEU B 125 3.596 14.116 -5.633 1.00 0.00 H new ATOM 0 HB3 LEU B 125 2.740 15.035 -4.411 1.00 0.00 H new ATOM 0 HG LEU B 125 3.730 13.576 -2.651 1.00 0.00 H new ATOM 0 HD11 LEU B 125 5.672 12.148 -3.187 1.00 0.00 H new ATOM 0 HD12 LEU B 125 4.177 11.553 -3.947 1.00 0.00 H new ATOM 0 HD13 LEU B 125 5.387 12.421 -4.922 1.00 0.00 H new ATOM 0 HD21 LEU B 125 6.036 14.554 -2.833 1.00 0.00 H new ATOM 0 HD22 LEU B 125 5.724 14.928 -4.545 1.00 0.00 H new ATOM 0 HD23 LEU B 125 4.785 15.742 -3.271 1.00 0.00 H new ATOM 1912 N ALA B 126 0.150 13.776 -3.182 1.00 0.00 N ATOM 1913 CA ALA B 126 -0.712 13.682 -1.997 1.00 0.00 C ATOM 1914 C ALA B 126 -1.539 12.383 -1.955 1.00 0.00 C ATOM 1915 O ALA B 126 -1.700 11.811 -0.873 1.00 0.00 O ATOM 1916 CB ALA B 126 -1.589 14.935 -1.931 1.00 0.00 C ATOM 0 H ALA B 126 -0.110 14.532 -3.816 1.00 0.00 H new ATOM 0 HA ALA B 126 -0.082 13.635 -1.109 1.00 0.00 H new ATOM 0 HB1 ALA B 126 -2.236 14.881 -1.055 1.00 0.00 H new ATOM 0 HB2 ALA B 126 -0.956 15.819 -1.860 1.00 0.00 H new ATOM 0 HB3 ALA B 126 -2.201 14.999 -2.831 1.00 0.00 H new ATOM 1922 N THR B 127 -1.992 11.879 -3.114 1.00 0.00 N ATOM 1923 CA THR B 127 -2.644 10.560 -3.239 1.00 0.00 C ATOM 1924 C THR B 127 -1.640 9.437 -2.998 1.00 0.00 C ATOM 1925 O THR B 127 -1.938 8.514 -2.244 1.00 0.00 O ATOM 1926 CB THR B 127 -3.338 10.431 -4.603 1.00 0.00 C ATOM 1927 OG1 THR B 127 -4.528 11.178 -4.568 1.00 0.00 O ATOM 1928 CG2 THR B 127 -3.769 9.005 -4.945 1.00 0.00 C ATOM 0 H THR B 127 -1.917 12.378 -4.000 1.00 0.00 H new ATOM 0 HA THR B 127 -3.414 10.473 -2.472 1.00 0.00 H new ATOM 0 HB THR B 127 -2.612 10.771 -5.342 1.00 0.00 H new ATOM 0 HG1 THR B 127 -5.236 10.687 -5.035 1.00 0.00 H new ATOM 0 HG21 THR B 127 -4.251 8.995 -5.923 1.00 0.00 H new ATOM 0 HG22 THR B 127 -2.894 8.355 -4.965 1.00 0.00 H new ATOM 0 HG23 THR B 127 -4.470 8.646 -4.191 1.00 0.00 H new ATOM 1936 N LEU B 128 -0.439 9.513 -3.582 1.00 0.00 N ATOM 1937 CA LEU B 128 0.601 8.488 -3.394 1.00 0.00 C ATOM 1938 C LEU B 128 1.100 8.417 -1.939 1.00 0.00 C ATOM 1939 O LEU B 128 1.313 7.320 -1.418 1.00 0.00 O ATOM 1940 CB LEU B 128 1.754 8.740 -4.385 1.00 0.00 C ATOM 1941 CG LEU B 128 1.381 8.583 -5.877 1.00 0.00 C ATOM 1942 CD1 LEU B 128 2.557 9.038 -6.754 1.00 0.00 C ATOM 1943 CD2 LEU B 128 1.011 7.133 -6.229 1.00 0.00 C ATOM 0 H LEU B 128 -0.159 10.279 -4.194 1.00 0.00 H new ATOM 0 HA LEU B 128 0.162 7.512 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU B 128 2.136 9.749 -4.226 1.00 0.00 H new ATOM 0 HB3 LEU B 128 2.567 8.052 -4.155 1.00 0.00 H new ATOM 0 HG LEU B 128 0.506 9.206 -6.066 1.00 0.00 H new ATOM 0 HD11 LEU B 128 2.291 8.926 -7.805 1.00 0.00 H new ATOM 0 HD12 LEU B 128 2.783 10.084 -6.546 1.00 0.00 H new ATOM 0 HD13 LEU B 128 3.433 8.427 -6.534 1.00 0.00 H new ATOM 0 HD21 LEU B 128 0.756 7.069 -7.287 1.00 0.00 H new ATOM 0 HD22 LEU B 128 1.859 6.480 -6.020 1.00 0.00 H new ATOM 0 HD23 LEU B 128 0.156 6.820 -5.630 1.00 0.00 H new ATOM 1955 N LYS B 129 1.203 9.555 -1.240 1.00 0.00 N ATOM 1956 CA LYS B 129 1.513 9.627 0.199 1.00 0.00 C ATOM 1957 C LYS B 129 0.533 8.840 1.094 1.00 0.00 C ATOM 1958 O LYS B 129 0.899 8.482 2.214 1.00 0.00 O ATOM 1959 CB LYS B 129 1.589 11.106 0.640 1.00 0.00 C ATOM 1960 CG LYS B 129 3.004 11.697 0.498 1.00 0.00 C ATOM 1961 CD LYS B 129 3.063 13.160 0.977 1.00 0.00 C ATOM 1962 CE LYS B 129 2.592 14.119 -0.123 1.00 0.00 C ATOM 1963 NZ LYS B 129 2.061 15.395 0.412 1.00 0.00 N ATOM 0 H LYS B 129 1.071 10.472 -1.666 1.00 0.00 H new ATOM 0 HA LYS B 129 2.480 9.143 0.334 1.00 0.00 H new ATOM 0 HB2 LYS B 129 0.892 11.695 0.043 1.00 0.00 H new ATOM 0 HB3 LYS B 129 1.268 11.188 1.678 1.00 0.00 H new ATOM 0 HG2 LYS B 129 3.708 11.097 1.074 1.00 0.00 H new ATOM 0 HG3 LYS B 129 3.318 11.643 -0.544 1.00 0.00 H new ATOM 0 HD2 LYS B 129 2.439 13.282 1.862 1.00 0.00 H new ATOM 0 HD3 LYS B 129 4.083 13.410 1.270 1.00 0.00 H new ATOM 0 HE2 LYS B 129 3.424 14.331 -0.794 1.00 0.00 H new ATOM 0 HE3 LYS B 129 1.820 13.631 -0.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 1.758 16.003 -0.376 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 1.248 15.200 1.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 2.803 15.879 0.957 1.00 0.00 H new ATOM 1977 N LYS B 130 -0.676 8.495 0.623 1.00 0.00 N ATOM 1978 CA LYS B 130 -1.627 7.661 1.378 1.00 0.00 C ATOM 1979 C LYS B 130 -1.109 6.230 1.642 1.00 0.00 C ATOM 1980 O LYS B 130 -1.497 5.621 2.640 1.00 0.00 O ATOM 1981 CB LYS B 130 -2.980 7.652 0.633 1.00 0.00 C ATOM 1982 CG LYS B 130 -4.172 7.051 1.410 1.00 0.00 C ATOM 1983 CD LYS B 130 -4.380 7.603 2.829 1.00 0.00 C ATOM 1984 CE LYS B 130 -4.463 9.136 2.856 1.00 0.00 C ATOM 1985 NZ LYS B 130 -4.173 9.664 4.209 1.00 0.00 N ATOM 0 H LYS B 130 -1.022 8.786 -0.291 1.00 0.00 H new ATOM 0 HA LYS B 130 -1.753 8.101 2.367 1.00 0.00 H new ATOM 0 HB2 LYS B 130 -3.229 8.677 0.359 1.00 0.00 H new ATOM 0 HB3 LYS B 130 -2.858 7.095 -0.296 1.00 0.00 H new ATOM 0 HG2 LYS B 130 -5.082 7.222 0.835 1.00 0.00 H new ATOM 0 HG3 LYS B 130 -4.034 5.972 1.475 1.00 0.00 H new ATOM 0 HD2 LYS B 130 -5.296 7.185 3.248 1.00 0.00 H new ATOM 0 HD3 LYS B 130 -3.559 7.275 3.467 1.00 0.00 H new ATOM 0 HE2 LYS B 130 -3.755 9.554 2.140 1.00 0.00 H new ATOM 0 HE3 LYS B 130 -5.458 9.455 2.544 1.00 0.00 H new ATOM 0 HZ1 LYS B 130 -4.236 10.702 4.197 1.00 0.00 H new ATOM 0 HZ2 LYS B 130 -4.864 9.282 4.886 1.00 0.00 H new ATOM 0 HZ3 LYS B 130 -3.215 9.379 4.495 1.00 0.00 H new ATOM 1999 N THR B 131 -0.200 5.720 0.794 1.00 0.00 N ATOM 2000 CA THR B 131 0.392 4.370 0.894 1.00 0.00 C ATOM 2001 C THR B 131 1.217 4.147 2.159 1.00 0.00 C ATOM 2002 O THR B 131 1.202 3.041 2.690 1.00 0.00 O ATOM 2003 CB THR B 131 1.282 4.057 -0.316 1.00 0.00 C ATOM 2004 OG1 THR B 131 2.317 5.012 -0.419 1.00 0.00 O ATOM 2005 CG2 THR B 131 0.498 4.019 -1.626 1.00 0.00 C ATOM 0 H THR B 131 0.155 6.248 -0.003 1.00 0.00 H new ATOM 0 HA THR B 131 -0.466 3.698 0.927 1.00 0.00 H new ATOM 0 HB THR B 131 1.700 3.064 -0.151 1.00 0.00 H new ATOM 0 HG1 THR B 131 1.938 5.879 -0.675 1.00 0.00 H new ATOM 0 HG21 THR B 131 1.176 3.794 -2.449 1.00 0.00 H new ATOM 0 HG22 THR B 131 -0.271 3.249 -1.568 1.00 0.00 H new ATOM 0 HG23 THR B 131 0.029 4.988 -1.797 1.00 0.00 H new ATOM 2013 N GLY B 132 1.921 5.173 2.643 1.00 0.00 N ATOM 2014 CA GLY B 132 2.894 5.075 3.741 1.00 0.00 C ATOM 2015 C GLY B 132 4.319 4.732 3.288 1.00 0.00 C ATOM 2016 O GLY B 132 5.167 4.455 4.134 1.00 0.00 O ATOM 0 H GLY B 132 1.830 6.120 2.275 1.00 0.00 H new ATOM 0 HA2 GLY B 132 2.914 6.022 4.280 1.00 0.00 H new ATOM 0 HA3 GLY B 132 2.555 4.315 4.445 1.00 0.00 H new ATOM 2020 N LYS B 133 4.611 4.784 1.983 1.00 0.00 N ATOM 2021 CA LYS B 133 5.968 4.640 1.428 1.00 0.00 C ATOM 2022 C LYS B 133 6.708 5.975 1.255 1.00 0.00 C ATOM 2023 O LYS B 133 6.095 7.047 1.227 1.00 0.00 O ATOM 2024 CB LYS B 133 5.903 3.883 0.089 1.00 0.00 C ATOM 2025 CG LYS B 133 5.707 2.372 0.277 1.00 0.00 C ATOM 2026 CD LYS B 133 5.806 1.677 -1.087 1.00 0.00 C ATOM 2027 CE LYS B 133 5.702 0.153 -0.992 1.00 0.00 C ATOM 2028 NZ LYS B 133 6.886 -0.471 -0.354 1.00 0.00 N ATOM 0 H LYS B 133 3.899 4.930 1.267 1.00 0.00 H new ATOM 0 HA LYS B 133 6.546 4.070 2.155 1.00 0.00 H new ATOM 0 HB2 LYS B 133 5.084 4.281 -0.510 1.00 0.00 H new ATOM 0 HB3 LYS B 133 6.822 4.060 -0.470 1.00 0.00 H new ATOM 0 HG2 LYS B 133 6.463 1.977 0.956 1.00 0.00 H new ATOM 0 HG3 LYS B 133 4.736 2.173 0.730 1.00 0.00 H new ATOM 0 HD2 LYS B 133 5.014 2.050 -1.737 1.00 0.00 H new ATOM 0 HD3 LYS B 133 6.754 1.942 -1.556 1.00 0.00 H new ATOM 0 HE2 LYS B 133 4.810 -0.110 -0.424 1.00 0.00 H new ATOM 0 HE3 LYS B 133 5.576 -0.260 -1.993 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 6.910 -1.485 -0.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 7.751 -0.015 -0.708 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 6.828 -0.351 0.677 1.00 0.00 H new ATOM 2042 N THR B 134 8.030 5.890 1.084 1.00 0.00 N ATOM 2043 CA THR B 134 8.908 6.969 0.621 1.00 0.00 C ATOM 2044 C THR B 134 8.664 7.166 -0.872 1.00 0.00 C ATOM 2045 O THR B 134 9.098 6.352 -1.688 1.00 0.00 O ATOM 2046 CB THR B 134 10.371 6.610 0.909 1.00 0.00 C ATOM 2047 OG1 THR B 134 10.509 6.341 2.286 1.00 0.00 O ATOM 2048 CG2 THR B 134 11.321 7.750 0.547 1.00 0.00 C ATOM 0 H THR B 134 8.541 5.028 1.273 1.00 0.00 H new ATOM 0 HA THR B 134 8.692 7.899 1.147 1.00 0.00 H new ATOM 0 HB THR B 134 10.628 5.742 0.302 1.00 0.00 H new ATOM 0 HG1 THR B 134 11.441 6.108 2.482 1.00 0.00 H new ATOM 0 HG21 THR B 134 12.346 7.453 0.767 1.00 0.00 H new ATOM 0 HG22 THR B 134 11.229 7.977 -0.515 1.00 0.00 H new ATOM 0 HG23 THR B 134 11.067 8.635 1.130 1.00 0.00 H new ATOM 2056 N VAL B 135 7.940 8.225 -1.222 1.00 0.00 N ATOM 2057 CA VAL B 135 7.607 8.585 -2.618 1.00 0.00 C ATOM 2058 C VAL B 135 8.233 9.934 -2.991 1.00 0.00 C ATOM 2059 O VAL B 135 8.193 10.868 -2.190 1.00 0.00 O ATOM 2060 CB VAL B 135 6.077 8.632 -2.851 1.00 0.00 C ATOM 2061 CG1 VAL B 135 5.754 8.895 -4.333 1.00 0.00 C ATOM 2062 CG2 VAL B 135 5.401 7.319 -2.412 1.00 0.00 C ATOM 0 H VAL B 135 7.556 8.877 -0.538 1.00 0.00 H new ATOM 0 HA VAL B 135 8.021 7.807 -3.259 1.00 0.00 H new ATOM 0 HB VAL B 135 5.687 9.450 -2.245 1.00 0.00 H new ATOM 0 HG11 VAL B 135 4.673 8.923 -4.470 1.00 0.00 H new ATOM 0 HG12 VAL B 135 6.183 9.850 -4.635 1.00 0.00 H new ATOM 0 HG13 VAL B 135 6.177 8.098 -4.945 1.00 0.00 H new ATOM 0 HG21 VAL B 135 4.328 7.386 -2.589 1.00 0.00 H new ATOM 0 HG22 VAL B 135 5.813 6.488 -2.985 1.00 0.00 H new ATOM 0 HG23 VAL B 135 5.584 7.153 -1.350 1.00 0.00 H new ATOM 2072 N SER B 136 8.786 10.055 -4.202 1.00 0.00 N ATOM 2073 CA SER B 136 9.496 11.261 -4.665 1.00 0.00 C ATOM 2074 C SER B 136 9.132 11.675 -6.103 1.00 0.00 C ATOM 2075 O SER B 136 8.984 10.833 -6.985 1.00 0.00 O ATOM 2076 CB SER B 136 11.018 11.041 -4.572 1.00 0.00 C ATOM 2077 OG SER B 136 11.439 10.711 -3.253 1.00 0.00 O ATOM 0 H SER B 136 8.755 9.312 -4.900 1.00 0.00 H new ATOM 0 HA SER B 136 9.180 12.072 -4.009 1.00 0.00 H new ATOM 0 HB2 SER B 136 11.309 10.242 -5.254 1.00 0.00 H new ATOM 0 HB3 SER B 136 11.534 11.944 -4.900 1.00 0.00 H new ATOM 0 HG SER B 136 12.410 10.579 -3.243 1.00 0.00 H new ATOM 2083 N TYR B 137 9.037 12.984 -6.369 1.00 0.00 N ATOM 2084 CA TYR B 137 8.882 13.551 -7.721 1.00 0.00 C ATOM 2085 C TYR B 137 10.241 13.663 -8.436 1.00 0.00 C ATOM 2086 O TYR B 137 11.166 14.271 -7.892 1.00 0.00 O ATOM 2087 CB TYR B 137 8.217 14.931 -7.585 1.00 0.00 C ATOM 2088 CG TYR B 137 8.150 15.773 -8.850 1.00 0.00 C ATOM 2089 CD1 TYR B 137 7.144 15.538 -9.806 1.00 0.00 C ATOM 2090 CD2 TYR B 137 9.062 16.830 -9.047 1.00 0.00 C ATOM 2091 CE1 TYR B 137 7.005 16.388 -10.921 1.00 0.00 C ATOM 2092 CE2 TYR B 137 8.944 17.671 -10.171 1.00 0.00 C ATOM 2093 CZ TYR B 137 7.897 17.468 -11.099 1.00 0.00 C ATOM 2094 OH TYR B 137 7.740 18.327 -12.142 1.00 0.00 O ATOM 0 H TYR B 137 9.066 13.695 -5.638 1.00 0.00 H new ATOM 0 HA TYR B 137 8.259 12.894 -8.328 1.00 0.00 H new ATOM 0 HB2 TYR B 137 7.202 14.787 -7.215 1.00 0.00 H new ATOM 0 HB3 TYR B 137 8.755 15.497 -6.825 1.00 0.00 H new ATOM 0 HD1 TYR B 137 6.474 14.700 -9.684 1.00 0.00 H new ATOM 0 HD2 TYR B 137 9.855 16.996 -8.333 1.00 0.00 H new ATOM 0 HE1 TYR B 137 6.217 16.214 -11.639 1.00 0.00 H new ATOM 0 HE2 TYR B 137 9.653 18.471 -10.324 1.00 0.00 H new ATOM 0 HH TYR B 137 8.441 19.011 -12.111 1.00 0.00 H new ATOM 2104 N LEU B 138 10.373 13.114 -9.652 1.00 0.00 N ATOM 2105 CA LEU B 138 11.619 13.120 -10.439 1.00 0.00 C ATOM 2106 C LEU B 138 11.446 13.934 -11.743 1.00 0.00 C ATOM 2107 O LEU B 138 11.945 13.559 -12.807 1.00 0.00 O ATOM 2108 CB LEU B 138 12.034 11.643 -10.702 1.00 0.00 C ATOM 2109 CG LEU B 138 12.882 10.927 -9.625 1.00 0.00 C ATOM 2110 CD1 LEU B 138 14.292 11.527 -9.526 1.00 0.00 C ATOM 2111 CD2 LEU B 138 12.237 10.885 -8.235 1.00 0.00 C ATOM 0 H LEU B 138 9.603 12.644 -10.127 1.00 0.00 H new ATOM 0 HA LEU B 138 12.418 13.614 -9.886 1.00 0.00 H new ATOM 0 HB2 LEU B 138 11.124 11.062 -10.852 1.00 0.00 H new ATOM 0 HB3 LEU B 138 12.590 11.614 -11.639 1.00 0.00 H new ATOM 0 HG LEU B 138 12.946 9.894 -9.968 1.00 0.00 H new ATOM 0 HD11 LEU B 138 14.859 10.999 -8.759 1.00 0.00 H new ATOM 0 HD12 LEU B 138 14.799 11.426 -10.486 1.00 0.00 H new ATOM 0 HD13 LEU B 138 14.221 12.582 -9.262 1.00 0.00 H new ATOM 0 HD21 LEU B 138 12.899 10.365 -7.542 1.00 0.00 H new ATOM 0 HD22 LEU B 138 12.068 11.902 -7.881 1.00 0.00 H new ATOM 0 HD23 LEU B 138 11.285 10.358 -8.292 1.00 0.00 H new ATOM 2123 N GLY B 139 10.896 15.146 -11.624 1.00 0.00 N ATOM 2124 CA GLY B 139 10.965 16.190 -12.651 1.00 0.00 C ATOM 2125 C GLY B 139 9.964 16.103 -13.812 1.00 0.00 C ATOM 2126 O GLY B 139 9.170 15.166 -13.954 1.00 0.00 O ATOM 0 H GLY B 139 10.379 15.435 -10.793 1.00 0.00 H new ATOM 0 HA2 GLY B 139 10.830 17.154 -12.161 1.00 0.00 H new ATOM 0 HA3 GLY B 139 11.971 16.184 -13.071 1.00 0.00 H new ATOM 2130 N LEU B 140 10.038 17.134 -14.659 1.00 0.00 N ATOM 2131 CA LEU B 140 9.266 17.335 -15.890 1.00 0.00 C ATOM 2132 C LEU B 140 10.010 16.735 -17.098 1.00 0.00 C ATOM 2133 O LEU B 140 11.240 16.832 -17.165 1.00 0.00 O ATOM 2134 CB LEU B 140 9.066 18.860 -16.046 1.00 0.00 C ATOM 2135 CG LEU B 140 8.123 19.315 -17.180 1.00 0.00 C ATOM 2136 CD1 LEU B 140 6.658 18.970 -16.871 1.00 0.00 C ATOM 2137 CD2 LEU B 140 8.248 20.835 -17.372 1.00 0.00 C ATOM 0 H LEU B 140 10.685 17.905 -14.491 1.00 0.00 H new ATOM 0 HA LEU B 140 8.301 16.831 -15.840 1.00 0.00 H new ATOM 0 HB2 LEU B 140 8.682 19.253 -15.104 1.00 0.00 H new ATOM 0 HB3 LEU B 140 10.042 19.318 -16.208 1.00 0.00 H new ATOM 0 HG LEU B 140 8.416 18.789 -18.089 1.00 0.00 H new ATOM 0 HD11 LEU B 140 6.024 19.306 -17.692 1.00 0.00 H new ATOM 0 HD12 LEU B 140 6.556 17.891 -16.751 1.00 0.00 H new ATOM 0 HD13 LEU B 140 6.353 19.468 -15.950 1.00 0.00 H new ATOM 0 HD21 LEU B 140 7.582 21.157 -18.173 1.00 0.00 H new ATOM 0 HD22 LEU B 140 7.974 21.342 -16.447 1.00 0.00 H new ATOM 0 HD23 LEU B 140 9.276 21.085 -17.633 1.00 0.00 H new ATOM 2149 N GLU B 141 9.285 16.143 -18.058 1.00 0.00 N ATOM 2150 CA GLU B 141 9.853 15.719 -19.358 1.00 0.00 C ATOM 2151 C GLU B 141 10.006 16.910 -20.312 1.00 0.00 C ATOM 2152 O GLU B 141 11.162 17.348 -20.513 1.00 0.00 O ATOM 2153 CB GLU B 141 9.044 14.558 -19.980 1.00 0.00 C ATOM 2154 CG GLU B 141 9.789 13.955 -21.187 1.00 0.00 C ATOM 2155 CD GLU B 141 9.059 12.770 -21.849 1.00 0.00 C ATOM 2156 OE1 GLU B 141 9.200 11.610 -21.383 1.00 0.00 O ATOM 2157 OE2 GLU B 141 8.420 12.966 -22.915 1.00 0.00 O ATOM 2158 OXT GLU B 141 8.983 17.422 -20.828 1.00 0.00 O ATOM 0 H GLU B 141 8.290 15.942 -17.961 1.00 0.00 H new ATOM 0 HA GLU B 141 10.856 15.332 -19.176 1.00 0.00 H new ATOM 0 HB2 GLU B 141 8.873 13.786 -19.230 1.00 0.00 H new ATOM 0 HB3 GLU B 141 8.065 14.919 -20.295 1.00 0.00 H new ATOM 0 HG2 GLU B 141 9.943 14.735 -21.932 1.00 0.00 H new ATOM 0 HG3 GLU B 141 10.776 13.625 -20.863 1.00 0.00 H new TER 2165 GLU B 141 HETATM 2166 CU CU A 142 5.933 -4.491 -3.584 1.00 0.00 CU