USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1051 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 CYS SG : rot -104:sc= -7.73! USER MOD Set 1.2: A 127 CYS SG : rot -72:sc= -5.64! USER MOD Set 2.1: A 83 THR OG1 : rot -161:sc= 0.936 USER MOD Set 2.2: A 85 THR OG1 : rot 99:sc= 1.22 USER MOD Set 2.3: A 98 GLN : amide:sc= 1.27 K(o=3.4,f=-3.2) USER MOD Set 3.1: A 67 CYS SG : rot -48:sc= 0.252 USER MOD Set 3.2: A 87 CYS SG : rot 119:sc= 0.413 USER MOD Set 4.1: A 51 ASN : amide:sc= 1.92 K(o=3.1,f=-1.7) USER MOD Set 4.2: A 68 THR OG1 : rot -89:sc= 1.22 USER MOD Set 5.1: A 43 CYS SG : rot 180:sc= -0.0265 USER MOD Set 5.2: A 56 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 35 MET CE :methyl -170:sc= -0.043 (180deg=-0.212) USER MOD Set 6.2: A 61 LYS NZ :NH3+ 176:sc= 0.686 (180deg=0.68) USER MOD Set 7.1: A 22 TYR OH : rot 180:sc= 1.07 USER MOD Set 7.2: A 105 SER OG : rot 152:sc= 1.27 USER MOD Single : A 3 THR OG1 : rot 23:sc= 0.128 USER MOD Single : A 5 GLN : amide:sc= -0.036 K(o=-0.036,f=-1.8!) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 16 SER OG : rot 40:sc= 0.351 USER MOD Single : A 17 LYS NZ :NH3+ -170:sc= 1.23 (180deg=0.983) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -15:sc= 1.04 USER MOD Single : A 47 CYS SG : rot 29:sc= 0.323 USER MOD Single : A 50 LYS NZ :NH3+ -171:sc= 1.3 (180deg=0.815) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -172:sc= 0.983 (180deg=0.975) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 62:sc= 1.73 USER MOD Single : A 63 THR OG1 : rot -16:sc= 1.11 USER MOD Single : A 64 GLN : amide:sc= -0.0589 X(o=-0.059,f=-0.51) USER MOD Single : A 66 SER OG : rot 34:sc= 0.855 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0.0703 USER MOD Single : A 82 LYS NZ :NH3+ -153:sc= 1.19 (180deg=1.1) USER MOD Single : A 84 GLN : amide:sc= 0.206 K(o=0.21,f=-2.5!) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot -54:sc= 0.931 USER MOD Single : A 96 GLN : amide:sc= 0.478 K(o=0.48,f=-5.2!) USER MOD Single : A 97 HIS : no HD1:sc= -0.0648 K(o=-0.065,f=-0.62) USER MOD Single : A 103 LYS NZ :NH3+ 163:sc= 1.15 (180deg=0.9) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 176:sc= 1.13 (180deg=1.09) USER MOD Single : A 112 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.266) USER MOD Single : A 115 LYS NZ :NH3+ -166:sc= 2.37 (180deg=1.93) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0.995 K(o=0.99,f=0) USER MOD Single : A 124 ASN : amide:sc= 0.955 K(o=0.96,f=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot -130:sc= 1.06 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ -176:sc= 1.25 (180deg=1.08) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 3 -0.090 -2.807 0.801 1.00 0.00 N ATOM 2 CA THR A 3 -1.226 -2.580 -0.138 1.00 0.00 C ATOM 3 C THR A 3 -0.717 -2.625 -1.612 1.00 0.00 C ATOM 4 O THR A 3 -1.002 -3.597 -2.314 1.00 0.00 O ATOM 5 CB THR A 3 -2.053 -1.324 0.268 1.00 0.00 C ATOM 6 OG1 THR A 3 -2.393 -1.354 1.651 1.00 0.00 O ATOM 7 CG2 THR A 3 -3.399 -1.198 -0.461 1.00 0.00 C ATOM 0 HA THR A 3 -1.950 -3.392 -0.067 1.00 0.00 H new ATOM 0 HB THR A 3 -1.401 -0.491 0.005 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.763 -1.932 2.130 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.913 -0.298 -0.123 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.226 -1.135 -1.535 1.00 0.00 H new ATOM 0 HG23 THR A 3 -4.014 -2.071 -0.243 1.00 0.00 H new ATOM 14 N VAL A 4 0.075 -1.634 -2.077 1.00 0.00 N ATOM 15 CA VAL A 4 0.917 -1.789 -3.314 1.00 0.00 C ATOM 16 C VAL A 4 2.097 -2.824 -3.183 1.00 0.00 C ATOM 17 O VAL A 4 2.375 -3.551 -4.140 1.00 0.00 O ATOM 18 CB VAL A 4 1.314 -0.386 -3.890 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.342 0.412 -3.054 1.00 0.00 C ATOM 20 CG2 VAL A 4 1.818 -0.463 -5.349 1.00 0.00 C ATOM 0 H VAL A 4 0.158 -0.721 -1.629 1.00 0.00 H new ATOM 0 HA VAL A 4 0.295 -2.268 -4.070 1.00 0.00 H new ATOM 0 HB VAL A 4 0.373 0.161 -3.844 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.546 1.365 -3.541 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.939 0.593 -2.058 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.267 -0.159 -2.973 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.079 0.536 -5.697 1.00 0.00 H new ATOM 0 HG22 VAL A 4 2.698 -1.105 -5.397 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.033 -0.875 -5.984 1.00 0.00 H new ATOM 30 N GLN A 5 2.715 -2.959 -1.992 1.00 0.00 N ATOM 31 CA GLN A 5 3.650 -4.067 -1.637 1.00 0.00 C ATOM 32 C GLN A 5 3.154 -5.540 -1.860 1.00 0.00 C ATOM 33 O GLN A 5 3.965 -6.424 -2.145 1.00 0.00 O ATOM 34 CB GLN A 5 4.092 -3.862 -0.162 1.00 0.00 C ATOM 35 CG GLN A 5 4.755 -2.505 0.204 1.00 0.00 C ATOM 36 CD GLN A 5 3.779 -1.482 0.792 1.00 0.00 C ATOM 37 OE1 GLN A 5 3.103 -0.734 0.092 1.00 0.00 O ATOM 38 NE2 GLN A 5 3.629 -1.468 2.093 1.00 0.00 N ATOM 0 H GLN A 5 2.582 -2.294 -1.231 1.00 0.00 H new ATOM 0 HA GLN A 5 4.472 -3.987 -2.349 1.00 0.00 H new ATOM 0 HB2 GLN A 5 3.216 -3.991 0.473 1.00 0.00 H new ATOM 0 HB3 GLN A 5 4.791 -4.658 0.094 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.556 -2.684 0.921 1.00 0.00 H new ATOM 0 HG3 GLN A 5 5.215 -2.083 -0.689 1.00 0.00 H new ATOM 0 HE21 GLN A 5 4.189 -2.088 2.678 1.00 0.00 H new ATOM 0 HE22 GLN A 5 2.952 -0.837 2.522 1.00 0.00 H new ATOM 47 N GLN A 6 1.833 -5.795 -1.791 1.00 0.00 N ATOM 48 CA GLN A 6 1.201 -7.043 -2.320 1.00 0.00 C ATOM 49 C GLN A 6 1.546 -7.419 -3.807 1.00 0.00 C ATOM 50 O GLN A 6 1.772 -8.597 -4.097 1.00 0.00 O ATOM 51 CB GLN A 6 -0.339 -6.920 -2.141 1.00 0.00 C ATOM 52 CG GLN A 6 -0.888 -6.774 -0.697 1.00 0.00 C ATOM 53 CD GLN A 6 -2.418 -6.659 -0.609 1.00 0.00 C ATOM 54 OE1 GLN A 6 -3.179 -7.037 -1.494 1.00 0.00 O ATOM 55 NE2 GLN A 6 -2.929 -6.149 0.484 1.00 0.00 N ATOM 0 H GLN A 6 1.165 -5.149 -1.369 1.00 0.00 H new ATOM 0 HA GLN A 6 1.624 -7.863 -1.740 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.676 -6.058 -2.717 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.800 -7.801 -2.588 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -0.566 -7.634 -0.110 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -0.442 -5.891 -0.239 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -2.315 -5.828 1.233 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -3.941 -6.073 0.586 1.00 0.00 H new ATOM 64 N LEU A 7 1.622 -6.433 -4.724 1.00 0.00 N ATOM 65 CA LEU A 7 2.128 -6.642 -6.112 1.00 0.00 C ATOM 66 C LEU A 7 3.681 -6.855 -6.284 1.00 0.00 C ATOM 67 O LEU A 7 4.113 -7.123 -7.409 1.00 0.00 O ATOM 68 CB LEU A 7 1.684 -5.450 -7.017 1.00 0.00 C ATOM 69 CG LEU A 7 0.219 -4.931 -7.002 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.047 -3.870 -8.101 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.851 -6.015 -7.191 1.00 0.00 C ATOM 0 H LEU A 7 1.338 -5.472 -4.533 1.00 0.00 H new ATOM 0 HA LEU A 7 1.682 -7.591 -6.410 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.324 -4.604 -6.766 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.913 -5.729 -8.046 1.00 0.00 H new ATOM 0 HG LEU A 7 0.062 -4.519 -6.005 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.979 -3.503 -8.095 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.730 -3.041 -7.917 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.268 -4.313 -9.072 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.840 -5.558 -7.166 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.703 -6.509 -8.152 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.770 -6.749 -6.390 1.00 0.00 H new ATOM 83 N GLU A 8 4.524 -6.727 -5.239 1.00 0.00 N ATOM 84 CA GLU A 8 6.007 -6.793 -5.366 1.00 0.00 C ATOM 85 C GLU A 8 6.558 -8.244 -5.187 1.00 0.00 C ATOM 86 O GLU A 8 6.170 -8.985 -4.274 1.00 0.00 O ATOM 87 CB GLU A 8 6.670 -5.822 -4.354 1.00 0.00 C ATOM 88 CG GLU A 8 6.396 -4.317 -4.600 1.00 0.00 C ATOM 89 CD GLU A 8 7.186 -3.405 -3.679 1.00 0.00 C ATOM 90 OE1 GLU A 8 6.786 -3.216 -2.514 1.00 0.00 O ATOM 91 OE2 GLU A 8 8.202 -2.845 -4.130 1.00 0.00 O ATOM 0 H GLU A 8 4.204 -6.575 -4.283 1.00 0.00 H new ATOM 0 HA GLU A 8 6.263 -6.485 -6.380 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.325 -6.078 -3.352 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.748 -5.985 -4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.638 -4.075 -5.635 1.00 0.00 H new ATOM 0 HG3 GLU A 8 5.332 -4.122 -4.468 1.00 0.00 H new ATOM 98 N GLY A 9 7.490 -8.634 -6.070 1.00 0.00 N ATOM 99 CA GLY A 9 8.090 -9.992 -6.059 1.00 0.00 C ATOM 100 C GLY A 9 8.555 -10.498 -7.442 1.00 0.00 C ATOM 101 O GLY A 9 8.491 -9.804 -8.461 1.00 0.00 O ATOM 0 H GLY A 9 7.851 -8.029 -6.808 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.943 -9.993 -5.380 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.361 -10.694 -5.656 1.00 0.00 H new ATOM 105 N ARG A 10 9.024 -11.752 -7.457 1.00 0.00 N ATOM 106 CA ARG A 10 9.342 -12.487 -8.714 1.00 0.00 C ATOM 107 C ARG A 10 8.112 -13.345 -9.142 1.00 0.00 C ATOM 108 O ARG A 10 7.661 -14.219 -8.396 1.00 0.00 O ATOM 109 CB ARG A 10 10.621 -13.321 -8.447 1.00 0.00 C ATOM 110 CG ARG A 10 11.174 -14.098 -9.670 1.00 0.00 C ATOM 111 CD ARG A 10 12.479 -14.861 -9.361 1.00 0.00 C ATOM 112 NE ARG A 10 13.668 -13.959 -9.387 1.00 0.00 N ATOM 113 CZ ARG A 10 14.445 -13.727 -10.449 1.00 0.00 C ATOM 114 NH1 ARG A 10 14.282 -14.286 -11.625 1.00 0.00 N ATOM 115 NH2 ARG A 10 15.433 -12.890 -10.313 1.00 0.00 N ATOM 0 H ARG A 10 9.197 -12.294 -6.610 1.00 0.00 H new ATOM 0 HA ARG A 10 9.541 -11.816 -9.550 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.400 -12.653 -8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.410 -14.034 -7.650 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.420 -14.805 -10.015 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.353 -13.399 -10.487 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.401 -15.332 -8.381 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.614 -15.661 -10.089 1.00 0.00 H new ATOM 0 HE ARG A 10 13.908 -13.479 -8.520 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.520 -14.948 -11.774 1.00 0.00 H new ATOM 0 HH12 ARG A 10 14.917 -14.059 -12.390 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.595 -12.434 -9.415 1.00 0.00 H new ATOM 0 HH22 ARG A 10 16.045 -12.691 -11.104 1.00 0.00 H new ATOM 129 N TRP A 11 7.563 -13.074 -10.335 1.00 0.00 N ATOM 130 CA TRP A 11 6.226 -13.592 -10.734 1.00 0.00 C ATOM 131 C TRP A 11 6.326 -14.458 -12.025 1.00 0.00 C ATOM 132 O TRP A 11 6.693 -13.945 -13.086 1.00 0.00 O ATOM 133 CB TRP A 11 5.294 -12.368 -10.941 1.00 0.00 C ATOM 134 CG TRP A 11 4.937 -11.559 -9.693 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.373 -10.248 -9.419 1.00 0.00 C ATOM 136 CD2 TRP A 11 4.061 -11.882 -8.678 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.766 -9.732 -8.262 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.950 -10.754 -7.829 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.308 -13.056 -8.416 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.056 -10.772 -6.739 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.454 -13.057 -7.316 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.320 -11.934 -6.495 1.00 0.00 C ATOM 0 H TRP A 11 8.016 -12.501 -11.047 1.00 0.00 H new ATOM 0 HA TRP A 11 5.821 -14.241 -9.958 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.767 -11.697 -11.658 1.00 0.00 H new ATOM 0 HB3 TRP A 11 4.368 -12.719 -11.396 1.00 0.00 H new ATOM 0 HD1 TRP A 11 6.086 -9.707 -10.023 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.899 -8.813 -7.840 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.395 -13.925 -9.052 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 2.942 -9.905 -6.105 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.882 -13.946 -7.092 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.637 -11.965 -5.659 1.00 0.00 H new ATOM 153 N ARG A 12 5.974 -15.755 -11.961 1.00 0.00 N ATOM 154 CA ARG A 12 6.074 -16.675 -13.124 1.00 0.00 C ATOM 155 C ARG A 12 4.691 -17.013 -13.749 1.00 0.00 C ATOM 156 O ARG A 12 3.799 -17.528 -13.069 1.00 0.00 O ATOM 157 CB ARG A 12 6.824 -17.929 -12.631 1.00 0.00 C ATOM 158 CG ARG A 12 7.145 -18.952 -13.748 1.00 0.00 C ATOM 159 CD ARG A 12 8.000 -20.151 -13.285 1.00 0.00 C ATOM 160 NE ARG A 12 9.295 -19.851 -12.600 1.00 0.00 N ATOM 161 CZ ARG A 12 10.250 -19.035 -13.052 1.00 0.00 C ATOM 162 NH1 ARG A 12 10.317 -18.602 -14.282 1.00 0.00 N ATOM 163 NH2 ARG A 12 11.160 -18.620 -12.221 1.00 0.00 N ATOM 0 H ARG A 12 5.615 -16.197 -11.115 1.00 0.00 H new ATOM 0 HA ARG A 12 6.620 -16.197 -13.937 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.756 -17.620 -12.158 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.225 -18.420 -11.864 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.209 -19.327 -14.161 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.667 -18.439 -14.555 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.394 -20.755 -12.610 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.216 -20.767 -14.158 1.00 0.00 H new ATOM 0 HE ARG A 12 9.464 -20.312 -11.706 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.612 -18.887 -14.962 1.00 0.00 H new ATOM 0 HH12 ARG A 12 11.074 -17.979 -14.563 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.135 -18.919 -11.246 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.899 -17.996 -12.544 1.00 0.00 H new ATOM 177 N LEU A 13 4.538 -16.806 -15.070 1.00 0.00 N ATOM 178 CA LEU A 13 3.277 -17.144 -15.788 1.00 0.00 C ATOM 179 C LEU A 13 3.052 -18.684 -15.932 1.00 0.00 C ATOM 180 O LEU A 13 3.892 -19.416 -16.466 1.00 0.00 O ATOM 181 CB LEU A 13 3.270 -16.417 -17.157 1.00 0.00 C ATOM 182 CG LEU A 13 2.010 -16.559 -18.053 1.00 0.00 C ATOM 183 CD1 LEU A 13 0.714 -16.176 -17.323 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.165 -15.696 -19.317 1.00 0.00 C ATOM 0 H LEU A 13 5.263 -16.409 -15.667 1.00 0.00 H new ATOM 0 HA LEU A 13 2.434 -16.794 -15.192 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.429 -15.355 -16.971 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.127 -16.773 -17.728 1.00 0.00 H new ATOM 0 HG LEU A 13 1.930 -17.612 -18.322 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.133 -16.295 -17.999 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.580 -16.823 -16.456 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.774 -15.138 -16.996 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.277 -15.801 -19.940 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.286 -14.651 -19.032 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.042 -16.024 -19.876 1.00 0.00 H new ATOM 196 N VAL A 14 1.890 -19.137 -15.450 1.00 0.00 N ATOM 197 CA VAL A 14 1.507 -20.581 -15.405 1.00 0.00 C ATOM 198 C VAL A 14 0.202 -20.873 -16.218 1.00 0.00 C ATOM 199 O VAL A 14 0.226 -21.728 -17.107 1.00 0.00 O ATOM 200 CB VAL A 14 1.500 -21.144 -13.937 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.931 -21.414 -13.418 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.744 -20.294 -12.881 1.00 0.00 C ATOM 0 H VAL A 14 1.172 -18.518 -15.073 1.00 0.00 H new ATOM 0 HA VAL A 14 2.286 -21.145 -15.919 1.00 0.00 H new ATOM 0 HB VAL A 14 0.938 -22.072 -14.042 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.882 -21.802 -12.401 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.420 -22.145 -14.062 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.502 -20.485 -13.425 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.808 -20.781 -11.908 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.195 -19.303 -12.821 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.302 -20.199 -13.171 1.00 0.00 H new ATOM 212 N ASP A 15 -0.919 -20.186 -15.929 1.00 0.00 N ATOM 213 CA ASP A 15 -2.221 -20.399 -16.617 1.00 0.00 C ATOM 214 C ASP A 15 -2.540 -19.153 -17.512 1.00 0.00 C ATOM 215 O ASP A 15 -2.988 -18.104 -17.034 1.00 0.00 O ATOM 216 CB ASP A 15 -3.229 -20.737 -15.489 1.00 0.00 C ATOM 217 CG ASP A 15 -4.696 -20.895 -15.862 1.00 0.00 C ATOM 218 OD1 ASP A 15 -5.022 -21.280 -17.003 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.560 -20.581 -15.013 1.00 0.00 O ATOM 0 H ASP A 15 -0.955 -19.463 -15.210 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.245 -21.226 -17.327 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.903 -21.664 -15.018 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.159 -19.954 -14.734 1.00 0.00 H new ATOM 224 N SER A 16 -2.256 -19.280 -18.820 1.00 0.00 N ATOM 225 CA SER A 16 -2.378 -18.175 -19.812 1.00 0.00 C ATOM 226 C SER A 16 -3.499 -18.457 -20.863 1.00 0.00 C ATOM 227 O SER A 16 -3.280 -19.137 -21.871 1.00 0.00 O ATOM 228 CB SER A 16 -0.984 -17.928 -20.451 1.00 0.00 C ATOM 229 OG SER A 16 -0.497 -19.055 -21.187 1.00 0.00 O ATOM 0 H SER A 16 -1.932 -20.156 -19.231 1.00 0.00 H new ATOM 0 HA SER A 16 -2.692 -17.260 -19.310 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.043 -17.066 -21.115 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.270 -17.678 -19.666 1.00 0.00 H new ATOM 0 HG SER A 16 -1.236 -19.468 -21.680 1.00 0.00 H new ATOM 235 N LYS A 17 -4.713 -17.925 -20.633 1.00 0.00 N ATOM 236 CA LYS A 17 -5.886 -18.163 -21.528 1.00 0.00 C ATOM 237 C LYS A 17 -6.241 -16.893 -22.367 1.00 0.00 C ATOM 238 O LYS A 17 -6.475 -15.816 -21.809 1.00 0.00 O ATOM 239 CB LYS A 17 -7.057 -18.735 -20.681 1.00 0.00 C ATOM 240 CG LYS A 17 -7.740 -17.772 -19.672 1.00 0.00 C ATOM 241 CD LYS A 17 -8.257 -18.453 -18.389 1.00 0.00 C ATOM 242 CE LYS A 17 -7.115 -18.766 -17.403 1.00 0.00 C ATOM 243 NZ LYS A 17 -7.607 -19.603 -16.283 1.00 0.00 N ATOM 0 H LYS A 17 -4.919 -17.324 -19.835 1.00 0.00 H new ATOM 0 HA LYS A 17 -5.643 -18.912 -22.281 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -7.821 -19.104 -21.366 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.684 -19.596 -20.126 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.030 -16.993 -19.394 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.576 -17.279 -20.168 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.988 -17.806 -17.904 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -8.773 -19.376 -18.651 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.309 -19.283 -17.924 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -6.698 -17.837 -17.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -6.875 -19.663 -15.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -8.467 -19.176 -15.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.825 -20.558 -16.633 1.00 0.00 H new ATOM 257 N GLY A 18 -6.263 -17.025 -23.706 1.00 0.00 N ATOM 258 CA GLY A 18 -6.595 -15.894 -24.624 1.00 0.00 C ATOM 259 C GLY A 18 -5.496 -14.866 -25.005 1.00 0.00 C ATOM 260 O GLY A 18 -5.841 -13.784 -25.482 1.00 0.00 O ATOM 0 H GLY A 18 -6.056 -17.900 -24.187 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -6.972 -16.326 -25.551 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.418 -15.339 -24.173 1.00 0.00 H new ATOM 264 N PHE A 19 -4.194 -15.171 -24.841 1.00 0.00 N ATOM 265 CA PHE A 19 -3.095 -14.204 -25.149 1.00 0.00 C ATOM 266 C PHE A 19 -2.717 -14.066 -26.663 1.00 0.00 C ATOM 267 O PHE A 19 -2.570 -12.930 -27.126 1.00 0.00 O ATOM 268 CB PHE A 19 -1.909 -14.455 -24.176 1.00 0.00 C ATOM 269 CG PHE A 19 -0.827 -13.352 -24.115 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.164 -12.022 -23.826 1.00 0.00 C ATOM 271 CD2 PHE A 19 0.516 -13.680 -24.330 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.181 -11.037 -23.792 1.00 0.00 C ATOM 273 CE2 PHE A 19 1.501 -12.696 -24.279 1.00 0.00 C ATOM 274 CZ PHE A 19 1.151 -11.375 -24.017 1.00 0.00 C ATOM 0 H PHE A 19 -3.867 -16.074 -24.498 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.472 -13.199 -24.961 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.313 -14.594 -23.173 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.427 -15.391 -24.458 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.193 -11.760 -23.628 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.791 -14.704 -24.537 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.451 -10.011 -23.591 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.536 -12.958 -24.443 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.914 -10.611 -23.988 1.00 0.00 H new ATOM 284 N ASP A 20 -2.648 -15.161 -27.455 1.00 0.00 N ATOM 285 CA ASP A 20 -2.713 -15.070 -28.950 1.00 0.00 C ATOM 286 C ASP A 20 -3.984 -14.323 -29.507 1.00 0.00 C ATOM 287 O ASP A 20 -3.852 -13.474 -30.391 1.00 0.00 O ATOM 288 CB ASP A 20 -2.534 -16.494 -29.551 1.00 0.00 C ATOM 289 CG ASP A 20 -2.168 -16.498 -31.039 1.00 0.00 C ATOM 290 OD1 ASP A 20 -0.986 -16.277 -31.360 1.00 0.00 O ATOM 291 OD2 ASP A 20 -3.046 -16.636 -31.917 1.00 0.00 O ATOM 0 H ASP A 20 -2.548 -16.111 -27.099 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.891 -14.433 -29.277 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.757 -17.018 -28.994 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.458 -17.055 -29.413 1.00 0.00 H new ATOM 296 N GLU A 21 -5.184 -14.592 -28.953 1.00 0.00 N ATOM 297 CA GLU A 21 -6.432 -13.823 -29.234 1.00 0.00 C ATOM 298 C GLU A 21 -6.374 -12.289 -28.907 1.00 0.00 C ATOM 299 O GLU A 21 -6.727 -11.480 -29.771 1.00 0.00 O ATOM 300 CB GLU A 21 -7.621 -14.539 -28.537 1.00 0.00 C ATOM 301 CG GLU A 21 -7.952 -15.961 -29.064 1.00 0.00 C ATOM 302 CD GLU A 21 -9.017 -16.682 -28.261 1.00 0.00 C ATOM 303 OE1 GLU A 21 -8.687 -17.232 -27.190 1.00 0.00 O ATOM 304 OE2 GLU A 21 -10.180 -16.722 -28.713 1.00 0.00 O ATOM 0 H GLU A 21 -5.324 -15.355 -28.291 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.570 -13.824 -30.315 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.405 -14.608 -27.471 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.509 -13.916 -28.643 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.281 -15.886 -30.100 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.041 -16.560 -29.061 1.00 0.00 H new ATOM 311 N TYR A 22 -5.890 -11.867 -27.719 1.00 0.00 N ATOM 312 CA TYR A 22 -5.513 -10.444 -27.444 1.00 0.00 C ATOM 313 C TYR A 22 -4.545 -9.801 -28.504 1.00 0.00 C ATOM 314 O TYR A 22 -4.890 -8.775 -29.096 1.00 0.00 O ATOM 315 CB TYR A 22 -5.012 -10.376 -25.969 1.00 0.00 C ATOM 316 CG TYR A 22 -4.360 -9.050 -25.531 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.136 -7.918 -25.262 1.00 0.00 C ATOM 318 CD2 TYR A 22 -2.963 -8.953 -25.480 1.00 0.00 C ATOM 319 CE1 TYR A 22 -4.522 -6.705 -24.953 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.353 -7.742 -25.163 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.132 -6.616 -24.907 1.00 0.00 C ATOM 322 OH TYR A 22 -2.527 -5.414 -24.640 1.00 0.00 O ATOM 0 H TYR A 22 -5.747 -12.489 -26.923 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.390 -9.807 -27.557 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -5.858 -10.576 -25.311 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.291 -11.179 -25.815 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.214 -7.984 -25.294 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.356 -9.822 -25.688 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.125 -5.832 -24.749 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.276 -7.676 -25.116 1.00 0.00 H new ATOM 0 HH TYR A 22 -1.554 -5.529 -24.644 1.00 0.00 H new ATOM 332 N MET A 23 -3.371 -10.405 -28.773 1.00 0.00 N ATOM 333 CA MET A 23 -2.473 -9.970 -29.881 1.00 0.00 C ATOM 334 C MET A 23 -3.044 -10.046 -31.350 1.00 0.00 C ATOM 335 O MET A 23 -2.603 -9.279 -32.210 1.00 0.00 O ATOM 336 CB MET A 23 -1.127 -10.716 -29.689 1.00 0.00 C ATOM 337 CG MET A 23 -0.278 -10.301 -28.461 1.00 0.00 C ATOM 338 SD MET A 23 -0.044 -11.666 -27.304 1.00 0.00 S ATOM 339 CE MET A 23 1.129 -12.711 -28.185 1.00 0.00 C ATOM 0 H MET A 23 -3.014 -11.199 -28.241 1.00 0.00 H new ATOM 0 HA MET A 23 -2.347 -8.891 -29.797 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.336 -11.783 -29.615 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.525 -10.570 -30.586 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.694 -9.941 -28.798 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.765 -9.471 -27.948 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.359 -13.589 -27.581 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.694 -13.026 -29.134 1.00 0.00 H new ATOM 0 HE3 MET A 23 2.045 -12.151 -28.374 1.00 0.00 H new ATOM 349 N LYS A 24 -4.053 -10.891 -31.639 1.00 0.00 N ATOM 350 CA LYS A 24 -4.936 -10.759 -32.837 1.00 0.00 C ATOM 351 C LYS A 24 -5.832 -9.472 -32.876 1.00 0.00 C ATOM 352 O LYS A 24 -5.840 -8.820 -33.923 1.00 0.00 O ATOM 353 CB LYS A 24 -5.787 -12.053 -32.982 1.00 0.00 C ATOM 354 CG LYS A 24 -5.034 -13.296 -33.522 1.00 0.00 C ATOM 355 CD LYS A 24 -5.622 -14.671 -33.114 1.00 0.00 C ATOM 356 CE LYS A 24 -7.138 -14.913 -33.281 1.00 0.00 C ATOM 357 NZ LYS A 24 -7.534 -14.962 -34.714 1.00 0.00 N ATOM 0 H LYS A 24 -4.288 -11.691 -31.051 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.275 -10.634 -33.694 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.207 -12.301 -32.007 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.625 -11.842 -33.646 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.012 -13.240 -34.610 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.000 -13.248 -33.180 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.101 -15.436 -33.689 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.375 -14.837 -32.065 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.412 -15.850 -32.796 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.691 -14.119 -32.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.558 -15.126 -34.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.295 -14.059 -35.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.026 -15.735 -35.188 1.00 0.00 H new ATOM 371 N GLU A 25 -6.547 -9.070 -31.795 1.00 0.00 N ATOM 372 CA GLU A 25 -7.183 -7.711 -31.725 1.00 0.00 C ATOM 373 C GLU A 25 -6.180 -6.500 -31.789 1.00 0.00 C ATOM 374 O GLU A 25 -6.483 -5.510 -32.462 1.00 0.00 O ATOM 375 CB GLU A 25 -8.194 -7.612 -30.544 1.00 0.00 C ATOM 376 CG GLU A 25 -9.134 -6.370 -30.628 1.00 0.00 C ATOM 377 CD GLU A 25 -10.215 -6.199 -29.566 1.00 0.00 C ATOM 378 OE1 GLU A 25 -9.918 -6.225 -28.354 1.00 0.00 O ATOM 379 OE2 GLU A 25 -11.385 -5.986 -29.941 1.00 0.00 O ATOM 0 H GLU A 25 -6.701 -9.649 -30.969 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.751 -7.612 -32.650 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -8.802 -8.516 -30.521 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.641 -7.576 -29.605 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -8.507 -5.479 -30.609 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.626 -6.393 -31.600 1.00 0.00 H new ATOM 386 N LEU A 26 -4.980 -6.577 -31.172 1.00 0.00 N ATOM 387 CA LEU A 26 -3.861 -5.632 -31.471 1.00 0.00 C ATOM 388 C LEU A 26 -3.419 -5.573 -32.982 1.00 0.00 C ATOM 389 O LEU A 26 -3.282 -4.482 -33.541 1.00 0.00 O ATOM 390 CB LEU A 26 -2.612 -5.938 -30.587 1.00 0.00 C ATOM 391 CG LEU A 26 -2.701 -5.920 -29.039 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.306 -6.191 -28.443 1.00 0.00 C ATOM 393 CD2 LEU A 26 -3.215 -4.591 -28.476 1.00 0.00 C ATOM 0 H LEU A 26 -4.754 -7.277 -30.466 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.273 -4.652 -31.232 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.253 -6.926 -30.874 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.839 -5.224 -30.870 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.416 -6.695 -28.761 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.367 -6.179 -27.355 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.951 -7.167 -28.776 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.612 -5.420 -28.776 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.253 -4.647 -27.388 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.544 -3.785 -28.775 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.214 -4.394 -28.864 1.00 0.00 H new ATOM 405 N GLY A 27 -3.133 -6.726 -33.614 1.00 0.00 N ATOM 406 CA GLY A 27 -2.468 -6.790 -34.941 1.00 0.00 C ATOM 407 C GLY A 27 -0.955 -7.061 -34.831 1.00 0.00 C ATOM 408 O GLY A 27 -0.148 -6.154 -35.047 1.00 0.00 O ATOM 0 H GLY A 27 -3.354 -7.642 -33.225 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.932 -7.575 -35.539 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -2.628 -5.850 -35.470 1.00 0.00 H new ATOM 412 N VAL A 28 -0.605 -8.303 -34.470 1.00 0.00 N ATOM 413 CA VAL A 28 0.804 -8.725 -34.183 1.00 0.00 C ATOM 414 C VAL A 28 1.193 -9.868 -35.185 1.00 0.00 C ATOM 415 O VAL A 28 0.435 -10.825 -35.402 1.00 0.00 O ATOM 416 CB VAL A 28 0.929 -9.185 -32.687 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.318 -9.743 -32.286 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.592 -8.086 -31.654 1.00 0.00 C ATOM 0 H VAL A 28 -1.282 -9.058 -34.364 1.00 0.00 H new ATOM 0 HA VAL A 28 1.494 -7.892 -34.321 1.00 0.00 H new ATOM 0 HB VAL A 28 0.187 -9.983 -32.655 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.304 -10.033 -31.235 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.552 -10.613 -32.900 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.077 -8.976 -32.440 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.703 -8.487 -30.647 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.270 -7.243 -31.786 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.435 -7.752 -31.800 1.00 0.00 H new ATOM 428 N GLY A 29 2.418 -9.797 -35.740 1.00 0.00 N ATOM 429 CA GLY A 29 2.941 -10.839 -36.670 1.00 0.00 C ATOM 430 C GLY A 29 3.163 -12.257 -36.081 1.00 0.00 C ATOM 431 O GLY A 29 3.414 -12.428 -34.886 1.00 0.00 O ATOM 0 H GLY A 29 3.070 -9.033 -35.566 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.249 -10.924 -37.508 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.890 -10.487 -37.075 1.00 0.00 H new ATOM 435 N ILE A 30 3.084 -13.283 -36.942 1.00 0.00 N ATOM 436 CA ILE A 30 3.030 -14.722 -36.526 1.00 0.00 C ATOM 437 C ILE A 30 4.255 -15.230 -35.681 1.00 0.00 C ATOM 438 O ILE A 30 4.047 -15.827 -34.622 1.00 0.00 O ATOM 439 CB ILE A 30 2.691 -15.646 -37.757 1.00 0.00 C ATOM 440 CG1 ILE A 30 1.595 -15.116 -38.742 1.00 0.00 C ATOM 441 CG2 ILE A 30 2.269 -17.066 -37.296 1.00 0.00 C ATOM 442 CD1 ILE A 30 2.137 -14.291 -39.926 1.00 0.00 C ATOM 0 H ILE A 30 3.055 -13.154 -37.953 1.00 0.00 H new ATOM 0 HA ILE A 30 2.209 -14.791 -35.813 1.00 0.00 H new ATOM 0 HB ILE A 30 3.628 -15.658 -38.313 1.00 0.00 H new ATOM 0 HG12 ILE A 30 1.037 -15.966 -39.135 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.889 -14.502 -38.182 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.042 -17.679 -38.168 1.00 0.00 H new ATOM 0 HG22 ILE A 30 3.083 -17.523 -36.733 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.385 -16.995 -36.662 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.307 -13.967 -40.554 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.669 -13.418 -39.548 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.819 -14.904 -40.515 1.00 0.00 H new ATOM 454 N ALA A 31 5.507 -14.968 -36.105 1.00 0.00 N ATOM 455 CA ALA A 31 6.712 -15.177 -35.247 1.00 0.00 C ATOM 456 C ALA A 31 6.755 -14.393 -33.887 1.00 0.00 C ATOM 457 O ALA A 31 7.084 -14.983 -32.854 1.00 0.00 O ATOM 458 CB ALA A 31 7.944 -14.886 -36.125 1.00 0.00 C ATOM 0 H ALA A 31 5.720 -14.610 -37.036 1.00 0.00 H new ATOM 0 HA ALA A 31 6.686 -16.210 -34.900 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.851 -15.027 -35.537 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.954 -15.567 -36.976 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.900 -13.858 -36.484 1.00 0.00 H new ATOM 464 N LEU A 32 6.381 -13.099 -33.884 1.00 0.00 N ATOM 465 CA LEU A 32 6.180 -12.286 -32.645 1.00 0.00 C ATOM 466 C LEU A 32 5.077 -12.832 -31.669 1.00 0.00 C ATOM 467 O LEU A 32 5.348 -12.959 -30.470 1.00 0.00 O ATOM 468 CB LEU A 32 5.929 -10.803 -33.059 1.00 0.00 C ATOM 469 CG LEU A 32 7.072 -10.072 -33.824 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.546 -8.814 -34.533 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.240 -9.679 -32.904 1.00 0.00 C ATOM 0 H LEU A 32 6.206 -12.575 -34.741 1.00 0.00 H new ATOM 0 HA LEU A 32 7.092 -12.360 -32.053 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.034 -10.773 -33.681 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.709 -10.233 -32.156 1.00 0.00 H new ATOM 0 HG LEU A 32 7.444 -10.783 -34.562 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.365 -8.323 -35.059 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.773 -9.096 -35.248 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.127 -8.129 -33.796 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.009 -9.173 -33.488 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.879 -9.010 -32.123 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.662 -10.575 -32.448 1.00 0.00 H new ATOM 483 N ARG A 33 3.880 -13.221 -32.164 1.00 0.00 N ATOM 484 CA ARG A 33 2.884 -13.987 -31.355 1.00 0.00 C ATOM 485 C ARG A 33 3.360 -15.391 -30.862 1.00 0.00 C ATOM 486 O ARG A 33 3.166 -15.698 -29.687 1.00 0.00 O ATOM 487 CB ARG A 33 1.509 -14.146 -32.053 1.00 0.00 C ATOM 488 CG ARG A 33 0.800 -12.867 -32.560 1.00 0.00 C ATOM 489 CD ARG A 33 -0.734 -12.907 -32.759 1.00 0.00 C ATOM 490 NE ARG A 33 -1.280 -14.235 -33.139 1.00 0.00 N ATOM 491 CZ ARG A 33 -1.527 -14.682 -34.353 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.275 -14.004 -35.446 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.050 -15.869 -34.433 1.00 0.00 N ATOM 0 H ARG A 33 3.574 -13.021 -33.116 1.00 0.00 H new ATOM 0 HA ARG A 33 2.775 -13.352 -30.476 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.642 -14.814 -32.904 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.837 -14.647 -31.356 1.00 0.00 H new ATOM 0 HG2 ARG A 33 1.023 -12.063 -31.858 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.252 -12.593 -33.513 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.214 -12.583 -31.836 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.005 -12.185 -33.529 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.487 -14.874 -32.372 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -0.864 -13.073 -35.385 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.490 -14.408 -36.358 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.246 -16.398 -33.583 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.265 -16.271 -35.345 1.00 0.00 H new ATOM 507 N LYS A 34 3.996 -16.223 -31.713 1.00 0.00 N ATOM 508 CA LYS A 34 4.643 -17.495 -31.285 1.00 0.00 C ATOM 509 C LYS A 34 5.709 -17.359 -30.144 1.00 0.00 C ATOM 510 O LYS A 34 5.681 -18.164 -29.214 1.00 0.00 O ATOM 511 CB LYS A 34 5.148 -18.179 -32.584 1.00 0.00 C ATOM 512 CG LYS A 34 5.604 -19.655 -32.471 1.00 0.00 C ATOM 513 CD LYS A 34 7.075 -19.892 -32.045 1.00 0.00 C ATOM 514 CE LYS A 34 8.176 -19.467 -33.041 1.00 0.00 C ATOM 515 NZ LYS A 34 8.176 -20.336 -34.252 1.00 0.00 N ATOM 0 H LYS A 34 4.079 -16.039 -32.713 1.00 0.00 H new ATOM 0 HA LYS A 34 3.916 -18.132 -30.781 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.351 -18.127 -33.326 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.983 -17.595 -32.971 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.956 -20.159 -31.754 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.446 -20.136 -33.436 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.245 -19.362 -31.108 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.199 -20.955 -31.837 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.022 -18.429 -33.336 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.150 -19.519 -32.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.926 -20.026 -34.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.347 -21.323 -33.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.254 -20.267 -34.729 1.00 0.00 H new ATOM 529 N MET A 35 6.599 -16.346 -30.168 1.00 0.00 N ATOM 530 CA MET A 35 7.426 -15.977 -28.979 1.00 0.00 C ATOM 531 C MET A 35 6.629 -15.497 -27.715 1.00 0.00 C ATOM 532 O MET A 35 6.948 -15.942 -26.612 1.00 0.00 O ATOM 533 CB MET A 35 8.490 -14.917 -29.383 1.00 0.00 C ATOM 534 CG MET A 35 9.581 -15.364 -30.380 1.00 0.00 C ATOM 535 SD MET A 35 10.894 -14.127 -30.515 1.00 0.00 S ATOM 536 CE MET A 35 10.022 -12.718 -31.229 1.00 0.00 C ATOM 0 H MET A 35 6.770 -15.766 -30.989 1.00 0.00 H new ATOM 0 HA MET A 35 7.900 -16.907 -28.665 1.00 0.00 H new ATOM 0 HB2 MET A 35 7.969 -14.061 -29.812 1.00 0.00 H new ATOM 0 HB3 MET A 35 8.983 -14.569 -28.475 1.00 0.00 H new ATOM 0 HG2 MET A 35 10.005 -16.314 -30.056 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.134 -15.532 -31.360 1.00 0.00 H new ATOM 0 HE1 MET A 35 10.743 -11.957 -31.527 1.00 0.00 H new ATOM 0 HE2 MET A 35 9.457 -13.044 -32.102 1.00 0.00 H new ATOM 0 HE3 MET A 35 9.338 -12.301 -30.490 1.00 0.00 H new ATOM 546 N GLY A 36 5.617 -14.617 -27.849 1.00 0.00 N ATOM 547 CA GLY A 36 4.744 -14.211 -26.709 1.00 0.00 C ATOM 548 C GLY A 36 3.797 -15.271 -26.087 1.00 0.00 C ATOM 549 O GLY A 36 3.744 -15.392 -24.861 1.00 0.00 O ATOM 0 H GLY A 36 5.377 -14.168 -28.733 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.389 -13.836 -25.914 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.131 -13.374 -27.043 1.00 0.00 H new ATOM 553 N ALA A 37 3.034 -16.005 -26.913 1.00 0.00 N ATOM 554 CA ALA A 37 2.029 -17.001 -26.453 1.00 0.00 C ATOM 555 C ALA A 37 2.546 -18.206 -25.599 1.00 0.00 C ATOM 556 O ALA A 37 1.960 -18.482 -24.549 1.00 0.00 O ATOM 557 CB ALA A 37 1.248 -17.443 -27.707 1.00 0.00 C ATOM 0 H ALA A 37 3.091 -15.930 -27.929 1.00 0.00 H new ATOM 0 HA ALA A 37 1.393 -16.508 -25.718 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.494 -18.178 -27.426 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.762 -16.577 -28.157 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.936 -17.887 -28.426 1.00 0.00 H new ATOM 563 N MET A 38 3.631 -18.897 -26.006 1.00 0.00 N ATOM 564 CA MET A 38 4.256 -19.978 -25.176 1.00 0.00 C ATOM 565 C MET A 38 5.318 -19.544 -24.096 1.00 0.00 C ATOM 566 O MET A 38 5.977 -20.411 -23.510 1.00 0.00 O ATOM 567 CB MET A 38 4.768 -21.084 -26.145 1.00 0.00 C ATOM 568 CG MET A 38 6.038 -20.774 -26.950 1.00 0.00 C ATOM 569 SD MET A 38 6.400 -22.157 -28.039 1.00 0.00 S ATOM 570 CE MET A 38 8.040 -21.640 -28.548 1.00 0.00 C ATOM 0 H MET A 38 4.099 -18.736 -26.898 1.00 0.00 H new ATOM 0 HA MET A 38 3.473 -20.360 -24.521 1.00 0.00 H new ATOM 0 HB2 MET A 38 4.949 -21.987 -25.562 1.00 0.00 H new ATOM 0 HB3 MET A 38 3.968 -21.314 -26.849 1.00 0.00 H new ATOM 0 HG2 MET A 38 5.900 -19.863 -27.533 1.00 0.00 H new ATOM 0 HG3 MET A 38 6.876 -20.597 -26.276 1.00 0.00 H new ATOM 0 HE1 MET A 38 8.454 -22.373 -29.240 1.00 0.00 H new ATOM 0 HE2 MET A 38 7.979 -20.670 -29.041 1.00 0.00 H new ATOM 0 HE3 MET A 38 8.685 -21.562 -27.673 1.00 0.00 H new ATOM 580 N ALA A 39 5.486 -18.240 -23.798 1.00 0.00 N ATOM 581 CA ALA A 39 6.471 -17.756 -22.803 1.00 0.00 C ATOM 582 C ALA A 39 5.975 -17.862 -21.330 1.00 0.00 C ATOM 583 O ALA A 39 4.898 -17.374 -20.975 1.00 0.00 O ATOM 584 CB ALA A 39 6.811 -16.299 -23.168 1.00 0.00 C ATOM 0 H ALA A 39 4.947 -17.494 -24.237 1.00 0.00 H new ATOM 0 HA ALA A 39 7.354 -18.394 -22.846 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.536 -15.905 -22.456 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.233 -16.265 -24.172 1.00 0.00 H new ATOM 0 HB3 ALA A 39 5.905 -15.695 -23.134 1.00 0.00 H new ATOM 590 N LYS A 40 6.825 -18.426 -20.457 1.00 0.00 N ATOM 591 CA LYS A 40 6.639 -18.368 -18.980 1.00 0.00 C ATOM 592 C LYS A 40 7.714 -17.427 -18.316 1.00 0.00 C ATOM 593 O LYS A 40 8.655 -17.949 -17.705 1.00 0.00 O ATOM 594 CB LYS A 40 6.515 -19.814 -18.414 1.00 0.00 C ATOM 595 CG LYS A 40 7.672 -20.815 -18.668 1.00 0.00 C ATOM 596 CD LYS A 40 7.343 -22.226 -18.137 1.00 0.00 C ATOM 597 CE LYS A 40 8.478 -23.225 -18.418 1.00 0.00 C ATOM 598 NZ LYS A 40 8.112 -24.575 -17.909 1.00 0.00 N ATOM 0 H LYS A 40 7.661 -18.936 -20.744 1.00 0.00 H new ATOM 0 HA LYS A 40 5.697 -17.889 -18.713 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.376 -19.736 -17.336 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.604 -20.252 -18.822 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.877 -20.869 -19.737 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.580 -20.449 -18.188 1.00 0.00 H new ATOM 0 HD2 LYS A 40 7.161 -22.176 -17.063 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.423 -22.583 -18.600 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.673 -23.273 -19.489 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.398 -22.886 -17.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.886 -25.241 -18.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.948 -24.526 -16.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.246 -24.902 -18.383 1.00 0.00 H new ATOM 612 N PRO A 41 7.647 -16.057 -18.401 1.00 0.00 N ATOM 613 CA PRO A 41 8.741 -15.165 -17.920 1.00 0.00 C ATOM 614 C PRO A 41 8.879 -15.030 -16.376 1.00 0.00 C ATOM 615 O PRO A 41 7.904 -15.182 -15.635 1.00 0.00 O ATOM 616 CB PRO A 41 8.346 -13.813 -18.558 1.00 0.00 C ATOM 617 CG PRO A 41 6.826 -13.861 -18.689 1.00 0.00 C ATOM 618 CD PRO A 41 6.579 -15.309 -19.101 1.00 0.00 C ATOM 0 HA PRO A 41 9.718 -15.559 -18.199 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.661 -12.976 -17.934 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.821 -13.683 -19.530 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.329 -13.615 -17.750 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.460 -13.158 -19.437 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.588 -15.648 -18.799 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.644 -15.435 -20.182 1.00 0.00 H new ATOM 626 N ASP A 42 10.077 -14.629 -15.917 1.00 0.00 N ATOM 627 CA ASP A 42 10.255 -14.089 -14.539 1.00 0.00 C ATOM 628 C ASP A 42 9.925 -12.561 -14.556 1.00 0.00 C ATOM 629 O ASP A 42 10.759 -11.733 -14.937 1.00 0.00 O ATOM 630 CB ASP A 42 11.695 -14.348 -14.019 1.00 0.00 C ATOM 631 CG ASP A 42 12.033 -15.774 -13.611 1.00 0.00 C ATOM 632 OD1 ASP A 42 12.067 -16.674 -14.472 1.00 0.00 O ATOM 633 OD2 ASP A 42 12.296 -16.018 -12.414 1.00 0.00 O ATOM 0 H ASP A 42 10.935 -14.664 -16.467 1.00 0.00 H new ATOM 0 HA ASP A 42 9.576 -14.599 -13.856 1.00 0.00 H new ATOM 0 HB2 ASP A 42 12.396 -14.042 -14.795 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.867 -13.699 -13.160 1.00 0.00 H new ATOM 638 N CYS A 43 8.698 -12.187 -14.155 1.00 0.00 N ATOM 639 CA CYS A 43 8.285 -10.767 -14.049 1.00 0.00 C ATOM 640 C CYS A 43 8.620 -10.203 -12.638 1.00 0.00 C ATOM 641 O CYS A 43 7.941 -10.477 -11.645 1.00 0.00 O ATOM 642 CB CYS A 43 6.802 -10.669 -14.452 1.00 0.00 C ATOM 643 SG CYS A 43 6.231 -8.936 -14.373 1.00 0.00 S ATOM 0 H CYS A 43 7.967 -12.849 -13.896 1.00 0.00 H new ATOM 0 HA CYS A 43 8.846 -10.132 -14.735 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.667 -11.057 -15.462 1.00 0.00 H new ATOM 0 HB3 CYS A 43 6.197 -11.288 -13.789 1.00 0.00 H new ATOM 0 HG CYS A 43 4.979 -8.875 -14.718 1.00 0.00 H new ATOM 649 N ILE A 44 9.716 -9.438 -12.559 1.00 0.00 N ATOM 650 CA ILE A 44 10.280 -8.939 -11.273 1.00 0.00 C ATOM 651 C ILE A 44 9.682 -7.519 -11.016 1.00 0.00 C ATOM 652 O ILE A 44 9.968 -6.582 -11.770 1.00 0.00 O ATOM 653 CB ILE A 44 11.849 -8.944 -11.323 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.512 -10.305 -11.724 1.00 0.00 C ATOM 655 CG2 ILE A 44 12.470 -8.460 -9.987 1.00 0.00 C ATOM 656 CD1 ILE A 44 13.636 -10.140 -12.763 1.00 0.00 C ATOM 0 H ILE A 44 10.246 -9.141 -13.378 1.00 0.00 H new ATOM 0 HA ILE A 44 10.009 -9.589 -10.441 1.00 0.00 H new ATOM 0 HB ILE A 44 12.071 -8.244 -12.129 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.916 -10.783 -10.832 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.748 -10.971 -12.125 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.557 -8.478 -10.063 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.138 -7.443 -9.779 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.152 -9.118 -9.178 1.00 0.00 H new ATOM 0 HD11 ILE A 44 14.057 -11.117 -13.001 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.231 -9.689 -13.669 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.417 -9.498 -12.355 1.00 0.00 H new ATOM 668 N ILE A 45 8.859 -7.374 -9.966 1.00 0.00 N ATOM 669 CA ILE A 45 8.159 -6.090 -9.653 1.00 0.00 C ATOM 670 C ILE A 45 8.728 -5.539 -8.302 1.00 0.00 C ATOM 671 O ILE A 45 8.725 -6.228 -7.275 1.00 0.00 O ATOM 672 CB ILE A 45 6.594 -6.255 -9.697 1.00 0.00 C ATOM 673 CG1 ILE A 45 6.096 -6.779 -11.084 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.863 -4.933 -9.325 1.00 0.00 C ATOM 675 CD1 ILE A 45 4.586 -7.025 -11.232 1.00 0.00 C ATOM 0 H ILE A 45 8.653 -8.126 -9.309 1.00 0.00 H new ATOM 0 HA ILE A 45 8.358 -5.341 -10.419 1.00 0.00 H new ATOM 0 HB ILE A 45 6.345 -7.005 -8.947 1.00 0.00 H new ATOM 0 HG12 ILE A 45 6.399 -6.062 -11.847 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.615 -7.713 -11.300 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.785 -5.089 -9.367 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.147 -4.632 -8.317 1.00 0.00 H new ATOM 0 HG23 ILE A 45 6.144 -4.151 -10.030 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.373 -7.386 -12.238 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.266 -7.770 -10.504 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.047 -6.094 -11.059 1.00 0.00 H new ATOM 687 N THR A 46 9.222 -4.287 -8.290 1.00 0.00 N ATOM 688 CA THR A 46 9.631 -3.578 -7.032 1.00 0.00 C ATOM 689 C THR A 46 9.475 -2.031 -7.229 1.00 0.00 C ATOM 690 O THR A 46 9.884 -1.483 -8.258 1.00 0.00 O ATOM 691 CB THR A 46 11.061 -4.013 -6.571 1.00 0.00 C ATOM 692 OG1 THR A 46 11.098 -5.425 -6.373 1.00 0.00 O ATOM 693 CG2 THR A 46 11.519 -3.403 -5.235 1.00 0.00 C ATOM 0 H THR A 46 9.354 -3.731 -9.135 1.00 0.00 H new ATOM 0 HA THR A 46 8.969 -3.867 -6.215 1.00 0.00 H new ATOM 0 HB THR A 46 11.719 -3.661 -7.365 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.183 -5.774 -6.336 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.521 -3.761 -4.996 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.532 -2.316 -5.317 1.00 0.00 H new ATOM 0 HG23 THR A 46 10.830 -3.699 -4.444 1.00 0.00 H new ATOM 701 N CYS A 47 8.875 -1.318 -6.255 1.00 0.00 N ATOM 702 CA CYS A 47 8.618 0.143 -6.357 1.00 0.00 C ATOM 703 C CYS A 47 9.636 1.049 -5.596 1.00 0.00 C ATOM 704 O CYS A 47 9.785 0.981 -4.372 1.00 0.00 O ATOM 705 CB CYS A 47 7.152 0.420 -5.951 1.00 0.00 C ATOM 706 SG CYS A 47 6.876 0.171 -4.161 1.00 0.00 S ATOM 0 H CYS A 47 8.555 -1.730 -5.379 1.00 0.00 H new ATOM 0 HA CYS A 47 8.774 0.426 -7.398 1.00 0.00 H new ATOM 0 HB2 CYS A 47 6.889 1.443 -6.219 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.490 -0.237 -6.514 1.00 0.00 H new ATOM 0 HG CYS A 47 7.979 0.406 -3.515 1.00 0.00 H new ATOM 712 N ASP A 48 10.263 1.985 -6.332 1.00 0.00 N ATOM 713 CA ASP A 48 10.968 3.160 -5.742 1.00 0.00 C ATOM 714 C ASP A 48 9.937 4.307 -5.420 1.00 0.00 C ATOM 715 O ASP A 48 9.813 5.305 -6.139 1.00 0.00 O ATOM 716 CB ASP A 48 12.129 3.467 -6.733 1.00 0.00 C ATOM 717 CG ASP A 48 12.837 4.811 -6.578 1.00 0.00 C ATOM 718 OD1 ASP A 48 13.574 4.996 -5.588 1.00 0.00 O ATOM 719 OD2 ASP A 48 12.642 5.690 -7.450 1.00 0.00 O ATOM 0 H ASP A 48 10.301 1.957 -7.351 1.00 0.00 H new ATOM 0 HA ASP A 48 11.419 2.997 -4.763 1.00 0.00 H new ATOM 0 HB2 ASP A 48 12.875 2.678 -6.635 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.733 3.408 -7.747 1.00 0.00 H new ATOM 724 N GLY A 49 9.152 4.120 -4.336 1.00 0.00 N ATOM 725 CA GLY A 49 8.061 5.055 -3.937 1.00 0.00 C ATOM 726 C GLY A 49 6.883 5.169 -4.931 1.00 0.00 C ATOM 727 O GLY A 49 5.908 4.420 -4.849 1.00 0.00 O ATOM 0 H GLY A 49 9.251 3.321 -3.710 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.669 4.736 -2.971 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.491 6.047 -3.795 1.00 0.00 H new ATOM 731 N LYS A 50 7.014 6.101 -5.885 1.00 0.00 N ATOM 732 CA LYS A 50 6.175 6.105 -7.120 1.00 0.00 C ATOM 733 C LYS A 50 6.743 5.269 -8.319 1.00 0.00 C ATOM 734 O LYS A 50 5.942 4.813 -9.134 1.00 0.00 O ATOM 735 CB LYS A 50 5.873 7.565 -7.565 1.00 0.00 C ATOM 736 CG LYS A 50 4.990 8.402 -6.601 1.00 0.00 C ATOM 737 CD LYS A 50 4.631 9.812 -7.127 1.00 0.00 C ATOM 738 CE LYS A 50 3.527 9.825 -8.204 1.00 0.00 C ATOM 739 NZ LYS A 50 3.382 11.175 -8.805 1.00 0.00 N ATOM 0 H LYS A 50 7.688 6.866 -5.838 1.00 0.00 H new ATOM 0 HA LYS A 50 5.253 5.597 -6.838 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.821 8.085 -7.702 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.384 7.533 -8.538 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.068 7.855 -6.405 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.509 8.504 -5.648 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.311 10.430 -6.288 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.529 10.273 -7.538 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.766 9.101 -8.983 1.00 0.00 H new ATOM 0 HE3 LYS A 50 2.580 9.517 -7.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.538 11.196 -9.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.283 11.883 -8.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.224 11.393 -9.375 1.00 0.00 H new ATOM 753 N ASN A 51 8.067 5.085 -8.490 1.00 0.00 N ATOM 754 CA ASN A 51 8.657 4.464 -9.715 1.00 0.00 C ATOM 755 C ASN A 51 8.585 2.902 -9.668 1.00 0.00 C ATOM 756 O ASN A 51 9.500 2.211 -9.203 1.00 0.00 O ATOM 757 CB ASN A 51 10.095 5.010 -9.929 1.00 0.00 C ATOM 758 CG ASN A 51 10.210 6.533 -10.097 1.00 0.00 C ATOM 759 OD1 ASN A 51 9.578 7.140 -10.960 1.00 0.00 O ATOM 760 ND2 ASN A 51 10.977 7.196 -9.263 1.00 0.00 N ATOM 0 H ASN A 51 8.762 5.357 -7.794 1.00 0.00 H new ATOM 0 HA ASN A 51 8.064 4.747 -10.585 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.708 4.709 -9.080 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.518 4.532 -10.813 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.047 8.211 -9.332 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.503 6.696 -8.546 1.00 0.00 H new ATOM 767 N LEU A 52 7.461 2.350 -10.156 1.00 0.00 N ATOM 768 CA LEU A 52 7.151 0.902 -10.074 1.00 0.00 C ATOM 769 C LEU A 52 7.867 0.134 -11.228 1.00 0.00 C ATOM 770 O LEU A 52 7.573 0.309 -12.415 1.00 0.00 O ATOM 771 CB LEU A 52 5.609 0.767 -9.958 1.00 0.00 C ATOM 772 CG LEU A 52 5.082 -0.670 -9.680 1.00 0.00 C ATOM 773 CD1 LEU A 52 3.912 -0.673 -8.681 1.00 0.00 C ATOM 774 CD2 LEU A 52 4.636 -1.348 -10.979 1.00 0.00 C ATOM 0 H LEU A 52 6.735 2.894 -10.622 1.00 0.00 H new ATOM 0 HA LEU A 52 7.552 0.413 -9.186 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.263 1.423 -9.159 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.159 1.127 -10.883 1.00 0.00 H new ATOM 0 HG LEU A 52 5.910 -1.227 -9.241 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.576 -1.697 -8.517 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.240 -0.243 -7.735 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.089 -0.081 -9.082 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.272 -2.351 -10.759 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.838 -0.765 -11.438 1.00 0.00 H new ATOM 0 HD23 LEU A 52 5.481 -1.411 -11.665 1.00 0.00 H new ATOM 786 N THR A 53 8.885 -0.653 -10.850 1.00 0.00 N ATOM 787 CA THR A 53 9.911 -1.169 -11.798 1.00 0.00 C ATOM 788 C THR A 53 9.588 -2.646 -12.151 1.00 0.00 C ATOM 789 O THR A 53 9.641 -3.533 -11.296 1.00 0.00 O ATOM 790 CB THR A 53 11.334 -0.939 -11.210 1.00 0.00 C ATOM 791 OG1 THR A 53 11.526 0.446 -10.919 1.00 0.00 O ATOM 792 CG2 THR A 53 12.477 -1.329 -12.163 1.00 0.00 C ATOM 0 H THR A 53 9.029 -0.954 -9.886 1.00 0.00 H new ATOM 0 HA THR A 53 9.891 -0.622 -12.740 1.00 0.00 H new ATOM 0 HB THR A 53 11.375 -1.573 -10.325 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.423 0.581 -10.548 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.435 -1.139 -11.679 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.399 -2.388 -12.410 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.408 -0.737 -13.076 1.00 0.00 H new ATOM 800 N ILE A 54 9.233 -2.873 -13.422 1.00 0.00 N ATOM 801 CA ILE A 54 8.768 -4.190 -13.938 1.00 0.00 C ATOM 802 C ILE A 54 9.888 -4.707 -14.898 1.00 0.00 C ATOM 803 O ILE A 54 10.095 -4.129 -15.970 1.00 0.00 O ATOM 804 CB ILE A 54 7.360 -3.998 -14.621 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.231 -3.600 -13.614 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.885 -5.244 -15.414 1.00 0.00 C ATOM 807 CD1 ILE A 54 5.054 -2.828 -14.226 1.00 0.00 C ATOM 0 H ILE A 54 9.257 -2.147 -14.138 1.00 0.00 H new ATOM 0 HA ILE A 54 8.617 -4.939 -13.161 1.00 0.00 H new ATOM 0 HB ILE A 54 7.526 -3.175 -15.316 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.847 -4.507 -13.146 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.670 -2.994 -12.821 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.910 -5.043 -15.858 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.603 -5.469 -16.203 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.808 -6.097 -14.740 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.326 -2.599 -13.448 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.418 -1.900 -14.667 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.582 -3.436 -14.997 1.00 0.00 H new ATOM 819 N LYS A 55 10.583 -5.802 -14.536 1.00 0.00 N ATOM 820 CA LYS A 55 11.525 -6.501 -15.458 1.00 0.00 C ATOM 821 C LYS A 55 10.943 -7.893 -15.856 1.00 0.00 C ATOM 822 O LYS A 55 10.980 -8.837 -15.065 1.00 0.00 O ATOM 823 CB LYS A 55 12.933 -6.598 -14.804 1.00 0.00 C ATOM 824 CG LYS A 55 14.047 -7.036 -15.786 1.00 0.00 C ATOM 825 CD LYS A 55 15.363 -7.509 -15.139 1.00 0.00 C ATOM 826 CE LYS A 55 16.446 -7.713 -16.219 1.00 0.00 C ATOM 827 NZ LYS A 55 17.591 -8.513 -15.713 1.00 0.00 N ATOM 0 H LYS A 55 10.516 -6.229 -13.612 1.00 0.00 H new ATOM 0 HA LYS A 55 11.642 -5.930 -16.379 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.195 -5.628 -14.381 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.891 -7.306 -13.976 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.660 -7.842 -16.409 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.270 -6.200 -16.449 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.702 -6.774 -14.408 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.197 -8.442 -14.600 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.008 -8.213 -17.083 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.805 -6.742 -16.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.354 -8.513 -16.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.941 -8.097 -14.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.281 -9.490 -15.538 1.00 0.00 H new ATOM 841 N THR A 56 10.439 -8.023 -17.092 1.00 0.00 N ATOM 842 CA THR A 56 9.909 -9.308 -17.636 1.00 0.00 C ATOM 843 C THR A 56 11.063 -10.076 -18.356 1.00 0.00 C ATOM 844 O THR A 56 11.422 -9.750 -19.491 1.00 0.00 O ATOM 845 CB THR A 56 8.682 -9.006 -18.554 1.00 0.00 C ATOM 846 OG1 THR A 56 7.663 -8.320 -17.831 1.00 0.00 O ATOM 847 CG2 THR A 56 7.989 -10.245 -19.138 1.00 0.00 C ATOM 0 H THR A 56 10.382 -7.248 -17.752 1.00 0.00 H new ATOM 0 HA THR A 56 9.551 -9.962 -16.841 1.00 0.00 H new ATOM 0 HB THR A 56 9.113 -8.418 -19.364 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.905 -8.140 -18.425 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.150 -9.933 -19.761 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.700 -10.808 -19.742 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.624 -10.874 -18.326 1.00 0.00 H new ATOM 855 N GLU A 57 11.634 -11.086 -17.682 1.00 0.00 N ATOM 856 CA GLU A 57 12.811 -11.853 -18.184 1.00 0.00 C ATOM 857 C GLU A 57 12.378 -13.149 -18.942 1.00 0.00 C ATOM 858 O GLU A 57 11.772 -14.060 -18.368 1.00 0.00 O ATOM 859 CB GLU A 57 13.722 -12.177 -16.966 1.00 0.00 C ATOM 860 CG GLU A 57 14.605 -11.019 -16.455 1.00 0.00 C ATOM 861 CD GLU A 57 16.006 -10.933 -17.024 1.00 0.00 C ATOM 862 OE1 GLU A 57 16.160 -10.613 -18.217 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.969 -11.018 -16.228 1.00 0.00 O ATOM 0 H GLU A 57 11.301 -11.403 -16.772 1.00 0.00 H new ATOM 0 HA GLU A 57 13.360 -11.254 -18.910 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.090 -12.516 -16.145 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.370 -13.011 -17.234 1.00 0.00 H new ATOM 0 HG2 GLU A 57 14.093 -10.081 -16.667 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.682 -11.102 -15.371 1.00 0.00 H new ATOM 870 N SER A 58 12.718 -13.229 -20.241 1.00 0.00 N ATOM 871 CA SER A 58 12.497 -14.441 -21.081 1.00 0.00 C ATOM 872 C SER A 58 13.501 -14.512 -22.274 1.00 0.00 C ATOM 873 O SER A 58 13.742 -13.523 -22.978 1.00 0.00 O ATOM 874 CB SER A 58 11.044 -14.463 -21.618 1.00 0.00 C ATOM 875 OG SER A 58 10.755 -15.660 -22.344 1.00 0.00 O ATOM 0 H SER A 58 13.155 -12.459 -20.747 1.00 0.00 H new ATOM 0 HA SER A 58 12.666 -15.312 -20.448 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.349 -14.369 -20.784 1.00 0.00 H new ATOM 0 HB3 SER A 58 10.884 -13.600 -22.265 1.00 0.00 H new ATOM 0 HG SER A 58 9.829 -15.633 -22.663 1.00 0.00 H new ATOM 881 N THR A 59 14.009 -15.724 -22.564 1.00 0.00 N ATOM 882 CA THR A 59 14.735 -16.027 -23.843 1.00 0.00 C ATOM 883 C THR A 59 13.916 -15.831 -25.169 1.00 0.00 C ATOM 884 O THR A 59 14.490 -15.401 -26.173 1.00 0.00 O ATOM 885 CB THR A 59 15.372 -17.452 -23.804 1.00 0.00 C ATOM 886 OG1 THR A 59 14.383 -18.453 -23.580 1.00 0.00 O ATOM 887 CG2 THR A 59 16.469 -17.653 -22.747 1.00 0.00 C ATOM 0 H THR A 59 13.937 -16.524 -21.935 1.00 0.00 H new ATOM 0 HA THR A 59 15.512 -15.264 -23.885 1.00 0.00 H new ATOM 0 HB THR A 59 15.837 -17.547 -24.785 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.809 -19.335 -23.562 1.00 0.00 H new ATOM 0 HG21 THR A 59 16.845 -18.674 -22.803 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.285 -16.955 -22.933 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.056 -17.472 -21.755 1.00 0.00 H new ATOM 895 N LEU A 60 12.595 -16.104 -25.180 1.00 0.00 N ATOM 896 CA LEU A 60 11.696 -15.759 -26.320 1.00 0.00 C ATOM 897 C LEU A 60 11.528 -14.215 -26.545 1.00 0.00 C ATOM 898 O LEU A 60 11.808 -13.728 -27.647 1.00 0.00 O ATOM 899 CB LEU A 60 10.337 -16.502 -26.145 1.00 0.00 C ATOM 900 CG LEU A 60 10.343 -18.053 -26.247 1.00 0.00 C ATOM 901 CD1 LEU A 60 8.974 -18.623 -25.846 1.00 0.00 C ATOM 902 CD2 LEU A 60 10.693 -18.565 -27.657 1.00 0.00 C ATOM 0 H LEU A 60 12.116 -16.567 -24.408 1.00 0.00 H new ATOM 0 HA LEU A 60 12.168 -16.105 -27.239 1.00 0.00 H new ATOM 0 HB2 LEU A 60 9.930 -16.232 -25.171 1.00 0.00 H new ATOM 0 HB3 LEU A 60 9.646 -16.119 -26.896 1.00 0.00 H new ATOM 0 HG LEU A 60 11.119 -18.395 -25.563 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.996 -19.710 -25.923 1.00 0.00 H new ATOM 0 HD12 LEU A 60 8.747 -18.337 -24.819 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.206 -18.227 -26.511 1.00 0.00 H new ATOM 0 HD21 LEU A 60 10.680 -19.655 -27.662 1.00 0.00 H new ATOM 0 HD22 LEU A 60 9.961 -18.190 -28.372 1.00 0.00 H new ATOM 0 HD23 LEU A 60 11.686 -18.212 -27.936 1.00 0.00 H new ATOM 914 N LYS A 61 11.110 -13.426 -25.530 1.00 0.00 N ATOM 915 CA LYS A 61 11.196 -11.941 -25.589 1.00 0.00 C ATOM 916 C LYS A 61 11.272 -11.312 -24.163 1.00 0.00 C ATOM 917 O LYS A 61 10.286 -11.295 -23.420 1.00 0.00 O ATOM 918 CB LYS A 61 10.042 -11.366 -26.464 1.00 0.00 C ATOM 919 CG LYS A 61 10.142 -9.874 -26.863 1.00 0.00 C ATOM 920 CD LYS A 61 11.431 -9.364 -27.555 1.00 0.00 C ATOM 921 CE LYS A 61 11.733 -9.932 -28.958 1.00 0.00 C ATOM 922 NZ LYS A 61 12.469 -11.229 -28.896 1.00 0.00 N ATOM 0 H LYS A 61 10.711 -13.786 -24.663 1.00 0.00 H new ATOM 0 HA LYS A 61 12.129 -11.660 -26.077 1.00 0.00 H new ATOM 0 HB2 LYS A 61 9.982 -11.958 -27.377 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.105 -11.511 -25.927 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.305 -9.654 -27.525 1.00 0.00 H new ATOM 0 HG3 LYS A 61 9.998 -9.282 -25.959 1.00 0.00 H new ATOM 0 HD2 LYS A 61 11.369 -8.279 -27.633 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.278 -9.589 -26.907 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.798 -10.073 -29.500 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.322 -9.209 -29.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 12.590 -11.606 -29.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 13.402 -11.078 -28.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.928 -11.908 -28.324 1.00 0.00 H new ATOM 936 N THR A 62 12.444 -10.751 -23.812 1.00 0.00 N ATOM 937 CA THR A 62 12.622 -9.923 -22.580 1.00 0.00 C ATOM 938 C THR A 62 12.119 -8.452 -22.804 1.00 0.00 C ATOM 939 O THR A 62 12.185 -7.898 -23.909 1.00 0.00 O ATOM 940 CB THR A 62 14.121 -10.022 -22.149 1.00 0.00 C ATOM 941 OG1 THR A 62 14.437 -11.362 -21.777 1.00 0.00 O ATOM 942 CG2 THR A 62 14.535 -9.182 -20.927 1.00 0.00 C ATOM 0 H THR A 62 13.296 -10.851 -24.363 1.00 0.00 H new ATOM 0 HA THR A 62 12.007 -10.301 -21.763 1.00 0.00 H new ATOM 0 HB THR A 62 14.649 -9.649 -23.027 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.311 -11.954 -22.548 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.595 -9.332 -20.724 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.351 -8.127 -21.131 1.00 0.00 H new ATOM 0 HG23 THR A 62 13.952 -9.491 -20.059 1.00 0.00 H new ATOM 950 N THR A 63 11.566 -7.814 -21.757 1.00 0.00 N ATOM 951 CA THR A 63 11.097 -6.390 -21.813 1.00 0.00 C ATOM 952 C THR A 63 11.101 -5.779 -20.372 1.00 0.00 C ATOM 953 O THR A 63 10.661 -6.418 -19.413 1.00 0.00 O ATOM 954 CB THR A 63 9.700 -6.289 -22.506 1.00 0.00 C ATOM 955 OG1 THR A 63 9.758 -6.848 -23.818 1.00 0.00 O ATOM 956 CG2 THR A 63 9.159 -4.864 -22.689 1.00 0.00 C ATOM 0 H THR A 63 11.426 -8.255 -20.848 1.00 0.00 H new ATOM 0 HA THR A 63 11.784 -5.804 -22.423 1.00 0.00 H new ATOM 0 HB THR A 63 9.037 -6.827 -21.828 1.00 0.00 H new ATOM 0 HG1 THR A 63 10.694 -6.933 -24.096 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.186 -4.904 -23.179 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.056 -4.386 -21.715 1.00 0.00 H new ATOM 0 HG23 THR A 63 9.851 -4.288 -23.304 1.00 0.00 H new ATOM 964 N GLN A 64 11.584 -4.532 -20.206 1.00 0.00 N ATOM 965 CA GLN A 64 11.663 -3.870 -18.866 1.00 0.00 C ATOM 966 C GLN A 64 11.340 -2.341 -18.875 1.00 0.00 C ATOM 967 O GLN A 64 11.671 -1.627 -19.827 1.00 0.00 O ATOM 968 CB GLN A 64 13.016 -4.191 -18.173 1.00 0.00 C ATOM 969 CG GLN A 64 14.315 -3.572 -18.756 1.00 0.00 C ATOM 970 CD GLN A 64 15.526 -3.735 -17.832 1.00 0.00 C ATOM 971 OE1 GLN A 64 16.272 -4.706 -17.895 1.00 0.00 O ATOM 972 NE2 GLN A 64 15.744 -2.808 -16.927 1.00 0.00 N ATOM 0 H GLN A 64 11.927 -3.955 -20.974 1.00 0.00 H new ATOM 0 HA GLN A 64 10.860 -4.303 -18.269 1.00 0.00 H new ATOM 0 HB2 GLN A 64 12.938 -3.876 -17.132 1.00 0.00 H new ATOM 0 HB3 GLN A 64 13.138 -5.274 -18.170 1.00 0.00 H new ATOM 0 HG2 GLN A 64 14.533 -4.038 -19.717 1.00 0.00 H new ATOM 0 HG3 GLN A 64 14.151 -2.511 -18.947 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.128 -1.997 -16.869 1.00 0.00 H new ATOM 0 HE22 GLN A 64 16.530 -2.899 -16.283 1.00 0.00 H new ATOM 981 N PHE A 65 10.722 -1.834 -17.788 1.00 0.00 N ATOM 982 CA PHE A 65 10.352 -0.391 -17.653 1.00 0.00 C ATOM 983 C PHE A 65 10.154 0.058 -16.163 1.00 0.00 C ATOM 984 O PHE A 65 9.715 -0.717 -15.308 1.00 0.00 O ATOM 985 CB PHE A 65 9.119 -0.028 -18.542 1.00 0.00 C ATOM 986 CG PHE A 65 7.787 -0.754 -18.264 1.00 0.00 C ATOM 987 CD1 PHE A 65 6.921 -0.291 -17.267 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.404 -1.845 -19.051 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.675 -0.885 -17.089 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.167 -2.453 -18.854 1.00 0.00 C ATOM 991 CZ PHE A 65 5.299 -1.965 -17.882 1.00 0.00 C ATOM 0 H PHE A 65 10.463 -2.400 -16.980 1.00 0.00 H new ATOM 0 HA PHE A 65 11.204 0.178 -18.024 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.942 1.043 -18.446 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.390 -0.214 -19.581 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.221 0.530 -16.633 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.071 -2.217 -19.815 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.000 -0.508 -16.335 1.00 0.00 H new ATOM 0 HE2 PHE A 65 5.881 -3.303 -19.456 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.332 -2.425 -17.743 1.00 0.00 H new ATOM 1001 N SER A 66 10.419 1.348 -15.880 1.00 0.00 N ATOM 1002 CA SER A 66 10.079 1.992 -14.578 1.00 0.00 C ATOM 1003 C SER A 66 8.894 2.990 -14.743 1.00 0.00 C ATOM 1004 O SER A 66 9.077 4.072 -15.316 1.00 0.00 O ATOM 1005 CB SER A 66 11.342 2.684 -14.014 1.00 0.00 C ATOM 1006 OG SER A 66 11.731 3.808 -14.810 1.00 0.00 O ATOM 0 H SER A 66 10.874 1.979 -16.540 1.00 0.00 H new ATOM 0 HA SER A 66 9.751 1.233 -13.868 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.152 3.011 -12.992 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.162 1.967 -13.972 1.00 0.00 H new ATOM 0 HG SER A 66 10.932 4.245 -15.171 1.00 0.00 H new ATOM 1012 N CYS A 67 7.699 2.636 -14.242 1.00 0.00 N ATOM 1013 CA CYS A 67 6.489 3.484 -14.382 1.00 0.00 C ATOM 1014 C CYS A 67 6.195 4.328 -13.105 1.00 0.00 C ATOM 1015 O CYS A 67 5.872 3.796 -12.038 1.00 0.00 O ATOM 1016 CB CYS A 67 5.319 2.567 -14.790 1.00 0.00 C ATOM 1017 SG CYS A 67 4.930 1.289 -13.546 1.00 0.00 S ATOM 0 H CYS A 67 7.538 1.766 -13.734 1.00 0.00 H new ATOM 0 HA CYS A 67 6.647 4.232 -15.159 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.432 3.177 -14.963 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.561 2.081 -15.735 1.00 0.00 H new ATOM 0 HG CYS A 67 6.027 0.701 -13.170 1.00 0.00 H new ATOM 1023 N THR A 68 6.278 5.664 -13.226 1.00 0.00 N ATOM 1024 CA THR A 68 5.975 6.611 -12.111 1.00 0.00 C ATOM 1025 C THR A 68 4.432 6.662 -11.842 1.00 0.00 C ATOM 1026 O THR A 68 3.650 7.133 -12.670 1.00 0.00 O ATOM 1027 CB THR A 68 6.598 8.005 -12.425 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.973 7.898 -12.797 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.568 8.993 -11.250 1.00 0.00 C ATOM 0 H THR A 68 6.555 6.128 -14.091 1.00 0.00 H new ATOM 0 HA THR A 68 6.431 6.261 -11.185 1.00 0.00 H new ATOM 0 HB THR A 68 5.974 8.379 -13.236 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.534 7.953 -11.995 1.00 0.00 H new ATOM 0 HG21 THR A 68 7.021 9.936 -11.556 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.535 9.168 -10.948 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.126 8.578 -10.411 1.00 0.00 H new ATOM 1037 N LEU A 69 4.011 6.121 -10.688 1.00 0.00 N ATOM 1038 CA LEU A 69 2.603 5.732 -10.421 1.00 0.00 C ATOM 1039 C LEU A 69 1.638 6.949 -10.244 1.00 0.00 C ATOM 1040 O LEU A 69 1.727 7.701 -9.272 1.00 0.00 O ATOM 1041 CB LEU A 69 2.687 4.811 -9.169 1.00 0.00 C ATOM 1042 CG LEU A 69 1.417 4.009 -8.814 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.142 2.910 -9.850 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.565 3.392 -7.412 1.00 0.00 C ATOM 0 H LEU A 69 4.637 5.937 -9.904 1.00 0.00 H new ATOM 0 HA LEU A 69 2.159 5.215 -11.272 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.504 4.106 -9.319 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.952 5.427 -8.310 1.00 0.00 H new ATOM 0 HG LEU A 69 0.569 4.694 -8.821 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.241 2.364 -9.571 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.002 3.362 -10.832 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.987 2.222 -9.884 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.666 2.827 -7.166 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.428 2.726 -7.397 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.707 4.186 -6.678 1.00 0.00 H new ATOM 1056 N GLY A 70 0.745 7.147 -11.219 1.00 0.00 N ATOM 1057 CA GLY A 70 0.064 8.446 -11.459 1.00 0.00 C ATOM 1058 C GLY A 70 0.221 8.985 -12.901 1.00 0.00 C ATOM 1059 O GLY A 70 -0.775 9.314 -13.550 1.00 0.00 O ATOM 0 H GLY A 70 0.466 6.415 -11.872 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -0.997 8.334 -11.238 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.458 9.185 -10.761 1.00 0.00 H new ATOM 1063 N GLU A 71 1.468 9.113 -13.380 1.00 0.00 N ATOM 1064 CA GLU A 71 1.802 9.815 -14.644 1.00 0.00 C ATOM 1065 C GLU A 71 1.961 8.847 -15.881 1.00 0.00 C ATOM 1066 O GLU A 71 1.704 7.628 -15.843 1.00 0.00 O ATOM 1067 CB GLU A 71 3.044 10.724 -14.337 1.00 0.00 C ATOM 1068 CG GLU A 71 2.829 11.922 -13.362 1.00 0.00 C ATOM 1069 CD GLU A 71 3.053 11.621 -11.887 1.00 0.00 C ATOM 1070 OE1 GLU A 71 4.223 11.543 -11.456 1.00 0.00 O ATOM 1071 OE2 GLU A 71 2.075 11.481 -11.118 1.00 0.00 O ATOM 0 H GLU A 71 2.285 8.732 -12.902 1.00 0.00 H new ATOM 0 HA GLU A 71 0.974 10.444 -14.971 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.832 10.092 -13.927 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.414 11.121 -15.283 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.500 12.730 -13.655 1.00 0.00 H new ATOM 0 HG3 GLU A 71 1.811 12.291 -13.488 1.00 0.00 H new ATOM 1078 N LYS A 72 2.311 9.474 -17.023 1.00 0.00 N ATOM 1079 CA LYS A 72 2.449 8.809 -18.343 1.00 0.00 C ATOM 1080 C LYS A 72 3.944 8.488 -18.704 1.00 0.00 C ATOM 1081 O LYS A 72 4.824 9.352 -18.657 1.00 0.00 O ATOM 1082 CB LYS A 72 1.749 9.737 -19.378 1.00 0.00 C ATOM 1083 CG LYS A 72 1.599 9.144 -20.801 1.00 0.00 C ATOM 1084 CD LYS A 72 0.766 10.012 -21.779 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.693 9.566 -22.022 1.00 0.00 C ATOM 1086 NZ LYS A 72 -1.580 10.017 -20.917 1.00 0.00 N ATOM 0 H LYS A 72 2.510 10.474 -17.058 1.00 0.00 H new ATOM 0 HA LYS A 72 1.972 7.829 -18.337 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.758 9.992 -19.002 1.00 0.00 H new ATOM 0 HB3 LYS A 72 2.313 10.667 -19.447 1.00 0.00 H new ATOM 0 HG2 LYS A 72 2.592 8.995 -21.224 1.00 0.00 H new ATOM 0 HG3 LYS A 72 1.135 8.161 -20.723 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.752 11.034 -21.401 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.281 10.034 -22.739 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.049 9.974 -22.968 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.736 8.480 -22.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.554 9.705 -21.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.252 9.607 -20.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.555 11.055 -20.854 1.00 0.00 H new ATOM 1100 N PHE A 73 4.190 7.236 -19.112 1.00 0.00 N ATOM 1101 CA PHE A 73 5.504 6.741 -19.633 1.00 0.00 C ATOM 1102 C PHE A 73 5.357 6.127 -21.079 1.00 0.00 C ATOM 1103 O PHE A 73 4.278 6.145 -21.676 1.00 0.00 O ATOM 1104 CB PHE A 73 6.115 5.788 -18.547 1.00 0.00 C ATOM 1105 CG PHE A 73 5.464 4.394 -18.399 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.228 4.259 -17.760 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.030 3.283 -19.035 1.00 0.00 C ATOM 1108 CE1 PHE A 73 3.536 3.055 -17.823 1.00 0.00 C ATOM 1109 CE2 PHE A 73 5.337 2.078 -19.089 1.00 0.00 C ATOM 1110 CZ PHE A 73 4.092 1.962 -18.481 1.00 0.00 C ATOM 0 H PHE A 73 3.474 6.510 -19.095 1.00 0.00 H new ATOM 0 HA PHE A 73 6.214 7.554 -19.784 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.172 5.647 -18.774 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.061 6.293 -17.582 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.809 5.093 -17.216 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.008 3.362 -19.485 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.564 2.968 -17.360 1.00 0.00 H new ATOM 0 HE2 PHE A 73 5.767 1.231 -19.604 1.00 0.00 H new ATOM 0 HZ PHE A 73 3.557 1.025 -18.519 1.00 0.00 H new ATOM 1120 N GLU A 74 6.437 5.562 -21.646 1.00 0.00 N ATOM 1121 CA GLU A 74 6.356 4.683 -22.856 1.00 0.00 C ATOM 1122 C GLU A 74 6.663 3.194 -22.495 1.00 0.00 C ATOM 1123 O GLU A 74 7.783 2.866 -22.085 1.00 0.00 O ATOM 1124 CB GLU A 74 7.305 5.202 -23.979 1.00 0.00 C ATOM 1125 CG GLU A 74 6.646 6.170 -24.991 1.00 0.00 C ATOM 1126 CD GLU A 74 7.556 6.862 -25.999 1.00 0.00 C ATOM 1127 OE1 GLU A 74 8.787 6.625 -26.037 1.00 0.00 O ATOM 1128 OE2 GLU A 74 7.006 7.631 -26.813 1.00 0.00 O ATOM 0 H GLU A 74 7.386 5.691 -21.294 1.00 0.00 H new ATOM 0 HA GLU A 74 5.335 4.722 -23.235 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.152 5.706 -23.515 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.703 4.346 -24.523 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.891 5.613 -25.546 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.122 6.941 -24.426 1.00 0.00 H new ATOM 1135 N GLU A 75 5.702 2.275 -22.724 1.00 0.00 N ATOM 1136 CA GLU A 75 6.020 0.829 -22.873 1.00 0.00 C ATOM 1137 C GLU A 75 6.513 0.561 -24.340 1.00 0.00 C ATOM 1138 O GLU A 75 5.890 0.995 -25.316 1.00 0.00 O ATOM 1139 CB GLU A 75 4.784 -0.033 -22.478 1.00 0.00 C ATOM 1140 CG GLU A 75 5.088 -1.556 -22.422 1.00 0.00 C ATOM 1141 CD GLU A 75 3.936 -2.496 -22.094 1.00 0.00 C ATOM 1142 OE1 GLU A 75 3.653 -2.729 -20.898 1.00 0.00 O ATOM 1143 OE2 GLU A 75 3.324 -3.043 -23.037 1.00 0.00 O ATOM 0 H GLU A 75 4.710 2.498 -22.810 1.00 0.00 H new ATOM 0 HA GLU A 75 6.826 0.541 -22.198 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.419 0.293 -21.504 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.982 0.144 -23.195 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.498 -1.852 -23.388 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.872 -1.715 -21.681 1.00 0.00 H new ATOM 1150 N THR A 76 7.640 -0.160 -24.487 1.00 0.00 N ATOM 1151 CA THR A 76 8.064 -0.723 -25.807 1.00 0.00 C ATOM 1152 C THR A 76 7.675 -2.231 -25.819 1.00 0.00 C ATOM 1153 O THR A 76 8.286 -3.038 -25.113 1.00 0.00 O ATOM 1154 CB THR A 76 9.580 -0.469 -26.056 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.858 0.919 -25.915 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.069 -0.882 -27.457 1.00 0.00 C ATOM 0 H THR A 76 8.278 -0.372 -23.720 1.00 0.00 H new ATOM 0 HA THR A 76 7.555 -0.227 -26.633 1.00 0.00 H new ATOM 0 HB THR A 76 10.100 -1.084 -25.321 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.812 1.079 -26.070 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.135 -0.672 -27.547 1.00 0.00 H new ATOM 0 HG22 THR A 76 9.896 -1.948 -27.603 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.523 -0.319 -28.214 1.00 0.00 H new ATOM 1164 N THR A 77 6.637 -2.602 -26.585 1.00 0.00 N ATOM 1165 CA THR A 77 6.026 -3.967 -26.505 1.00 0.00 C ATOM 1166 C THR A 77 6.927 -5.121 -27.076 1.00 0.00 C ATOM 1167 O THR A 77 7.824 -4.894 -27.895 1.00 0.00 O ATOM 1168 CB THR A 77 4.622 -3.982 -27.200 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.757 -3.809 -28.607 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.588 -2.961 -26.695 1.00 0.00 C ATOM 0 H THR A 77 6.194 -1.989 -27.269 1.00 0.00 H new ATOM 0 HA THR A 77 5.921 -4.174 -25.440 1.00 0.00 H new ATOM 0 HB THR A 77 4.229 -4.963 -26.933 1.00 0.00 H new ATOM 0 HG1 THR A 77 3.871 -3.823 -29.025 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.661 -3.074 -27.256 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.395 -3.132 -25.636 1.00 0.00 H new ATOM 0 HG23 THR A 77 3.975 -1.952 -26.834 1.00 0.00 H new ATOM 1178 N ALA A 78 6.618 -6.385 -26.714 1.00 0.00 N ATOM 1179 CA ALA A 78 7.185 -7.588 -27.399 1.00 0.00 C ATOM 1180 C ALA A 78 7.015 -7.711 -28.957 1.00 0.00 C ATOM 1181 O ALA A 78 7.900 -8.251 -29.624 1.00 0.00 O ATOM 1182 CB ALA A 78 6.602 -8.821 -26.679 1.00 0.00 C ATOM 0 H ALA A 78 5.979 -6.609 -25.951 1.00 0.00 H new ATOM 0 HA ALA A 78 8.268 -7.496 -27.316 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.987 -9.729 -27.143 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.892 -8.800 -25.628 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.515 -8.807 -26.756 1.00 0.00 H new ATOM 1188 N ASP A 79 5.910 -7.185 -29.517 1.00 0.00 N ATOM 1189 CA ASP A 79 5.773 -6.876 -30.970 1.00 0.00 C ATOM 1190 C ASP A 79 6.757 -5.781 -31.532 1.00 0.00 C ATOM 1191 O ASP A 79 7.368 -5.982 -32.585 1.00 0.00 O ATOM 1192 CB ASP A 79 4.267 -6.526 -31.140 1.00 0.00 C ATOM 1193 CG ASP A 79 3.781 -6.151 -32.540 1.00 0.00 C ATOM 1194 OD1 ASP A 79 3.878 -6.969 -33.476 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.235 -5.038 -32.689 1.00 0.00 O ATOM 0 H ASP A 79 5.075 -6.957 -28.977 1.00 0.00 H new ATOM 0 HA ASP A 79 6.074 -7.729 -31.578 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.683 -7.381 -30.799 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.037 -5.696 -30.471 1.00 0.00 H new ATOM 1200 N GLY A 80 6.879 -4.634 -30.845 1.00 0.00 N ATOM 1201 CA GLY A 80 7.632 -3.445 -31.332 1.00 0.00 C ATOM 1202 C GLY A 80 6.768 -2.173 -31.476 1.00 0.00 C ATOM 1203 O GLY A 80 6.705 -1.590 -32.559 1.00 0.00 O ATOM 0 H GLY A 80 6.458 -4.495 -29.927 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.452 -3.239 -30.644 1.00 0.00 H new ATOM 0 HA3 GLY A 80 8.078 -3.681 -32.298 1.00 0.00 H new ATOM 1207 N ARG A 81 6.117 -1.738 -30.384 1.00 0.00 N ATOM 1208 CA ARG A 81 5.136 -0.616 -30.404 1.00 0.00 C ATOM 1209 C ARG A 81 5.499 0.362 -29.246 1.00 0.00 C ATOM 1210 O ARG A 81 5.538 -0.048 -28.081 1.00 0.00 O ATOM 1211 CB ARG A 81 3.679 -1.140 -30.202 1.00 0.00 C ATOM 1212 CG ARG A 81 3.147 -2.209 -31.194 1.00 0.00 C ATOM 1213 CD ARG A 81 1.899 -2.973 -30.687 1.00 0.00 C ATOM 1214 NE ARG A 81 0.640 -2.634 -31.390 1.00 0.00 N ATOM 1215 CZ ARG A 81 0.141 -3.270 -32.452 1.00 0.00 C ATOM 1216 NH1 ARG A 81 0.761 -4.216 -33.120 1.00 0.00 N ATOM 1217 NH2 ARG A 81 -1.048 -2.925 -32.842 1.00 0.00 N ATOM 0 H ARG A 81 6.249 -2.147 -29.459 1.00 0.00 H new ATOM 0 HA ARG A 81 5.182 -0.113 -31.370 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.609 -1.553 -29.196 1.00 0.00 H new ATOM 0 HB3 ARG A 81 3.007 -0.283 -30.242 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.904 -1.724 -32.139 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.941 -2.927 -31.399 1.00 0.00 H new ATOM 0 HD2 ARG A 81 2.079 -4.043 -30.788 1.00 0.00 H new ATOM 0 HD3 ARG A 81 1.772 -2.770 -29.624 1.00 0.00 H new ATOM 0 HE ARG A 81 0.106 -1.843 -31.030 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.694 -4.513 -32.836 1.00 0.00 H new ATOM 0 HH12 ARG A 81 0.309 -4.653 -33.923 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -1.558 -2.197 -32.342 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -1.473 -3.382 -33.649 1.00 0.00 H new ATOM 1231 N LYS A 82 5.719 1.655 -29.548 1.00 0.00 N ATOM 1232 CA LYS A 82 5.899 2.702 -28.505 1.00 0.00 C ATOM 1233 C LYS A 82 4.512 3.209 -28.010 1.00 0.00 C ATOM 1234 O LYS A 82 3.783 3.869 -28.761 1.00 0.00 O ATOM 1235 CB LYS A 82 6.758 3.868 -29.078 1.00 0.00 C ATOM 1236 CG LYS A 82 7.911 4.320 -28.171 1.00 0.00 C ATOM 1237 CD LYS A 82 9.225 3.524 -28.332 1.00 0.00 C ATOM 1238 CE LYS A 82 10.279 3.823 -27.245 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.677 5.261 -27.217 1.00 0.00 N ATOM 0 H LYS A 82 5.778 2.007 -30.503 1.00 0.00 H new ATOM 0 HA LYS A 82 6.424 2.279 -27.648 1.00 0.00 H new ATOM 0 HB2 LYS A 82 7.169 3.560 -30.039 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.107 4.721 -29.268 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.116 5.372 -28.368 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.586 4.247 -27.133 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.996 2.458 -28.318 1.00 0.00 H new ATOM 0 HD3 LYS A 82 9.654 3.745 -29.309 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.882 3.540 -26.270 1.00 0.00 H new ATOM 0 HE3 LYS A 82 11.162 3.208 -27.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.644 5.346 -26.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.642 5.650 -28.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.022 5.791 -26.607 1.00 0.00 H new ATOM 1253 N THR A 83 4.139 2.870 -26.768 1.00 0.00 N ATOM 1254 CA THR A 83 2.747 3.094 -26.276 1.00 0.00 C ATOM 1255 C THR A 83 2.728 4.111 -25.101 1.00 0.00 C ATOM 1256 O THR A 83 3.205 3.827 -23.996 1.00 0.00 O ATOM 1257 CB THR A 83 1.975 1.775 -25.974 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.474 1.120 -24.819 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.977 0.733 -27.103 1.00 0.00 C ATOM 0 H THR A 83 4.763 2.444 -26.083 1.00 0.00 H new ATOM 0 HA THR A 83 2.187 3.546 -27.095 1.00 0.00 H new ATOM 0 HB THR A 83 0.953 2.128 -25.836 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.194 0.181 -24.829 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.413 -0.145 -26.789 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.517 1.161 -27.994 1.00 0.00 H new ATOM 0 HG23 THR A 83 3.003 0.443 -27.329 1.00 0.00 H new ATOM 1267 N GLN A 84 2.138 5.298 -25.339 1.00 0.00 N ATOM 1268 CA GLN A 84 2.029 6.389 -24.334 1.00 0.00 C ATOM 1269 C GLN A 84 1.011 6.012 -23.208 1.00 0.00 C ATOM 1270 O GLN A 84 -0.210 6.030 -23.390 1.00 0.00 O ATOM 1271 CB GLN A 84 1.655 7.694 -25.096 1.00 0.00 C ATOM 1272 CG GLN A 84 2.829 8.403 -25.830 1.00 0.00 C ATOM 1273 CD GLN A 84 3.850 9.107 -24.919 1.00 0.00 C ATOM 1274 OE1 GLN A 84 3.555 9.556 -23.815 1.00 0.00 O ATOM 1275 NE2 GLN A 84 5.084 9.254 -25.333 1.00 0.00 N ATOM 0 H GLN A 84 1.719 5.535 -26.238 1.00 0.00 H new ATOM 0 HA GLN A 84 2.976 6.547 -23.818 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.882 7.458 -25.828 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.217 8.396 -24.386 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.356 7.664 -26.434 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.413 9.139 -26.518 1.00 0.00 H new ATOM 0 HE21 GLN A 84 5.362 8.893 -26.245 1.00 0.00 H new ATOM 0 HE22 GLN A 84 5.767 9.730 -24.743 1.00 0.00 H new ATOM 1284 N THR A 85 1.547 5.587 -22.058 1.00 0.00 N ATOM 1285 CA THR A 85 0.839 4.687 -21.112 1.00 0.00 C ATOM 1286 C THR A 85 0.741 5.353 -19.712 1.00 0.00 C ATOM 1287 O THR A 85 1.769 5.649 -19.100 1.00 0.00 O ATOM 1288 CB THR A 85 1.593 3.322 -21.064 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.603 2.703 -22.348 1.00 0.00 O ATOM 1290 CG2 THR A 85 0.959 2.287 -20.125 1.00 0.00 C ATOM 0 H THR A 85 2.482 5.851 -21.748 1.00 0.00 H new ATOM 0 HA THR A 85 -0.182 4.505 -21.448 1.00 0.00 H new ATOM 0 HB THR A 85 2.589 3.584 -20.706 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.459 2.881 -22.790 1.00 0.00 H new ATOM 0 HG21 THR A 85 1.543 1.367 -20.150 1.00 0.00 H new ATOM 0 HG22 THR A 85 0.943 2.680 -19.108 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.061 2.078 -20.449 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.478 5.538 -19.175 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.669 5.979 -17.756 1.00 0.00 C ATOM 1300 C VAL A 86 -0.775 4.752 -16.782 1.00 0.00 C ATOM 1301 O VAL A 86 -1.619 3.867 -16.978 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.832 7.025 -17.640 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.253 6.488 -17.901 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.811 7.780 -16.292 1.00 0.00 C ATOM 0 H VAL A 86 -1.348 5.394 -19.687 1.00 0.00 H new ATOM 0 HA VAL A 86 0.222 6.513 -17.426 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.615 7.711 -18.459 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.974 7.299 -17.793 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.309 6.084 -18.912 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.482 5.701 -17.183 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.636 8.492 -16.261 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.916 7.067 -15.474 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.866 8.314 -16.189 1.00 0.00 H new ATOM 1314 N CYS A 87 0.067 4.714 -15.727 1.00 0.00 N ATOM 1315 CA CYS A 87 -0.041 3.675 -14.656 1.00 0.00 C ATOM 1316 C CYS A 87 -0.775 4.204 -13.389 1.00 0.00 C ATOM 1317 O CYS A 87 -0.319 5.173 -12.784 1.00 0.00 O ATOM 1318 CB CYS A 87 1.371 3.161 -14.284 1.00 0.00 C ATOM 1319 SG CYS A 87 1.860 1.773 -15.353 1.00 0.00 S ATOM 0 H CYS A 87 0.826 5.381 -15.586 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.640 2.855 -15.051 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.094 3.971 -14.380 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.384 2.844 -13.241 1.00 0.00 H new ATOM 0 HG CYS A 87 2.923 2.098 -16.027 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.864 3.546 -12.948 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.607 3.943 -11.710 1.00 0.00 C ATOM 1327 C ASN A 88 -2.902 2.705 -10.809 1.00 0.00 C ATOM 1328 O ASN A 88 -3.387 1.681 -11.291 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.942 4.645 -12.084 1.00 0.00 C ATOM 1330 CG ASN A 88 -3.792 6.046 -12.686 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.316 6.978 -12.049 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.204 6.246 -13.913 1.00 0.00 N ATOM 0 H ASN A 88 -2.259 2.734 -13.423 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.977 4.636 -11.152 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.479 4.016 -12.795 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.561 4.715 -11.190 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.127 7.173 -14.332 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.601 5.475 -14.450 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.659 2.804 -9.491 1.00 0.00 N ATOM 1340 CA PHE A 89 -3.042 1.738 -8.521 1.00 0.00 C ATOM 1341 C PHE A 89 -4.425 2.037 -7.856 1.00 0.00 C ATOM 1342 O PHE A 89 -4.637 3.115 -7.293 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.889 1.590 -7.490 1.00 0.00 C ATOM 1344 CG PHE A 89 -2.101 0.514 -6.411 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.856 -0.834 -6.687 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.613 0.878 -5.161 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.119 -1.805 -5.723 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.883 -0.094 -4.203 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.636 -1.434 -4.485 1.00 0.00 C ATOM 0 H PHE A 89 -2.199 3.608 -9.063 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.176 0.786 -9.036 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.969 1.363 -8.029 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.740 2.551 -6.997 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.462 -1.124 -7.650 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.800 1.918 -4.939 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.922 -2.845 -5.936 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.284 0.191 -3.242 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.846 -2.188 -3.741 1.00 0.00 H new ATOM 1359 N THR A 90 -5.325 1.039 -7.852 1.00 0.00 N ATOM 1360 CA THR A 90 -6.552 1.055 -7.000 1.00 0.00 C ATOM 1361 C THR A 90 -6.870 -0.386 -6.480 1.00 0.00 C ATOM 1362 O THR A 90 -6.735 -1.370 -7.212 1.00 0.00 O ATOM 1363 CB THR A 90 -7.745 1.743 -7.736 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.785 2.043 -6.806 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.367 0.977 -8.915 1.00 0.00 C ATOM 0 H THR A 90 -5.235 0.202 -8.428 1.00 0.00 H new ATOM 0 HA THR A 90 -6.370 1.667 -6.116 1.00 0.00 H new ATOM 0 HB THR A 90 -7.293 2.634 -8.172 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.034 1.229 -6.320 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.184 1.562 -9.338 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.608 0.807 -9.679 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.750 0.019 -8.565 1.00 0.00 H new ATOM 1373 N ASP A 91 -7.332 -0.511 -5.219 1.00 0.00 N ATOM 1374 CA ASP A 91 -8.061 -1.737 -4.730 1.00 0.00 C ATOM 1375 C ASP A 91 -7.273 -3.108 -4.741 1.00 0.00 C ATOM 1376 O ASP A 91 -7.842 -4.173 -5.005 1.00 0.00 O ATOM 1377 CB ASP A 91 -9.461 -1.847 -5.418 1.00 0.00 C ATOM 1378 CG ASP A 91 -10.359 -0.613 -5.366 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -10.245 0.239 -6.277 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -11.150 -0.474 -4.412 1.00 0.00 O ATOM 0 H ASP A 91 -7.222 0.212 -4.509 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.181 -1.565 -3.660 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.304 -2.108 -6.465 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.999 -2.677 -4.960 1.00 0.00 H new ATOM 1385 N GLY A 92 -5.954 -3.095 -4.467 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.068 -4.264 -4.768 1.00 0.00 C ATOM 1387 C GLY A 92 -4.736 -4.582 -6.255 1.00 0.00 C ATOM 1388 O GLY A 92 -4.433 -5.740 -6.563 1.00 0.00 O ATOM 0 H GLY A 92 -5.472 -2.303 -4.043 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.125 -4.109 -4.244 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.531 -5.151 -4.335 1.00 0.00 H new ATOM 1392 N ALA A 93 -4.776 -3.584 -7.159 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.600 -3.791 -8.616 1.00 0.00 C ATOM 1394 C ALA A 93 -3.885 -2.602 -9.324 1.00 0.00 C ATOM 1395 O ALA A 93 -4.246 -1.435 -9.130 1.00 0.00 O ATOM 1396 CB ALA A 93 -5.994 -4.022 -9.239 1.00 0.00 C ATOM 0 H ALA A 93 -4.931 -2.609 -6.903 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.954 -4.657 -8.760 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -5.891 -4.177 -10.313 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.453 -4.901 -8.788 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.623 -3.151 -9.057 1.00 0.00 H new ATOM 1402 N LEU A 94 -2.915 -2.900 -10.214 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.363 -1.883 -11.155 1.00 0.00 C ATOM 1404 C LEU A 94 -3.222 -1.821 -12.458 1.00 0.00 C ATOM 1405 O LEU A 94 -3.219 -2.758 -13.260 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.870 -2.195 -11.456 1.00 0.00 C ATOM 1407 CG LEU A 94 -0.096 -1.103 -12.245 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.197 0.123 -11.371 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.225 -1.655 -12.801 1.00 0.00 C ATOM 0 H LEU A 94 -2.496 -3.826 -10.306 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.410 -0.898 -10.691 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.356 -2.366 -10.510 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.820 -3.127 -12.019 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.736 -0.799 -13.073 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.739 0.866 -11.956 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.741 0.552 -11.020 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.802 -0.177 -10.515 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.746 -0.869 -13.349 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.851 -1.999 -11.978 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.017 -2.488 -13.472 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.921 -0.698 -12.677 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.675 -0.423 -13.933 1.00 0.00 C ATOM 1423 C VAL A 95 -3.721 0.389 -14.876 1.00 0.00 C ATOM 1424 O VAL A 95 -3.491 1.590 -14.688 1.00 0.00 O ATOM 1425 CB VAL A 95 -6.035 0.299 -13.618 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.856 0.618 -14.892 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.969 -0.509 -12.680 1.00 0.00 C ATOM 0 H VAL A 95 -3.987 0.055 -11.992 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.963 -1.341 -14.445 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.719 1.217 -13.122 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.784 1.116 -14.612 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.276 1.271 -15.544 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -7.086 -0.309 -15.418 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.887 0.053 -12.509 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -7.210 -1.466 -13.143 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.467 -0.683 -11.728 1.00 0.00 H new ATOM 1437 N GLN A 96 -3.153 -0.292 -15.885 1.00 0.00 N ATOM 1438 CA GLN A 96 -2.212 0.321 -16.863 1.00 0.00 C ATOM 1439 C GLN A 96 -2.957 0.621 -18.206 1.00 0.00 C ATOM 1440 O GLN A 96 -3.192 -0.298 -18.995 1.00 0.00 O ATOM 1441 CB GLN A 96 -1.034 -0.688 -16.995 1.00 0.00 C ATOM 1442 CG GLN A 96 0.087 -0.325 -18.003 1.00 0.00 C ATOM 1443 CD GLN A 96 1.152 -1.408 -18.269 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.281 -2.430 -17.593 1.00 0.00 O ATOM 1445 NE2 GLN A 96 1.930 -1.200 -19.306 1.00 0.00 N ATOM 0 H GLN A 96 -3.327 -1.283 -16.054 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.821 1.287 -16.544 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.580 -0.811 -16.012 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.446 -1.656 -17.279 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.380 -0.065 -18.953 1.00 0.00 H new ATOM 0 HG3 GLN A 96 0.594 0.570 -17.642 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.821 -0.353 -19.864 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.644 -1.885 -19.554 1.00 0.00 H new ATOM 1454 N HIS A 97 -3.304 1.896 -18.484 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.935 2.287 -19.780 1.00 0.00 C ATOM 1456 C HIS A 97 -2.847 2.696 -20.822 1.00 0.00 C ATOM 1457 O HIS A 97 -2.312 3.807 -20.763 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.987 3.410 -19.536 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.703 3.935 -20.792 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.159 4.898 -21.632 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.880 3.420 -21.361 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.051 4.861 -22.675 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.153 4.054 -22.567 1.00 0.00 N ATOM 0 H HIS A 97 -3.162 2.673 -17.839 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.462 1.432 -20.203 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.739 3.034 -18.842 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.491 4.248 -19.046 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.487 2.641 -20.923 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -5.888 5.455 -23.562 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -7.950 3.948 -23.195 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.621 1.832 -21.819 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.797 2.147 -23.021 1.00 0.00 C ATOM 1474 C GLN A 98 -2.595 2.982 -24.075 1.00 0.00 C ATOM 1475 O GLN A 98 -3.801 2.772 -24.242 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.296 0.813 -23.650 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.408 -0.076 -22.739 1.00 0.00 C ATOM 1478 CD GLN A 98 0.441 -1.143 -23.437 1.00 0.00 C ATOM 1479 OE1 GLN A 98 1.017 -0.938 -24.500 1.00 0.00 O ATOM 1480 NE2 GLN A 98 0.648 -2.269 -22.804 1.00 0.00 N ATOM 0 H GLN A 98 -3.001 0.886 -21.827 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.949 2.757 -22.710 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.164 0.230 -23.958 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.734 1.049 -24.554 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.260 0.575 -22.175 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.054 -0.574 -22.016 1.00 0.00 H new ATOM 0 HE21 GLN A 98 0.175 -2.451 -21.919 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.283 -2.965 -23.195 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.924 3.910 -24.786 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.539 4.721 -25.870 1.00 0.00 C ATOM 1491 C GLU A 99 -1.501 4.942 -27.020 1.00 0.00 C ATOM 1492 O GLU A 99 -0.379 5.411 -26.795 1.00 0.00 O ATOM 1493 CB GLU A 99 -3.056 6.059 -25.267 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.160 6.748 -26.105 1.00 0.00 C ATOM 1495 CD GLU A 99 -3.720 7.499 -27.358 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.140 8.595 -27.219 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -3.975 7.008 -28.479 1.00 0.00 O ATOM 0 H GLU A 99 -0.939 4.123 -24.629 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.391 4.200 -26.307 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -3.442 5.868 -24.266 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.216 6.745 -25.160 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.881 5.987 -26.403 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.686 7.450 -25.458 1.00 0.00 H new ATOM 1504 N TRP A 100 -1.863 4.567 -28.258 1.00 0.00 N ATOM 1505 CA TRP A 100 -0.985 4.731 -29.451 1.00 0.00 C ATOM 1506 C TRP A 100 -1.843 4.806 -30.752 1.00 0.00 C ATOM 1507 O TRP A 100 -2.663 3.921 -31.013 1.00 0.00 O ATOM 1508 CB TRP A 100 0.134 3.648 -29.491 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.249 2.205 -29.852 1.00 0.00 C ATOM 1510 CD1 TRP A 100 0.058 1.597 -31.079 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -0.937 1.252 -29.121 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -0.403 0.267 -31.142 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -1.064 0.093 -29.927 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.488 1.280 -27.815 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -1.810 -1.017 -29.451 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.213 0.179 -27.369 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -2.385 -0.946 -28.179 1.00 0.00 C ATOM 0 H TRP A 100 -2.766 4.143 -28.470 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.457 5.682 -29.377 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.888 3.978 -30.205 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.610 3.628 -28.511 1.00 0.00 H new ATOM 0 HD1 TRP A 100 0.586 2.091 -31.881 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -0.282 -0.408 -31.897 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.348 2.140 -27.178 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -1.931 -1.900 -30.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.649 0.195 -26.381 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -2.973 -1.776 -27.816 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.665 5.865 -31.567 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.497 6.132 -32.791 1.00 0.00 C ATOM 1530 C ASP A 101 -4.068 6.061 -32.605 1.00 0.00 C ATOM 1531 O ASP A 101 -4.787 5.436 -33.394 1.00 0.00 O ATOM 1532 CB ASP A 101 -1.880 5.283 -33.944 1.00 0.00 C ATOM 1533 CG ASP A 101 -2.364 5.582 -35.360 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -2.360 6.756 -35.779 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -2.727 4.619 -36.070 1.00 0.00 O ATOM 0 H ASP A 101 -0.944 6.569 -31.408 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.438 7.188 -33.055 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.798 5.415 -33.921 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.077 4.232 -33.734 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.597 6.676 -31.525 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.018 6.494 -31.100 1.00 0.00 C ATOM 1542 C GLY A 102 -6.523 5.082 -30.694 1.00 0.00 C ATOM 1543 O GLY A 102 -7.715 4.808 -30.842 1.00 0.00 O ATOM 0 H GLY A 102 -4.066 7.307 -30.924 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.193 7.159 -30.254 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.650 6.844 -31.916 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.636 4.194 -30.218 1.00 0.00 N ATOM 1548 CA LYS A 103 -5.948 2.758 -29.964 1.00 0.00 C ATOM 1549 C LYS A 103 -5.428 2.384 -28.545 1.00 0.00 C ATOM 1550 O LYS A 103 -4.278 2.671 -28.189 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.274 1.874 -31.056 1.00 0.00 C ATOM 1552 CG LYS A 103 -5.782 2.102 -32.506 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.676 2.007 -33.576 1.00 0.00 C ATOM 1554 CE LYS A 103 -5.201 2.432 -34.960 1.00 0.00 C ATOM 1555 NZ LYS A 103 -4.097 2.449 -35.952 1.00 0.00 N ATOM 0 H LYS A 103 -4.673 4.443 -29.994 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.024 2.587 -30.008 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.199 2.055 -31.033 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.427 0.826 -30.796 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.555 1.367 -32.730 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.250 3.085 -32.567 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.836 2.642 -33.292 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.301 0.985 -33.625 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -5.981 1.744 -35.287 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.655 3.421 -34.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.494 2.451 -36.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.520 3.303 -35.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.503 1.605 -35.825 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.283 1.744 -27.736 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.064 1.577 -26.281 1.00 0.00 C ATOM 1571 C GLU A 104 -5.907 0.098 -25.825 1.00 0.00 C ATOM 1572 O GLU A 104 -6.523 -0.818 -26.372 1.00 0.00 O ATOM 1573 CB GLU A 104 -7.212 2.290 -25.505 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.682 1.818 -25.719 1.00 0.00 C ATOM 1575 CD GLU A 104 -9.332 2.333 -26.994 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -9.127 1.718 -28.065 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -10.031 3.364 -26.929 1.00 0.00 O ATOM 0 H GLU A 104 -7.151 1.324 -28.067 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.106 2.042 -26.047 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.991 2.204 -24.441 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.168 3.350 -25.755 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.702 0.728 -25.731 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -9.281 2.138 -24.866 1.00 0.00 H new ATOM 1584 N SER A 105 -5.132 -0.119 -24.748 1.00 0.00 N ATOM 1585 CA SER A 105 -5.154 -1.404 -23.995 1.00 0.00 C ATOM 1586 C SER A 105 -5.088 -1.181 -22.453 1.00 0.00 C ATOM 1587 O SER A 105 -4.244 -0.430 -21.956 1.00 0.00 O ATOM 1588 CB SER A 105 -4.039 -2.340 -24.509 1.00 0.00 C ATOM 1589 OG SER A 105 -4.136 -3.599 -23.848 1.00 0.00 O ATOM 0 H SER A 105 -4.481 0.571 -24.373 1.00 0.00 H new ATOM 0 HA SER A 105 -6.110 -1.894 -24.179 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.130 -2.475 -25.587 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.061 -1.895 -24.325 1.00 0.00 H new ATOM 0 HG SER A 105 -3.782 -4.303 -24.431 1.00 0.00 H new ATOM 1595 N THR A 106 -5.977 -1.849 -21.696 1.00 0.00 N ATOM 1596 CA THR A 106 -5.980 -1.796 -20.200 1.00 0.00 C ATOM 1597 C THR A 106 -5.390 -3.115 -19.616 1.00 0.00 C ATOM 1598 O THR A 106 -6.025 -4.172 -19.679 1.00 0.00 O ATOM 1599 CB THR A 106 -7.388 -1.474 -19.609 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.388 -2.340 -20.122 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.864 -0.039 -19.862 1.00 0.00 C ATOM 0 H THR A 106 -6.712 -2.439 -22.087 1.00 0.00 H new ATOM 0 HA THR A 106 -5.340 -0.967 -19.898 1.00 0.00 H new ATOM 0 HB THR A 106 -7.254 -1.615 -18.537 1.00 0.00 H new ATOM 0 HG1 THR A 106 -9.255 -2.109 -19.728 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.850 0.101 -19.419 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.161 0.662 -19.412 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.920 0.142 -20.935 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.179 -3.043 -19.030 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.507 -4.217 -18.391 1.00 0.00 C ATOM 1611 C ILE A 107 -3.834 -4.159 -16.860 1.00 0.00 C ATOM 1612 O ILE A 107 -3.274 -3.326 -16.138 1.00 0.00 O ATOM 1613 CB ILE A 107 -1.954 -4.291 -18.669 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -1.414 -3.796 -20.045 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.383 -5.690 -18.342 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.949 -4.498 -21.303 1.00 0.00 C ATOM 0 H ILE A 107 -3.634 -2.182 -18.980 1.00 0.00 H new ATOM 0 HA ILE A 107 -3.893 -5.135 -18.834 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.580 -3.536 -17.977 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.635 -2.732 -20.132 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.329 -3.896 -20.038 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.312 -5.703 -18.546 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.555 -5.916 -17.290 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -1.879 -6.439 -18.960 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.492 -4.056 -22.188 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.704 -5.559 -21.259 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.031 -4.377 -21.355 1.00 0.00 H new ATOM 1628 N THR A 108 -4.756 -5.011 -16.372 1.00 0.00 N ATOM 1629 CA THR A 108 -5.252 -4.951 -14.962 1.00 0.00 C ATOM 1630 C THR A 108 -4.538 -6.042 -14.103 1.00 0.00 C ATOM 1631 O THR A 108 -4.874 -7.228 -14.183 1.00 0.00 O ATOM 1632 CB THR A 108 -6.807 -5.068 -14.961 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.378 -4.047 -15.777 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.452 -4.905 -13.574 1.00 0.00 C ATOM 0 H THR A 108 -5.180 -5.755 -16.926 1.00 0.00 H new ATOM 0 HA THR A 108 -5.007 -3.994 -14.501 1.00 0.00 H new ATOM 0 HB THR A 108 -7.006 -6.074 -15.330 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.354 -4.131 -15.771 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.534 -5.000 -13.663 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.074 -5.677 -12.904 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.206 -3.922 -13.171 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.545 -5.639 -13.290 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.657 -6.587 -12.553 1.00 0.00 C ATOM 1644 C ARG A 109 -3.131 -6.739 -11.069 1.00 0.00 C ATOM 1645 O ARG A 109 -2.673 -6.001 -10.192 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.167 -6.129 -12.648 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.604 -5.717 -14.035 1.00 0.00 C ATOM 1648 CD ARG A 109 0.914 -5.458 -13.998 1.00 0.00 C ATOM 1649 NE ARG A 109 1.381 -4.947 -15.322 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.427 -5.396 -16.019 1.00 0.00 C ATOM 1651 NH1 ARG A 109 3.227 -6.348 -15.606 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.671 -4.849 -17.177 1.00 0.00 N ATOM 0 H ARG A 109 -3.328 -4.657 -13.119 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.724 -7.570 -13.019 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.037 -5.283 -11.973 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.546 -6.940 -12.266 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.818 -6.503 -14.759 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -1.115 -4.818 -14.379 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.148 -4.734 -13.217 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.442 -6.378 -13.748 1.00 0.00 H new ATOM 0 HE ARG A 109 0.849 -4.180 -15.733 1.00 0.00 H new ATOM 0 HH11 ARG A 109 3.067 -6.792 -14.702 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.010 -6.645 -16.189 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.070 -4.101 -17.525 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.463 -5.169 -17.735 1.00 0.00 H new ATOM 1666 N LYS A 110 -4.067 -7.666 -10.799 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.815 -7.737 -9.504 1.00 0.00 C ATOM 1668 C LYS A 110 -4.426 -8.969 -8.626 1.00 0.00 C ATOM 1669 O LYS A 110 -4.312 -10.093 -9.124 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.342 -7.637 -9.797 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.994 -8.776 -10.620 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.406 -8.432 -11.142 1.00 0.00 C ATOM 1673 CE LYS A 110 -8.828 -9.383 -12.274 1.00 0.00 C ATOM 1674 NZ LYS A 110 -10.102 -8.955 -12.905 1.00 0.00 N ATOM 0 H LYS A 110 -4.335 -8.392 -11.463 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.524 -6.887 -8.887 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.863 -7.573 -8.842 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.522 -6.699 -10.322 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.351 -9.015 -11.467 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -7.053 -9.672 -10.002 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -9.124 -8.495 -10.324 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.423 -7.403 -11.503 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.043 -9.421 -13.029 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.939 -10.393 -11.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.320 -9.580 -13.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -10.870 -9.008 -12.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.010 -7.976 -13.244 1.00 0.00 H new ATOM 1688 N LEU A 111 -4.235 -8.769 -7.308 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.715 -9.834 -6.402 1.00 0.00 C ATOM 1690 C LEU A 111 -4.843 -10.752 -5.833 1.00 0.00 C ATOM 1691 O LEU A 111 -5.706 -10.306 -5.071 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.846 -9.174 -5.287 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.498 -9.858 -4.944 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.632 -11.263 -4.336 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.537 -9.891 -6.140 1.00 0.00 C ATOM 0 H LEU A 111 -4.430 -7.884 -6.839 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.084 -10.508 -6.981 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.638 -8.146 -5.585 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.443 -9.127 -4.376 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.073 -9.223 -4.167 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.641 -11.665 -4.128 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.202 -11.205 -3.409 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.148 -11.916 -5.040 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.392 -10.380 -5.847 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.995 -10.444 -6.960 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.324 -8.872 -6.464 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.840 -12.036 -6.228 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.886 -13.022 -5.830 1.00 0.00 C ATOM 1709 C LYS A 112 -5.214 -14.405 -5.557 1.00 0.00 C ATOM 1710 O LYS A 112 -4.415 -14.872 -6.374 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.942 -13.171 -6.965 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.813 -11.931 -7.292 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.645 -12.023 -8.593 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.834 -13.007 -8.597 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.411 -14.405 -8.890 1.00 0.00 N ATOM 0 H LYS A 112 -4.118 -12.430 -6.831 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.385 -12.670 -4.927 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.420 -13.466 -7.875 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.609 -13.991 -6.700 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.493 -11.757 -6.458 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.162 -11.059 -7.359 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.028 -11.028 -8.821 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.973 -12.300 -9.406 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.331 -12.976 -7.628 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.564 -12.688 -9.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.216 -14.937 -9.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -8.636 -14.395 -9.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.086 -14.860 -8.013 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.550 -15.090 -4.439 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.992 -16.450 -4.103 1.00 0.00 C ATOM 1731 C ASP A 113 -3.417 -16.526 -3.940 1.00 0.00 C ATOM 1732 O ASP A 113 -2.764 -17.469 -4.399 1.00 0.00 O ATOM 1733 CB ASP A 113 -5.650 -17.480 -5.080 1.00 0.00 C ATOM 1734 CG ASP A 113 -5.407 -18.959 -4.798 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -5.607 -19.403 -3.650 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -4.972 -19.680 -5.726 1.00 0.00 O ATOM 0 H ASP A 113 -6.206 -14.734 -3.743 1.00 0.00 H new ATOM 0 HA ASP A 113 -5.270 -16.718 -3.084 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.726 -17.308 -5.078 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.294 -17.265 -6.088 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.783 -15.504 -3.323 1.00 0.00 N ATOM 1742 CA GLY A 114 -1.301 -15.298 -3.421 1.00 0.00 C ATOM 1743 C GLY A 114 -0.651 -15.020 -4.812 1.00 0.00 C ATOM 1744 O GLY A 114 0.570 -15.128 -4.940 1.00 0.00 O ATOM 0 H GLY A 114 -3.262 -14.807 -2.753 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.044 -14.464 -2.769 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.821 -16.185 -3.008 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.450 -14.705 -5.844 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.034 -14.781 -7.271 1.00 0.00 C ATOM 1750 C LYS A 115 -1.450 -13.481 -8.022 1.00 0.00 C ATOM 1751 O LYS A 115 -2.511 -12.890 -7.782 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.651 -16.046 -7.933 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.115 -17.384 -7.374 1.00 0.00 C ATOM 1754 CD LYS A 115 -1.902 -18.610 -7.869 1.00 0.00 C ATOM 1755 CE LYS A 115 -1.617 -19.885 -7.045 1.00 0.00 C ATOM 1756 NZ LYS A 115 -2.358 -19.851 -5.751 1.00 0.00 N ATOM 0 H LYS A 115 -2.411 -14.387 -5.720 1.00 0.00 H new ATOM 0 HA LYS A 115 0.051 -14.864 -7.330 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.733 -16.019 -7.802 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.458 -16.011 -9.005 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -0.068 -17.495 -7.657 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -1.149 -17.354 -6.285 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.969 -18.390 -7.830 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -1.653 -18.796 -8.914 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.911 -20.766 -7.615 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.547 -19.970 -6.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.980 -20.582 -5.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.243 -18.916 -5.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.368 -20.031 -5.924 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.604 -13.047 -8.965 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.849 -11.813 -9.760 1.00 0.00 C ATOM 1772 C LEU A 116 -1.696 -12.160 -11.024 1.00 0.00 C ATOM 1773 O LEU A 116 -1.205 -12.736 -12.000 1.00 0.00 O ATOM 1774 CB LEU A 116 0.526 -11.151 -10.038 1.00 0.00 C ATOM 1775 CG LEU A 116 0.506 -9.766 -10.736 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.172 -8.647 -9.736 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.868 -9.479 -11.389 1.00 0.00 C ATOM 0 H LEU A 116 0.263 -13.527 -9.205 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.448 -11.077 -9.224 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.051 -11.045 -9.088 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.114 -11.833 -10.653 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.268 -9.790 -11.503 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.165 -7.687 -10.253 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.809 -8.831 -9.299 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.923 -8.628 -8.947 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.840 -8.504 -11.875 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.645 -9.481 -10.625 1.00 0.00 H new ATOM 0 HD23 LEU A 116 2.085 -10.248 -12.130 1.00 0.00 H new ATOM 1789 N VAL A 117 -2.993 -11.818 -10.980 1.00 0.00 N ATOM 1790 CA VAL A 117 -3.961 -12.123 -12.071 1.00 0.00 C ATOM 1791 C VAL A 117 -3.938 -10.915 -13.060 1.00 0.00 C ATOM 1792 O VAL A 117 -4.489 -9.844 -12.786 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.371 -12.451 -11.466 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.460 -12.698 -12.534 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.369 -13.687 -10.537 1.00 0.00 C ATOM 0 H VAL A 117 -3.410 -11.322 -10.192 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.689 -13.016 -12.633 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.605 -11.552 -10.896 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.408 -12.919 -12.043 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.571 -11.808 -13.153 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.171 -13.542 -13.160 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.375 -13.856 -10.154 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.042 -14.563 -11.097 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.688 -13.515 -9.704 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.264 -11.095 -14.202 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.043 -10.015 -15.202 1.00 0.00 C ATOM 1807 C VAL A 118 -4.142 -10.156 -16.299 1.00 0.00 C ATOM 1808 O VAL A 118 -4.011 -10.968 -17.224 1.00 0.00 O ATOM 1809 CB VAL A 118 -1.571 -10.090 -15.733 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.270 -9.083 -16.863 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.501 -9.861 -14.636 1.00 0.00 C ATOM 0 H VAL A 118 -2.852 -11.989 -14.469 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.143 -9.017 -14.774 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.506 -11.110 -16.111 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.233 -9.192 -17.181 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -1.931 -9.276 -17.708 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.433 -8.069 -16.499 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.493 -9.928 -15.078 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.637 -8.873 -14.196 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.605 -10.621 -13.862 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.216 -9.355 -16.188 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.310 -9.346 -17.194 1.00 0.00 C ATOM 1823 C GLU A 119 -6.103 -8.168 -18.184 1.00 0.00 C ATOM 1824 O GLU A 119 -6.269 -6.998 -17.821 1.00 0.00 O ATOM 1825 CB GLU A 119 -7.714 -9.387 -16.535 1.00 0.00 C ATOM 1826 CG GLU A 119 -7.987 -10.722 -15.795 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.432 -11.143 -15.605 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -10.238 -10.369 -15.046 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -9.750 -12.289 -15.984 1.00 0.00 O ATOM 0 H GLU A 119 -5.356 -8.704 -15.416 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.265 -10.264 -17.780 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.805 -8.560 -15.830 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.475 -9.238 -17.301 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.475 -11.517 -16.338 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.524 -10.660 -14.810 1.00 0.00 H new ATOM 1836 N CYS A 120 -5.688 -8.487 -19.424 1.00 0.00 N ATOM 1837 CA CYS A 120 -5.438 -7.465 -20.469 1.00 0.00 C ATOM 1838 C CYS A 120 -6.548 -7.467 -21.557 1.00 0.00 C ATOM 1839 O CYS A 120 -6.785 -8.488 -22.212 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.010 -7.629 -21.029 1.00 0.00 C ATOM 1841 SG CYS A 120 -3.893 -8.864 -22.323 1.00 0.00 S ATOM 0 H CYS A 120 -5.517 -9.444 -19.731 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.492 -6.472 -20.022 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -3.668 -6.670 -21.419 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -3.337 -7.900 -20.216 1.00 0.00 H new ATOM 0 HG CYS A 120 -3.356 -9.946 -21.843 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.215 -6.318 -21.747 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.216 -6.122 -22.840 1.00 0.00 C ATOM 1848 C VAL A 121 -7.786 -4.929 -23.747 1.00 0.00 C ATOM 1849 O VAL A 121 -7.406 -3.863 -23.245 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.666 -5.989 -22.259 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.966 -4.724 -21.427 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -10.755 -6.120 -23.350 1.00 0.00 C ATOM 0 H VAL A 121 -7.086 -5.495 -21.158 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.241 -7.005 -23.479 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.700 -6.829 -21.565 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.000 -4.751 -21.083 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.298 -4.688 -20.566 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.812 -3.838 -22.043 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.740 -6.020 -22.894 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.619 -5.337 -24.096 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.674 -7.095 -23.830 1.00 0.00 H new ATOM 1862 N MET A 122 -7.910 -5.092 -25.079 1.00 0.00 N ATOM 1863 CA MET A 122 -7.811 -3.939 -26.022 1.00 0.00 C ATOM 1864 C MET A 122 -9.171 -3.170 -26.081 1.00 0.00 C ATOM 1865 O MET A 122 -9.330 -2.151 -25.402 1.00 0.00 O ATOM 1866 CB MET A 122 -7.188 -4.381 -27.376 1.00 0.00 C ATOM 1867 CG MET A 122 -6.804 -3.190 -28.279 1.00 0.00 C ATOM 1868 SD MET A 122 -6.495 -3.712 -29.968 1.00 0.00 S ATOM 1869 CE MET A 122 -5.968 -2.132 -30.655 1.00 0.00 C ATOM 0 H MET A 122 -8.076 -5.992 -25.530 1.00 0.00 H new ATOM 0 HA MET A 122 -7.105 -3.194 -25.657 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.301 -4.984 -27.182 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.897 -5.018 -27.905 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.605 -2.451 -28.267 1.00 0.00 H new ATOM 0 HG3 MET A 122 -5.914 -2.702 -27.880 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.729 -2.256 -31.711 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.771 -1.403 -30.547 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.084 -1.780 -30.122 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.154 -3.685 -26.836 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.569 -3.217 -26.768 1.00 0.00 C ATOM 1881 C ASN A 123 -12.528 -4.395 -26.410 1.00 0.00 C ATOM 1882 O ASN A 123 -13.211 -4.346 -25.385 1.00 0.00 O ATOM 1883 CB ASN A 123 -11.960 -2.467 -28.075 1.00 0.00 C ATOM 1884 CG ASN A 123 -11.477 -1.016 -28.158 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -12.185 -0.087 -27.786 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.280 -0.778 -28.636 1.00 0.00 N ATOM 0 H ASN A 123 -10.003 -4.434 -27.511 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.671 -2.493 -25.959 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -11.558 -3.017 -28.926 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -13.046 -2.479 -28.172 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -9.937 0.181 -28.699 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.691 -1.551 -28.945 1.00 0.00 H new ATOM 1893 N ASN A 124 -12.578 -5.438 -27.249 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.429 -6.643 -27.036 1.00 0.00 C ATOM 1895 C ASN A 124 -12.663 -7.850 -26.397 1.00 0.00 C ATOM 1896 O ASN A 124 -13.234 -8.554 -25.560 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.065 -7.093 -28.388 1.00 0.00 C ATOM 1898 CG ASN A 124 -14.806 -6.041 -29.223 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -15.973 -5.733 -29.008 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -14.145 -5.463 -30.199 1.00 0.00 N ATOM 0 H ASN A 124 -12.028 -5.481 -28.107 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.200 -6.347 -26.325 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -13.271 -7.512 -29.007 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -14.763 -7.902 -28.175 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -14.602 -4.758 -30.778 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -13.174 -5.719 -30.379 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.426 -8.157 -26.843 1.00 0.00 N ATOM 1908 CA VAL A 125 -10.818 -9.507 -26.698 1.00 0.00 C ATOM 1909 C VAL A 125 -9.820 -9.515 -25.493 1.00 0.00 C ATOM 1910 O VAL A 125 -8.912 -8.682 -25.379 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.168 -9.945 -28.053 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.578 -11.370 -27.989 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.129 -9.935 -29.269 1.00 0.00 C ATOM 0 H VAL A 125 -10.820 -7.484 -27.312 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.584 -10.247 -26.469 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.395 -9.191 -28.198 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.139 -11.626 -28.953 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.809 -11.411 -27.218 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.369 -12.081 -27.750 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.590 -10.252 -30.162 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.958 -10.618 -29.083 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.516 -8.927 -29.418 1.00 0.00 H new ATOM 1923 N THR A 126 -10.018 -10.489 -24.596 1.00 0.00 N ATOM 1924 CA THR A 126 -9.370 -10.522 -23.255 1.00 0.00 C ATOM 1925 C THR A 126 -8.311 -11.665 -23.145 1.00 0.00 C ATOM 1926 O THR A 126 -8.556 -12.802 -23.564 1.00 0.00 O ATOM 1927 CB THR A 126 -10.461 -10.664 -22.141 1.00 0.00 C ATOM 1928 OG1 THR A 126 -11.221 -11.857 -22.296 1.00 0.00 O ATOM 1929 CG2 THR A 126 -11.474 -9.510 -22.067 1.00 0.00 C ATOM 0 H THR A 126 -10.632 -11.285 -24.769 1.00 0.00 H new ATOM 0 HA THR A 126 -8.837 -9.582 -23.116 1.00 0.00 H new ATOM 0 HB THR A 126 -9.872 -10.668 -21.224 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.891 -11.913 -21.583 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.187 -9.702 -21.265 1.00 0.00 H new ATOM 0 HG22 THR A 126 -10.948 -8.576 -21.869 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.007 -9.432 -23.015 1.00 0.00 H new ATOM 1937 N CYS A 127 -7.159 -11.387 -22.504 1.00 0.00 N ATOM 1938 CA CYS A 127 -6.295 -12.456 -21.929 1.00 0.00 C ATOM 1939 C CYS A 127 -6.407 -12.476 -20.377 1.00 0.00 C ATOM 1940 O CYS A 127 -6.241 -11.426 -19.750 1.00 0.00 O ATOM 1941 CB CYS A 127 -4.828 -12.279 -22.387 1.00 0.00 C ATOM 1942 SG CYS A 127 -3.856 -11.246 -21.270 1.00 0.00 S ATOM 0 H CYS A 127 -6.801 -10.442 -22.368 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.644 -13.420 -22.300 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -4.358 -13.259 -22.467 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.816 -11.837 -23.383 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.231 -10.007 -21.388 1.00 0.00 H new ATOM 1947 N THR A 128 -6.607 -13.649 -19.754 1.00 0.00 N ATOM 1948 CA THR A 128 -6.503 -13.800 -18.268 1.00 0.00 C ATOM 1949 C THR A 128 -5.211 -14.621 -17.957 1.00 0.00 C ATOM 1950 O THR A 128 -5.150 -15.833 -18.199 1.00 0.00 O ATOM 1951 CB THR A 128 -7.816 -14.393 -17.666 1.00 0.00 C ATOM 1952 OG1 THR A 128 -8.915 -13.512 -17.902 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.790 -14.673 -16.154 1.00 0.00 C ATOM 0 H THR A 128 -6.842 -14.513 -20.243 1.00 0.00 H new ATOM 0 HA THR A 128 -6.403 -12.832 -17.777 1.00 0.00 H new ATOM 0 HB THR A 128 -7.920 -15.351 -18.175 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.399 -13.361 -17.063 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.751 -15.082 -15.843 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.001 -15.391 -15.930 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.600 -13.745 -15.615 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.173 -13.944 -17.435 1.00 0.00 N ATOM 1962 CA ARG A 129 -2.843 -14.559 -17.192 1.00 0.00 C ATOM 1963 C ARG A 129 -2.570 -14.705 -15.662 1.00 0.00 C ATOM 1964 O ARG A 129 -2.400 -13.707 -14.956 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.789 -13.650 -17.879 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.673 -13.758 -19.420 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.518 -12.916 -19.999 1.00 0.00 C ATOM 1968 NE ARG A 129 -0.850 -11.464 -19.963 1.00 0.00 N ATOM 1969 CZ ARG A 129 -0.009 -10.474 -20.254 1.00 0.00 C ATOM 1970 NH1 ARG A 129 1.274 -10.645 -20.451 1.00 0.00 N ATOM 1971 NH2 ARG A 129 -0.489 -9.268 -20.350 1.00 0.00 N ATOM 0 H ARG A 129 -4.225 -12.961 -17.169 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.797 -15.566 -17.607 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.017 -12.614 -17.627 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.813 -13.875 -17.448 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.527 -14.803 -19.695 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.611 -13.437 -19.873 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.393 -13.099 -19.429 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.318 -13.222 -21.026 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.800 -11.207 -19.693 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.680 -11.578 -20.384 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.867 -9.845 -20.671 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -1.485 -9.102 -20.203 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.131 -8.489 -20.572 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.492 -15.945 -15.146 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.238 -16.205 -13.695 1.00 0.00 C ATOM 1987 C ILE A 130 -0.694 -16.336 -13.475 1.00 0.00 C ATOM 1988 O ILE A 130 -0.051 -17.259 -13.992 1.00 0.00 O ATOM 1989 CB ILE A 130 -3.015 -17.460 -13.151 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.487 -17.659 -13.634 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.951 -17.575 -11.604 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.493 -16.547 -13.295 1.00 0.00 C ATOM 0 H ILE A 130 -2.600 -16.792 -15.704 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.622 -15.363 -13.119 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.459 -18.274 -13.617 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.473 -17.784 -14.717 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.859 -18.592 -13.210 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.503 -18.458 -11.282 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.911 -17.662 -11.288 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.394 -16.686 -11.154 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.474 -16.812 -13.688 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.555 -16.430 -12.213 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.164 -15.610 -13.743 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.116 -15.416 -12.688 1.00 0.00 N ATOM 2005 CA TYR A 131 1.332 -15.424 -12.355 1.00 0.00 C ATOM 2006 C TYR A 131 1.556 -15.854 -10.865 1.00 0.00 C ATOM 2007 O TYR A 131 1.020 -15.236 -9.937 1.00 0.00 O ATOM 2008 CB TYR A 131 1.913 -14.007 -12.605 1.00 0.00 C ATOM 2009 CG TYR A 131 2.174 -13.531 -14.046 1.00 0.00 C ATOM 2010 CD1 TYR A 131 1.131 -13.072 -14.853 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.492 -13.427 -14.510 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.397 -12.533 -16.112 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.756 -12.881 -15.763 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.711 -12.443 -16.567 1.00 0.00 C ATOM 2015 OH TYR A 131 2.967 -11.916 -17.804 1.00 0.00 O ATOM 0 H TYR A 131 -0.630 -14.645 -12.262 1.00 0.00 H new ATOM 0 HA TYR A 131 1.845 -16.147 -12.990 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.233 -13.291 -12.144 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.858 -13.943 -12.065 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.112 -13.135 -14.500 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.308 -13.772 -13.892 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.585 -12.186 -16.734 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.775 -12.798 -16.111 1.00 0.00 H new ATOM 0 HH TYR A 131 3.933 -11.924 -17.969 1.00 0.00 H new ATOM 2025 N GLU A 132 2.383 -16.887 -10.637 1.00 0.00 N ATOM 2026 CA GLU A 132 2.716 -17.395 -9.275 1.00 0.00 C ATOM 2027 C GLU A 132 3.999 -16.755 -8.643 1.00 0.00 C ATOM 2028 O GLU A 132 4.978 -16.439 -9.328 1.00 0.00 O ATOM 2029 CB GLU A 132 2.700 -18.950 -9.306 1.00 0.00 C ATOM 2030 CG GLU A 132 3.723 -19.708 -10.203 1.00 0.00 C ATOM 2031 CD GLU A 132 5.118 -20.002 -9.662 1.00 0.00 C ATOM 2032 OE1 GLU A 132 5.376 -19.841 -8.452 1.00 0.00 O ATOM 2033 OE2 GLU A 132 5.966 -20.436 -10.470 1.00 0.00 O ATOM 0 H GLU A 132 2.846 -17.402 -11.386 1.00 0.00 H new ATOM 0 HA GLU A 132 1.946 -17.065 -8.578 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.841 -19.299 -8.283 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.702 -19.261 -9.614 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.272 -20.661 -10.480 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.843 -19.133 -11.121 1.00 0.00 H new ATOM 2040 N LYS A 133 3.953 -16.520 -7.317 1.00 0.00 N ATOM 2041 CA LYS A 133 5.025 -15.813 -6.560 1.00 0.00 C ATOM 2042 C LYS A 133 6.213 -16.760 -6.195 1.00 0.00 C ATOM 2043 O LYS A 133 6.048 -17.721 -5.435 1.00 0.00 O ATOM 2044 CB LYS A 133 4.367 -15.179 -5.295 1.00 0.00 C ATOM 2045 CG LYS A 133 5.016 -13.857 -4.822 1.00 0.00 C ATOM 2046 CD LYS A 133 4.174 -13.140 -3.731 1.00 0.00 C ATOM 2047 CE LYS A 133 4.489 -11.641 -3.530 1.00 0.00 C ATOM 2048 NZ LYS A 133 5.709 -11.431 -2.711 1.00 0.00 N ATOM 0 H LYS A 133 3.171 -16.813 -6.731 1.00 0.00 H new ATOM 0 HA LYS A 133 5.465 -15.033 -7.181 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.313 -14.996 -5.504 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.410 -15.901 -4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.012 -14.064 -4.430 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.141 -13.191 -5.676 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.119 -13.241 -3.985 1.00 0.00 H new ATOM 0 HD3 LYS A 133 4.324 -13.656 -2.783 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.619 -11.165 -4.502 1.00 0.00 H new ATOM 0 HE3 LYS A 133 3.641 -11.154 -3.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.845 -10.413 -2.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 5.603 -11.920 -1.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.535 -11.812 -3.215 1.00 0.00 H new ATOM 2062 N VAL A 134 7.410 -16.478 -6.732 1.00 0.00 N ATOM 2063 CA VAL A 134 8.591 -17.388 -6.614 1.00 0.00 C ATOM 2064 C VAL A 134 9.527 -16.821 -5.497 1.00 0.00 C ATOM 2065 O VAL A 134 10.382 -15.963 -5.751 1.00 0.00 O ATOM 2066 CB VAL A 134 9.285 -17.571 -8.010 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.525 -18.495 -7.961 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.350 -18.144 -9.103 1.00 0.00 C ATOM 0 H VAL A 134 7.600 -15.625 -7.258 1.00 0.00 H new ATOM 0 HA VAL A 134 8.296 -18.394 -6.315 1.00 0.00 H new ATOM 0 HB VAL A 134 9.578 -16.553 -8.267 1.00 0.00 H new ATOM 0 HG11 VAL A 134 10.956 -18.578 -8.959 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.265 -18.075 -7.280 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.229 -19.484 -7.610 1.00 0.00 H new ATOM 0 HG21 VAL A 134 8.901 -18.242 -10.038 1.00 0.00 H new ATOM 0 HG22 VAL A 134 7.985 -19.123 -8.793 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.505 -17.471 -9.248 1.00 0.00 H new ATOM 2078 N GLU A 135 9.338 -17.309 -4.262 1.00 0.00 N ATOM 2079 CA GLU A 135 10.048 -16.814 -3.055 1.00 0.00 C ATOM 2080 C GLU A 135 10.070 -17.906 -1.953 1.00 0.00 C ATOM 2081 O GLU A 135 9.022 -18.527 -1.649 1.00 0.00 O ATOM 2082 CB GLU A 135 9.483 -15.446 -2.571 1.00 0.00 C ATOM 2083 CG GLU A 135 7.989 -15.368 -2.149 1.00 0.00 C ATOM 2084 CD GLU A 135 7.422 -13.950 -2.071 1.00 0.00 C ATOM 2085 OE1 GLU A 135 7.682 -13.124 -2.978 1.00 0.00 O ATOM 2086 OE2 GLU A 135 6.640 -13.651 -1.143 1.00 0.00 O ATOM 2087 OXT GLU A 135 11.161 -18.144 -1.385 1.00 0.00 O ATOM 0 H GLU A 135 8.684 -18.066 -4.063 1.00 0.00 H new ATOM 0 HA GLU A 135 11.087 -16.615 -3.317 1.00 0.00 H new ATOM 0 HB2 GLU A 135 10.085 -15.120 -1.722 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.640 -14.721 -3.370 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.394 -15.944 -2.858 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.875 -15.845 -1.175 1.00 0.00 H new TER 2094 GLU A 135