USER MOD reduce.3.24.130724 H: found=0, std=0, add=1102, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1097 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 32 SER OG : rot 180:sc= -0.0261 USER MOD Set 1.2: A 126 ASN : amide:sc= -0.0359 X(o=-0.062,f=0.034) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 129:sc= 0.032 (180deg=0) USER MOD Single : A 10 THR OG1 : rot -60:sc= 1.49 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 CYS SG : rot -64:sc= 0.49 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 TYR OH : rot -23:sc= 0.00855 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc=-0.00646 K(o=-0.0065,f=-1.9!) USER MOD Single : A 46 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.21) USER MOD Single : A 48 HIS : no HE2:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 53 GLN : amide:sc= -0.0816 K(o=-0.082,f=-5.2!) USER MOD Single : A 58 TYR OH : rot 155:sc= 1.09 USER MOD Single : A 59 CYS SG : rot -47:sc= 0.00478 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 90:sc= 0.557 USER MOD Single : A 70 LYS NZ :NH3+ -125:sc= 0.179 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= -2.17 K(o=-2.2,f=-3!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -106:sc=-0.00607 (180deg=-2.26!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 81 MET CE :methyl 162:sc= -0.0364 (180deg=-0.34) USER MOD Single : A 95 MET CE :methyl 178:sc= -0.122 (180deg=-0.133) USER MOD Single : A 99 ASN : amide:sc= -0.0936 X(o=-0.094,f=-0.036) USER MOD Single : A 102 ASN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 141:sc= 0.248 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.053) USER MOD Single : A 115 ASN : amide:sc= -0.958 K(o=-0.96,f=0) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 136 SER OG : rot 37:sc= 0.693 USER MOD Single : A 137 ASN : amide:sc= -0.203 X(o=-0.2,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 3.684 -1.145 -3.460 1.00 0.00 N ATOM 2 CA GLY A -1 2.887 -0.115 -2.750 1.00 0.00 C ATOM 3 C GLY A -1 2.153 0.807 -3.715 1.00 0.00 C ATOM 4 O GLY A -1 2.604 1.022 -4.841 1.00 0.00 O ATOM 0 H1 GLY A -1 4.657 -1.146 -3.092 1.00 0.00 H new ATOM 0 H2 GLY A -1 3.256 -2.081 -3.309 1.00 0.00 H new ATOM 0 H3 GLY A -1 3.699 -0.932 -4.478 1.00 0.00 H new ATOM 0 HA2 GLY A -1 2.165 -0.603 -2.096 1.00 0.00 H new ATOM 0 HA3 GLY A -1 3.545 0.477 -2.113 1.00 0.00 H new ATOM 8 N GLY A 0 1.033 1.381 -3.267 1.00 0.00 N ATOM 9 CA GLY A 0 0.221 2.377 -3.963 1.00 0.00 C ATOM 10 C GLY A 0 0.031 3.625 -3.095 1.00 0.00 C ATOM 11 O GLY A 0 0.201 3.586 -1.875 1.00 0.00 O ATOM 0 H GLY A 0 0.647 1.147 -2.352 1.00 0.00 H new ATOM 0 HA2 GLY A 0 0.700 2.651 -4.903 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -0.751 1.951 -4.213 1.00 0.00 H new ATOM 15 N ALA A 1 -0.306 4.746 -3.731 1.00 0.00 N ATOM 16 CA ALA A 1 -0.425 6.063 -3.103 1.00 0.00 C ATOM 17 C ALA A 1 -1.291 7.027 -3.942 1.00 0.00 C ATOM 18 O ALA A 1 -1.727 6.698 -5.051 1.00 0.00 O ATOM 19 CB ALA A 1 0.996 6.580 -2.878 1.00 0.00 C ATOM 0 H ALA A 1 -0.511 4.764 -4.730 1.00 0.00 H new ATOM 0 HA ALA A 1 -0.945 5.990 -2.148 1.00 0.00 H new ATOM 0 HB1 ALA A 1 0.955 7.563 -2.410 1.00 0.00 H new ATOM 0 HB2 ALA A 1 1.535 5.891 -2.228 1.00 0.00 H new ATOM 0 HB3 ALA A 1 1.512 6.655 -3.835 1.00 0.00 H new ATOM 25 N LEU A 2 -1.534 8.224 -3.406 1.00 0.00 N ATOM 26 CA LEU A 2 -2.447 9.232 -3.948 1.00 0.00 C ATOM 27 C LEU A 2 -1.657 10.440 -4.483 1.00 0.00 C ATOM 28 O LEU A 2 -0.629 10.806 -3.909 1.00 0.00 O ATOM 29 CB LEU A 2 -3.399 9.696 -2.829 1.00 0.00 C ATOM 30 CG LEU A 2 -4.281 8.662 -2.100 1.00 0.00 C ATOM 31 CD1 LEU A 2 -4.974 7.681 -3.043 1.00 0.00 C ATOM 32 CD2 LEU A 2 -3.541 7.924 -0.989 1.00 0.00 C ATOM 0 H LEU A 2 -1.081 8.531 -2.545 1.00 0.00 H new ATOM 0 HA LEU A 2 -3.016 8.796 -4.769 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -2.794 10.198 -2.074 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.063 10.447 -3.257 1.00 0.00 H new ATOM 0 HG LEU A 2 -5.065 9.255 -1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -5.577 6.983 -2.463 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -5.616 8.230 -3.731 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -4.224 7.129 -3.609 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -4.215 7.211 -0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -2.688 7.392 -1.411 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -3.190 8.641 -0.247 1.00 0.00 H new ATOM 44 N SER A 3 -2.111 11.067 -5.572 1.00 0.00 N ATOM 45 CA SER A 3 -1.440 12.249 -6.143 1.00 0.00 C ATOM 46 C SER A 3 -1.520 13.476 -5.218 1.00 0.00 C ATOM 47 O SER A 3 -2.350 13.531 -4.311 1.00 0.00 O ATOM 48 CB SER A 3 -2.032 12.562 -7.521 1.00 0.00 C ATOM 49 OG SER A 3 -1.213 13.497 -8.205 1.00 0.00 O ATOM 0 H SER A 3 -2.945 10.777 -6.082 1.00 0.00 H new ATOM 0 HA SER A 3 -0.381 12.012 -6.249 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.116 11.646 -8.105 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.039 12.963 -7.410 1.00 0.00 H new ATOM 0 HG SER A 3 -1.600 13.688 -9.085 1.00 0.00 H new ATOM 55 N TYR A 4 -0.690 14.500 -5.456 1.00 0.00 N ATOM 56 CA TYR A 4 -0.752 15.772 -4.724 1.00 0.00 C ATOM 57 C TYR A 4 -2.170 16.372 -4.728 1.00 0.00 C ATOM 58 O TYR A 4 -2.682 16.789 -3.691 1.00 0.00 O ATOM 59 CB TYR A 4 0.251 16.762 -5.337 1.00 0.00 C ATOM 60 CG TYR A 4 0.293 18.108 -4.636 1.00 0.00 C ATOM 61 CD1 TYR A 4 -0.625 19.115 -4.993 1.00 0.00 C ATOM 62 CD2 TYR A 4 1.238 18.350 -3.620 1.00 0.00 C ATOM 63 CE1 TYR A 4 -0.619 20.353 -4.322 1.00 0.00 C ATOM 64 CE2 TYR A 4 1.253 19.589 -2.951 1.00 0.00 C ATOM 65 CZ TYR A 4 0.322 20.592 -3.297 1.00 0.00 C ATOM 66 OH TYR A 4 0.340 21.789 -2.649 1.00 0.00 O ATOM 0 H TYR A 4 0.045 14.470 -6.163 1.00 0.00 H new ATOM 0 HA TYR A 4 -0.491 15.578 -3.684 1.00 0.00 H new ATOM 0 HB2 TYR A 4 1.246 16.319 -5.311 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -0.001 16.917 -6.386 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -1.337 18.937 -5.785 1.00 0.00 H new ATOM 0 HD2 TYR A 4 1.952 17.585 -3.354 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -1.333 21.118 -4.591 1.00 0.00 H new ATOM 0 HE2 TYR A 4 1.978 19.772 -2.172 1.00 0.00 H new ATOM 0 HH TYR A 4 1.049 21.784 -1.973 1.00 0.00 H new ATOM 76 N GLU A 5 -2.825 16.356 -5.896 1.00 0.00 N ATOM 77 CA GLU A 5 -4.180 16.890 -6.130 1.00 0.00 C ATOM 78 C GLU A 5 -5.292 16.163 -5.354 1.00 0.00 C ATOM 79 O GLU A 5 -6.426 16.644 -5.287 1.00 0.00 O ATOM 80 CB GLU A 5 -4.512 16.819 -7.628 1.00 0.00 C ATOM 81 CG GLU A 5 -3.434 17.461 -8.508 1.00 0.00 C ATOM 82 CD GLU A 5 -3.938 17.699 -9.944 1.00 0.00 C ATOM 83 OE1 GLU A 5 -4.579 16.792 -10.529 1.00 0.00 O ATOM 84 OE2 GLU A 5 -3.692 18.799 -10.500 1.00 0.00 O ATOM 0 H GLU A 5 -2.413 15.956 -6.739 1.00 0.00 H new ATOM 0 HA GLU A 5 -4.156 17.917 -5.766 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -4.637 15.776 -7.918 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -5.465 17.317 -7.808 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -3.123 18.409 -8.069 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -2.554 16.818 -8.533 1.00 0.00 H new ATOM 91 N THR A 6 -4.983 14.997 -4.785 1.00 0.00 N ATOM 92 CA THR A 6 -5.885 14.194 -3.952 1.00 0.00 C ATOM 93 C THR A 6 -6.038 14.811 -2.564 1.00 0.00 C ATOM 94 O THR A 6 -5.355 14.449 -1.604 1.00 0.00 O ATOM 95 CB THR A 6 -5.412 12.735 -3.859 1.00 0.00 C ATOM 96 OG1 THR A 6 -5.156 12.224 -5.149 1.00 0.00 O ATOM 97 CG2 THR A 6 -6.452 11.834 -3.192 1.00 0.00 C ATOM 0 H THR A 6 -4.064 14.568 -4.895 1.00 0.00 H new ATOM 0 HA THR A 6 -6.864 14.192 -4.431 1.00 0.00 H new ATOM 0 HB THR A 6 -4.506 12.737 -3.254 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.854 11.294 -5.079 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.074 10.813 -3.148 1.00 0.00 H new ATOM 0 HG22 THR A 6 -6.649 12.192 -2.181 1.00 0.00 H new ATOM 0 HG23 THR A 6 -7.376 11.855 -3.770 1.00 0.00 H new ATOM 105 N GLU A 7 -6.912 15.808 -2.465 1.00 0.00 N ATOM 106 CA GLU A 7 -7.192 16.476 -1.196 1.00 0.00 C ATOM 107 C GLU A 7 -7.982 15.568 -0.245 1.00 0.00 C ATOM 108 O GLU A 7 -8.892 14.836 -0.650 1.00 0.00 O ATOM 109 CB GLU A 7 -7.909 17.820 -1.390 1.00 0.00 C ATOM 110 CG GLU A 7 -7.342 18.658 -2.547 1.00 0.00 C ATOM 111 CD GLU A 7 -7.829 20.120 -2.527 1.00 0.00 C ATOM 112 OE1 GLU A 7 -9.054 20.361 -2.406 1.00 0.00 O ATOM 113 OE2 GLU A 7 -6.992 21.040 -2.695 1.00 0.00 O ATOM 0 H GLU A 7 -7.443 16.174 -3.255 1.00 0.00 H new ATOM 0 HA GLU A 7 -6.226 16.689 -0.738 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -8.968 17.635 -1.571 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -7.840 18.396 -0.467 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.253 18.643 -2.500 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -7.626 18.199 -3.494 1.00 0.00 H new ATOM 120 N ILE A 8 -7.646 15.664 1.038 1.00 0.00 N ATOM 121 CA ILE A 8 -8.200 14.874 2.135 1.00 0.00 C ATOM 122 C ILE A 8 -8.867 15.866 3.086 1.00 0.00 C ATOM 123 O ILE A 8 -8.257 16.869 3.472 1.00 0.00 O ATOM 124 CB ILE A 8 -7.075 14.083 2.853 1.00 0.00 C ATOM 125 CG1 ILE A 8 -6.200 13.240 1.899 1.00 0.00 C ATOM 126 CG2 ILE A 8 -7.600 13.185 3.986 1.00 0.00 C ATOM 127 CD1 ILE A 8 -6.934 12.257 0.976 1.00 0.00 C ATOM 0 H ILE A 8 -6.943 16.330 1.358 1.00 0.00 H new ATOM 0 HA ILE A 8 -8.920 14.140 1.774 1.00 0.00 H new ATOM 0 HB ILE A 8 -6.447 14.862 3.285 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.620 13.922 1.277 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.488 12.675 2.501 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.766 12.658 4.449 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.102 13.799 4.734 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.305 12.461 3.579 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.209 11.728 0.358 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.490 11.539 1.578 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.625 12.806 0.336 1.00 0.00 H new ATOM 139 N LEU A 9 -10.126 15.617 3.444 1.00 0.00 N ATOM 140 CA LEU A 9 -10.792 16.384 4.508 1.00 0.00 C ATOM 141 C LEU A 9 -10.012 16.274 5.839 1.00 0.00 C ATOM 142 O LEU A 9 -9.680 15.172 6.283 1.00 0.00 O ATOM 143 CB LEU A 9 -12.252 15.908 4.643 1.00 0.00 C ATOM 144 CG LEU A 9 -13.122 16.800 5.554 1.00 0.00 C ATOM 145 CD1 LEU A 9 -13.438 18.166 4.944 1.00 0.00 C ATOM 146 CD2 LEU A 9 -14.453 16.103 5.836 1.00 0.00 C ATOM 0 H LEU A 9 -10.707 14.895 3.018 1.00 0.00 H new ATOM 0 HA LEU A 9 -10.804 17.442 4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -12.704 15.869 3.652 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -12.257 14.891 5.036 1.00 0.00 H new ATOM 0 HG LEU A 9 -12.542 16.959 6.463 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -14.052 18.741 5.637 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -12.509 18.703 4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -13.978 18.030 4.007 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -15.065 16.735 6.479 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -14.977 15.926 4.897 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -14.267 15.151 6.333 1.00 0.00 H new ATOM 158 N THR A 10 -9.749 17.411 6.489 1.00 0.00 N ATOM 159 CA THR A 10 -8.993 17.514 7.755 1.00 0.00 C ATOM 160 C THR A 10 -9.716 18.392 8.781 1.00 0.00 C ATOM 161 O THR A 10 -10.362 19.376 8.415 1.00 0.00 O ATOM 162 CB THR A 10 -7.561 18.053 7.548 1.00 0.00 C ATOM 163 OG1 THR A 10 -7.571 19.338 6.966 1.00 0.00 O ATOM 164 CG2 THR A 10 -6.661 17.147 6.706 1.00 0.00 C ATOM 0 H THR A 10 -10.063 18.318 6.143 1.00 0.00 H new ATOM 0 HA THR A 10 -8.926 16.496 8.138 1.00 0.00 H new ATOM 0 HB THR A 10 -7.141 18.090 8.553 1.00 0.00 H new ATOM 0 HG1 THR A 10 -8.022 19.300 6.097 1.00 0.00 H new ATOM 0 HG21 THR A 10 -5.675 17.601 6.611 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.568 16.175 7.190 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.098 17.018 5.716 1.00 0.00 H new ATOM 172 N VAL A 11 -9.614 18.053 10.074 1.00 0.00 N ATOM 173 CA VAL A 11 -10.270 18.832 11.154 1.00 0.00 C ATOM 174 C VAL A 11 -9.535 20.146 11.439 1.00 0.00 C ATOM 175 O VAL A 11 -10.162 21.154 11.768 1.00 0.00 O ATOM 176 CB VAL A 11 -10.428 18.024 12.462 1.00 0.00 C ATOM 177 CG1 VAL A 11 -11.271 18.761 13.510 1.00 0.00 C ATOM 178 CG2 VAL A 11 -11.100 16.665 12.231 1.00 0.00 C ATOM 0 H VAL A 11 -9.085 17.246 10.406 1.00 0.00 H new ATOM 0 HA VAL A 11 -11.268 19.064 10.783 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.408 17.889 12.823 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.350 18.149 14.409 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -10.795 19.710 13.758 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -12.267 18.948 13.109 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.188 16.136 13.180 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.093 16.817 11.807 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.498 16.074 11.541 1.00 0.00 H new ATOM 188 N GLU A 12 -8.206 20.159 11.280 1.00 0.00 N ATOM 189 CA GLU A 12 -7.387 21.360 11.506 1.00 0.00 C ATOM 190 C GLU A 12 -7.707 22.512 10.538 1.00 0.00 C ATOM 191 O GLU A 12 -7.665 23.673 10.955 1.00 0.00 O ATOM 192 CB GLU A 12 -5.893 21.018 11.385 1.00 0.00 C ATOM 193 CG GLU A 12 -5.225 20.655 12.724 1.00 0.00 C ATOM 194 CD GLU A 12 -3.798 21.238 12.829 1.00 0.00 C ATOM 195 OE1 GLU A 12 -3.007 21.134 11.861 1.00 0.00 O ATOM 196 OE2 GLU A 12 -3.468 21.830 13.888 1.00 0.00 O ATOM 0 H GLU A 12 -7.668 19.342 10.992 1.00 0.00 H new ATOM 0 HA GLU A 12 -7.629 21.699 12.513 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -5.776 20.183 10.694 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.370 21.869 10.948 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.833 21.031 13.547 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -5.183 19.571 12.827 1.00 0.00 H new ATOM 203 N TYR A 13 -8.035 22.208 9.274 1.00 0.00 N ATOM 204 CA TYR A 13 -8.170 23.223 8.219 1.00 0.00 C ATOM 205 C TYR A 13 -9.345 22.986 7.253 1.00 0.00 C ATOM 206 O TYR A 13 -10.106 23.923 6.993 1.00 0.00 O ATOM 207 CB TYR A 13 -6.859 23.304 7.416 1.00 0.00 C ATOM 208 CG TYR A 13 -5.603 23.681 8.188 1.00 0.00 C ATOM 209 CD1 TYR A 13 -5.531 24.916 8.861 1.00 0.00 C ATOM 210 CD2 TYR A 13 -4.488 22.818 8.185 1.00 0.00 C ATOM 211 CE1 TYR A 13 -4.356 25.285 9.545 1.00 0.00 C ATOM 212 CE2 TYR A 13 -3.308 23.188 8.861 1.00 0.00 C ATOM 213 CZ TYR A 13 -3.239 24.420 9.544 1.00 0.00 C ATOM 214 OH TYR A 13 -2.094 24.779 10.187 1.00 0.00 O ATOM 0 H TYR A 13 -8.214 21.256 8.955 1.00 0.00 H new ATOM 0 HA TYR A 13 -8.384 24.162 8.731 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -6.690 22.336 6.944 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -6.996 24.030 6.615 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -6.380 25.583 8.853 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -4.538 21.873 7.664 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.309 26.228 10.069 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.454 22.526 8.856 1.00 0.00 H new ATOM 0 HH TYR A 13 -1.426 24.068 10.088 1.00 0.00 H new ATOM 224 N GLY A 14 -9.505 21.771 6.711 1.00 0.00 N ATOM 225 CA GLY A 14 -10.528 21.448 5.707 1.00 0.00 C ATOM 226 C GLY A 14 -10.008 20.542 4.587 1.00 0.00 C ATOM 227 O GLY A 14 -9.169 19.672 4.818 1.00 0.00 O ATOM 0 H GLY A 14 -8.920 20.974 6.961 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.370 20.960 6.199 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -10.906 22.373 5.272 1.00 0.00 H new ATOM 231 N LEU A 15 -10.526 20.725 3.374 1.00 0.00 N ATOM 232 CA LEU A 15 -10.100 20.024 2.155 1.00 0.00 C ATOM 233 C LEU A 15 -8.707 20.499 1.681 1.00 0.00 C ATOM 234 O LEU A 15 -8.599 21.523 1.000 1.00 0.00 O ATOM 235 CB LEU A 15 -11.165 20.258 1.063 1.00 0.00 C ATOM 236 CG LEU A 15 -12.570 19.716 1.389 1.00 0.00 C ATOM 237 CD1 LEU A 15 -13.536 20.081 0.267 1.00 0.00 C ATOM 238 CD2 LEU A 15 -12.552 18.200 1.543 1.00 0.00 C ATOM 0 H LEU A 15 -11.281 21.389 3.202 1.00 0.00 H new ATOM 0 HA LEU A 15 -10.010 18.958 2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.241 21.329 0.876 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.821 19.796 0.138 1.00 0.00 H new ATOM 0 HG LEU A 15 -12.892 20.164 2.329 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.528 19.696 0.502 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.582 21.165 0.165 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -13.189 19.643 -0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.557 17.846 1.773 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.210 17.744 0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -11.876 17.925 2.353 1.00 0.00 H new ATOM 250 N LEU A 16 -7.644 19.764 2.040 1.00 0.00 N ATOM 251 CA LEU A 16 -6.241 20.116 1.741 1.00 0.00 C ATOM 252 C LEU A 16 -5.477 18.960 1.046 1.00 0.00 C ATOM 253 O LEU A 16 -5.726 17.794 1.356 1.00 0.00 O ATOM 254 CB LEU A 16 -5.504 20.531 3.040 1.00 0.00 C ATOM 255 CG LEU A 16 -5.598 21.996 3.521 1.00 0.00 C ATOM 256 CD1 LEU A 16 -5.096 23.005 2.486 1.00 0.00 C ATOM 257 CD2 LEU A 16 -6.991 22.426 3.966 1.00 0.00 C ATOM 0 H LEU A 16 -7.734 18.889 2.557 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.263 20.956 1.047 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.874 19.896 3.845 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.448 20.295 2.908 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.942 22.005 4.391 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.190 24.014 2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -4.050 22.801 2.257 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.690 22.919 1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.965 23.467 4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.688 22.320 3.134 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.318 21.799 4.795 1.00 0.00 H new ATOM 269 N PRO A 17 -4.533 19.254 0.123 1.00 0.00 N ATOM 270 CA PRO A 17 -3.780 18.258 -0.653 1.00 0.00 C ATOM 271 C PRO A 17 -2.881 17.365 0.216 1.00 0.00 C ATOM 272 O PRO A 17 -2.046 17.860 0.978 1.00 0.00 O ATOM 273 CB PRO A 17 -2.965 19.063 -1.675 1.00 0.00 C ATOM 274 CG PRO A 17 -2.844 20.448 -1.058 1.00 0.00 C ATOM 275 CD PRO A 17 -4.150 20.596 -0.293 1.00 0.00 C ATOM 0 HA PRO A 17 -4.461 17.557 -1.136 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.985 18.616 -1.842 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.467 19.101 -2.642 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -1.979 20.522 -0.399 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -2.732 21.221 -1.819 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -4.023 21.250 0.570 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -4.920 21.043 -0.921 1.00 0.00 H new ATOM 283 N ILE A 18 -3.000 16.039 0.055 1.00 0.00 N ATOM 284 CA ILE A 18 -2.175 15.049 0.773 1.00 0.00 C ATOM 285 C ILE A 18 -0.672 15.254 0.556 1.00 0.00 C ATOM 286 O ILE A 18 0.110 15.124 1.495 1.00 0.00 O ATOM 287 CB ILE A 18 -2.593 13.605 0.405 1.00 0.00 C ATOM 288 CG1 ILE A 18 -1.945 12.588 1.369 1.00 0.00 C ATOM 289 CG2 ILE A 18 -2.302 13.250 -1.063 1.00 0.00 C ATOM 290 CD1 ILE A 18 -2.519 11.174 1.224 1.00 0.00 C ATOM 0 H ILE A 18 -3.676 15.617 -0.582 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.361 15.206 1.835 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.676 13.551 0.519 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.871 12.558 1.188 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.086 12.928 2.395 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.617 12.225 -1.259 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -2.849 13.929 -1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -1.233 13.344 -1.255 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.023 10.506 1.928 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.589 11.192 1.433 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -2.354 10.817 0.207 1.00 0.00 H new ATOM 302 N GLY A 19 -0.262 15.641 -0.658 1.00 0.00 N ATOM 303 CA GLY A 19 1.152 15.808 -0.983 1.00 0.00 C ATOM 304 C GLY A 19 1.812 16.943 -0.204 1.00 0.00 C ATOM 305 O GLY A 19 2.967 16.813 0.198 1.00 0.00 O ATOM 0 H GLY A 19 -0.895 15.844 -1.431 1.00 0.00 H new ATOM 0 HA2 GLY A 19 1.680 14.877 -0.775 1.00 0.00 H new ATOM 0 HA3 GLY A 19 1.254 16.000 -2.051 1.00 0.00 H new ATOM 309 N LYS A 20 1.064 18.012 0.105 1.00 0.00 N ATOM 310 CA LYS A 20 1.552 19.118 0.937 1.00 0.00 C ATOM 311 C LYS A 20 1.663 18.702 2.405 1.00 0.00 C ATOM 312 O LYS A 20 2.612 19.082 3.086 1.00 0.00 O ATOM 313 CB LYS A 20 0.627 20.335 0.783 1.00 0.00 C ATOM 314 CG LYS A 20 1.374 21.644 1.082 1.00 0.00 C ATOM 315 CD LYS A 20 0.441 22.864 1.114 1.00 0.00 C ATOM 316 CE LYS A 20 -0.318 22.950 2.446 1.00 0.00 C ATOM 317 NZ LYS A 20 -1.160 24.176 2.516 1.00 0.00 N ATOM 0 H LYS A 20 0.103 18.133 -0.216 1.00 0.00 H new ATOM 0 HA LYS A 20 2.552 19.389 0.598 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.227 20.365 -0.231 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.223 20.236 1.458 1.00 0.00 H new ATOM 0 HG2 LYS A 20 1.883 21.556 2.042 1.00 0.00 H new ATOM 0 HG3 LYS A 20 2.143 21.800 0.326 1.00 0.00 H new ATOM 0 HD2 LYS A 20 1.023 23.774 0.965 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.271 22.802 0.291 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.947 22.068 2.565 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.393 22.948 3.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -1.659 24.203 3.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.556 25.018 2.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.854 24.165 1.742 1.00 0.00 H new ATOM 331 N ILE A 21 0.728 17.878 2.885 1.00 0.00 N ATOM 332 CA ILE A 21 0.724 17.365 4.261 1.00 0.00 C ATOM 333 C ILE A 21 1.915 16.434 4.460 1.00 0.00 C ATOM 334 O ILE A 21 2.564 16.505 5.497 1.00 0.00 O ATOM 335 CB ILE A 21 -0.624 16.681 4.587 1.00 0.00 C ATOM 336 CG1 ILE A 21 -1.761 17.732 4.596 1.00 0.00 C ATOM 337 CG2 ILE A 21 -0.595 15.902 5.913 1.00 0.00 C ATOM 338 CD1 ILE A 21 -3.166 17.129 4.464 1.00 0.00 C ATOM 0 H ILE A 21 -0.056 17.544 2.325 1.00 0.00 H new ATOM 0 HA ILE A 21 0.827 18.193 4.962 1.00 0.00 H new ATOM 0 HB ILE A 21 -0.811 15.947 3.803 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -1.707 18.303 5.523 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -1.600 18.435 3.778 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -1.569 15.444 6.087 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.167 15.125 5.862 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.363 16.584 6.731 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.908 17.928 4.478 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.240 16.582 3.524 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.349 16.449 5.296 1.00 0.00 H new ATOM 350 N VAL A 22 2.249 15.615 3.461 1.00 0.00 N ATOM 351 CA VAL A 22 3.374 14.674 3.515 1.00 0.00 C ATOM 352 C VAL A 22 4.729 15.347 3.306 1.00 0.00 C ATOM 353 O VAL A 22 5.669 15.049 4.041 1.00 0.00 O ATOM 354 CB VAL A 22 3.136 13.526 2.519 1.00 0.00 C ATOM 355 CG1 VAL A 22 4.350 12.604 2.348 1.00 0.00 C ATOM 356 CG2 VAL A 22 1.956 12.686 3.031 1.00 0.00 C ATOM 0 H VAL A 22 1.739 15.585 2.578 1.00 0.00 H new ATOM 0 HA VAL A 22 3.416 14.262 4.523 1.00 0.00 H new ATOM 0 HB VAL A 22 2.937 13.975 1.546 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.112 11.818 1.632 1.00 0.00 H new ATOM 0 HG12 VAL A 22 5.198 13.183 1.982 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.604 12.155 3.308 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.768 11.864 2.340 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.195 12.285 4.016 1.00 0.00 H new ATOM 0 HG23 VAL A 22 1.067 13.312 3.101 1.00 0.00 H new ATOM 366 N GLU A 23 4.857 16.282 2.362 1.00 0.00 N ATOM 367 CA GLU A 23 6.144 16.943 2.094 1.00 0.00 C ATOM 368 C GLU A 23 6.532 17.986 3.158 1.00 0.00 C ATOM 369 O GLU A 23 7.718 18.280 3.330 1.00 0.00 O ATOM 370 CB GLU A 23 6.154 17.534 0.676 1.00 0.00 C ATOM 371 CG GLU A 23 5.488 18.908 0.548 1.00 0.00 C ATOM 372 CD GLU A 23 5.332 19.397 -0.911 1.00 0.00 C ATOM 373 OE1 GLU A 23 5.822 18.745 -1.865 1.00 0.00 O ATOM 374 OE2 GLU A 23 4.741 20.487 -1.109 1.00 0.00 O ATOM 0 H GLU A 23 4.090 16.600 1.770 1.00 0.00 H new ATOM 0 HA GLU A 23 6.916 16.176 2.156 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.187 17.614 0.338 1.00 0.00 H new ATOM 0 HB3 GLU A 23 5.652 16.838 0.004 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.504 18.868 1.014 1.00 0.00 H new ATOM 0 HG3 GLU A 23 6.075 19.638 1.105 1.00 0.00 H new ATOM 381 N LYS A 24 5.542 18.506 3.905 1.00 0.00 N ATOM 382 CA LYS A 24 5.726 19.474 5.007 1.00 0.00 C ATOM 383 C LYS A 24 5.447 18.853 6.385 1.00 0.00 C ATOM 384 O LYS A 24 5.552 19.545 7.399 1.00 0.00 O ATOM 385 CB LYS A 24 4.851 20.726 4.784 1.00 0.00 C ATOM 386 CG LYS A 24 4.975 21.408 3.411 1.00 0.00 C ATOM 387 CD LYS A 24 6.392 21.869 3.028 1.00 0.00 C ATOM 388 CE LYS A 24 7.029 22.856 4.018 1.00 0.00 C ATOM 389 NZ LYS A 24 6.289 24.145 4.098 1.00 0.00 N ATOM 0 H LYS A 24 4.564 18.259 3.757 1.00 0.00 H new ATOM 0 HA LYS A 24 6.775 19.772 4.999 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.808 20.446 4.934 1.00 0.00 H new ATOM 0 HB3 LYS A 24 5.098 21.458 5.553 1.00 0.00 H new ATOM 0 HG2 LYS A 24 4.617 20.717 2.648 1.00 0.00 H new ATOM 0 HG3 LYS A 24 4.313 22.273 3.393 1.00 0.00 H new ATOM 0 HD2 LYS A 24 7.035 20.993 2.943 1.00 0.00 H new ATOM 0 HD3 LYS A 24 6.355 22.334 2.043 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.065 22.400 5.007 1.00 0.00 H new ATOM 0 HE3 LYS A 24 8.059 23.051 3.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 6.760 24.774 4.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 6.276 24.597 3.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 5.313 23.966 4.410 1.00 0.00 H new ATOM 403 N ARG A 25 5.120 17.551 6.415 1.00 0.00 N ATOM 404 CA ARG A 25 4.793 16.745 7.612 1.00 0.00 C ATOM 405 C ARG A 25 3.805 17.441 8.565 1.00 0.00 C ATOM 406 O ARG A 25 4.105 17.669 9.741 1.00 0.00 O ATOM 407 CB ARG A 25 6.080 16.259 8.307 1.00 0.00 C ATOM 408 CG ARG A 25 7.045 15.519 7.360 1.00 0.00 C ATOM 409 CD ARG A 25 8.229 16.378 6.891 1.00 0.00 C ATOM 410 NE ARG A 25 9.098 16.784 8.019 1.00 0.00 N ATOM 411 CZ ARG A 25 10.076 17.672 7.987 1.00 0.00 C ATOM 412 NH1 ARG A 25 10.430 18.283 6.890 1.00 0.00 N ATOM 413 NH2 ARG A 25 10.729 17.967 9.076 1.00 0.00 N ATOM 0 H ARG A 25 5.073 16.998 5.559 1.00 0.00 H new ATOM 0 HA ARG A 25 4.255 15.860 7.273 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.595 17.116 8.742 1.00 0.00 H new ATOM 0 HB3 ARG A 25 5.812 15.597 9.130 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.428 14.633 7.866 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.490 15.173 6.488 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.817 15.819 6.163 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.854 17.267 6.383 1.00 0.00 H new ATOM 0 HE ARG A 25 8.923 16.330 8.916 1.00 0.00 H new ATOM 0 HH11 ARG A 25 9.946 18.081 6.015 1.00 0.00 H new ATOM 0 HH12 ARG A 25 11.191 18.962 6.907 1.00 0.00 H new ATOM 0 HH21 ARG A 25 10.485 17.512 9.956 1.00 0.00 H new ATOM 0 HH22 ARG A 25 11.483 18.653 9.048 1.00 0.00 H new ATOM 427 N ILE A 26 2.650 17.860 8.033 1.00 0.00 N ATOM 428 CA ILE A 26 1.665 18.676 8.762 1.00 0.00 C ATOM 429 C ILE A 26 0.903 17.805 9.775 1.00 0.00 C ATOM 430 O ILE A 26 0.234 16.840 9.402 1.00 0.00 O ATOM 431 CB ILE A 26 0.718 19.430 7.796 1.00 0.00 C ATOM 432 CG1 ILE A 26 1.535 20.363 6.868 1.00 0.00 C ATOM 433 CG2 ILE A 26 -0.294 20.263 8.609 1.00 0.00 C ATOM 434 CD1 ILE A 26 0.765 21.004 5.704 1.00 0.00 C ATOM 0 H ILE A 26 2.369 17.642 7.077 1.00 0.00 H new ATOM 0 HA ILE A 26 2.197 19.446 9.321 1.00 0.00 H new ATOM 0 HB ILE A 26 0.183 18.703 7.185 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.964 21.160 7.475 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.367 19.793 6.456 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.960 20.793 7.928 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.880 19.602 9.248 1.00 0.00 H new ATOM 0 HG23 ILE A 26 0.241 20.984 9.227 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.440 21.635 5.125 1.00 0.00 H new ATOM 0 HD12 ILE A 26 0.359 20.222 5.062 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.051 21.611 6.098 1.00 0.00 H new ATOM 446 N GLU A 27 1.011 18.157 11.058 1.00 0.00 N ATOM 447 CA GLU A 27 0.375 17.472 12.200 1.00 0.00 C ATOM 448 C GLU A 27 -1.134 17.754 12.280 1.00 0.00 C ATOM 449 O GLU A 27 -1.594 18.594 13.059 1.00 0.00 O ATOM 450 CB GLU A 27 1.084 17.846 13.515 1.00 0.00 C ATOM 451 CG GLU A 27 2.465 17.195 13.634 1.00 0.00 C ATOM 452 CD GLU A 27 3.150 17.590 14.956 1.00 0.00 C ATOM 453 OE1 GLU A 27 3.759 18.684 15.030 1.00 0.00 O ATOM 454 OE2 GLU A 27 3.090 16.804 15.936 1.00 0.00 O ATOM 0 H GLU A 27 1.567 18.961 11.349 1.00 0.00 H new ATOM 0 HA GLU A 27 0.484 16.399 12.041 1.00 0.00 H new ATOM 0 HB2 GLU A 27 1.189 18.929 13.574 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.466 17.539 14.359 1.00 0.00 H new ATOM 0 HG2 GLU A 27 2.366 16.111 13.582 1.00 0.00 H new ATOM 0 HG3 GLU A 27 3.088 17.499 12.793 1.00 0.00 H new ATOM 461 N CYS A 28 -1.909 17.034 11.466 1.00 0.00 N ATOM 462 CA CYS A 28 -3.345 17.257 11.254 1.00 0.00 C ATOM 463 C CYS A 28 -4.198 16.038 11.648 1.00 0.00 C ATOM 464 O CYS A 28 -3.689 14.997 12.064 1.00 0.00 O ATOM 465 CB CYS A 28 -3.580 17.718 9.798 1.00 0.00 C ATOM 466 SG CYS A 28 -2.923 16.513 8.606 1.00 0.00 S ATOM 0 H CYS A 28 -1.545 16.255 10.918 1.00 0.00 H new ATOM 0 HA CYS A 28 -3.679 18.052 11.921 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -4.647 17.857 9.627 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -3.103 18.685 9.640 1.00 0.00 H new ATOM 0 HG CYS A 28 -1.632 16.435 8.734 1.00 0.00 H new ATOM 472 N THR A 29 -5.519 16.178 11.512 1.00 0.00 N ATOM 473 CA THR A 29 -6.522 15.145 11.833 1.00 0.00 C ATOM 474 C THR A 29 -7.292 14.809 10.556 1.00 0.00 C ATOM 475 O THR A 29 -7.484 15.697 9.732 1.00 0.00 O ATOM 476 CB THR A 29 -7.504 15.659 12.904 1.00 0.00 C ATOM 477 OG1 THR A 29 -6.869 16.441 13.897 1.00 0.00 O ATOM 478 CG2 THR A 29 -8.240 14.564 13.670 1.00 0.00 C ATOM 0 H THR A 29 -5.939 17.040 11.164 1.00 0.00 H new ATOM 0 HA THR A 29 -6.020 14.259 12.223 1.00 0.00 H new ATOM 0 HB THR A 29 -8.209 16.241 12.310 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.534 16.743 14.550 1.00 0.00 H new ATOM 0 HG21 THR A 29 -8.908 15.018 14.402 1.00 0.00 H new ATOM 0 HG22 THR A 29 -8.821 13.960 12.973 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.517 13.930 14.183 1.00 0.00 H new ATOM 486 N VAL A 30 -7.774 13.576 10.398 1.00 0.00 N ATOM 487 CA VAL A 30 -8.462 13.063 9.191 1.00 0.00 C ATOM 488 C VAL A 30 -9.777 12.372 9.562 1.00 0.00 C ATOM 489 O VAL A 30 -10.062 12.215 10.747 1.00 0.00 O ATOM 490 CB VAL A 30 -7.556 12.115 8.370 1.00 0.00 C ATOM 491 CG1 VAL A 30 -6.222 12.778 8.019 1.00 0.00 C ATOM 492 CG2 VAL A 30 -7.271 10.770 9.056 1.00 0.00 C ATOM 0 H VAL A 30 -7.698 12.871 11.131 1.00 0.00 H new ATOM 0 HA VAL A 30 -8.691 13.922 8.561 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.127 11.908 7.465 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.611 12.083 7.442 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -6.406 13.676 7.429 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.697 13.048 8.936 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.630 10.164 8.416 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.771 10.946 10.008 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.210 10.245 9.231 1.00 0.00 H new ATOM 502 N TYR A 31 -10.556 11.929 8.569 1.00 0.00 N ATOM 503 CA TYR A 31 -11.886 11.325 8.734 1.00 0.00 C ATOM 504 C TYR A 31 -11.906 9.913 8.148 1.00 0.00 C ATOM 505 O TYR A 31 -11.292 9.662 7.109 1.00 0.00 O ATOM 506 CB TYR A 31 -12.965 12.163 8.026 1.00 0.00 C ATOM 507 CG TYR A 31 -13.237 13.540 8.603 1.00 0.00 C ATOM 508 CD1 TYR A 31 -12.299 14.577 8.437 1.00 0.00 C ATOM 509 CD2 TYR A 31 -14.456 13.799 9.259 1.00 0.00 C ATOM 510 CE1 TYR A 31 -12.578 15.868 8.923 1.00 0.00 C ATOM 511 CE2 TYR A 31 -14.749 15.094 9.729 1.00 0.00 C ATOM 512 CZ TYR A 31 -13.809 16.135 9.553 1.00 0.00 C ATOM 513 OH TYR A 31 -14.087 17.397 9.974 1.00 0.00 O ATOM 0 H TYR A 31 -10.268 11.983 7.592 1.00 0.00 H new ATOM 0 HA TYR A 31 -12.099 11.289 9.802 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -12.675 12.281 6.982 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -13.897 11.598 8.036 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -11.363 14.381 7.935 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -15.169 13.001 9.402 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -11.847 16.655 8.813 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -15.689 15.291 10.222 1.00 0.00 H new ATOM 0 HH TYR A 31 -14.976 17.416 10.387 1.00 0.00 H new ATOM 523 N SER A 32 -12.618 8.996 8.801 1.00 0.00 N ATOM 524 CA SER A 32 -12.679 7.571 8.441 1.00 0.00 C ATOM 525 C SER A 32 -13.851 6.878 9.151 1.00 0.00 C ATOM 526 O SER A 32 -14.268 7.343 10.209 1.00 0.00 O ATOM 527 CB SER A 32 -11.355 6.931 8.872 1.00 0.00 C ATOM 528 OG SER A 32 -11.321 5.572 8.511 1.00 0.00 O ATOM 0 H SER A 32 -13.185 9.225 9.617 1.00 0.00 H new ATOM 0 HA SER A 32 -12.833 7.463 7.367 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.522 7.457 8.406 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.231 7.029 9.950 1.00 0.00 H new ATOM 0 HG SER A 32 -10.468 5.180 8.792 1.00 0.00 H new ATOM 534 N VAL A 33 -14.403 5.783 8.607 1.00 0.00 N ATOM 535 CA VAL A 33 -15.424 4.986 9.326 1.00 0.00 C ATOM 536 C VAL A 33 -14.804 3.959 10.270 1.00 0.00 C ATOM 537 O VAL A 33 -13.773 3.347 9.979 1.00 0.00 O ATOM 538 CB VAL A 33 -16.428 4.255 8.422 1.00 0.00 C ATOM 539 CG1 VAL A 33 -17.218 5.225 7.555 1.00 0.00 C ATOM 540 CG2 VAL A 33 -15.783 3.205 7.530 1.00 0.00 C ATOM 0 H VAL A 33 -14.166 5.427 7.681 1.00 0.00 H new ATOM 0 HA VAL A 33 -15.971 5.742 9.890 1.00 0.00 H new ATOM 0 HB VAL A 33 -17.103 3.744 9.108 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -17.917 4.669 6.930 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -17.771 5.915 8.192 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -16.533 5.787 6.921 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -16.548 2.727 6.918 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -15.046 3.680 6.883 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -15.292 2.454 8.149 1.00 0.00 H new ATOM 550 N ASP A 34 -15.481 3.730 11.395 1.00 0.00 N ATOM 551 CA ASP A 34 -15.147 2.669 12.350 1.00 0.00 C ATOM 552 C ASP A 34 -15.756 1.311 11.939 1.00 0.00 C ATOM 553 O ASP A 34 -16.507 1.212 10.963 1.00 0.00 O ATOM 554 CB ASP A 34 -15.619 3.089 13.754 1.00 0.00 C ATOM 555 CG ASP A 34 -14.709 2.543 14.864 1.00 0.00 C ATOM 556 OD1 ASP A 34 -13.477 2.756 14.808 1.00 0.00 O ATOM 557 OD2 ASP A 34 -15.222 1.894 15.804 1.00 0.00 O ATOM 0 H ASP A 34 -16.290 4.284 11.675 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.066 2.533 12.357 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -15.649 4.177 13.814 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -16.637 2.733 13.914 1.00 0.00 H new ATOM 562 N ASN A 35 -15.501 0.262 12.729 1.00 0.00 N ATOM 563 CA ASN A 35 -16.086 -1.078 12.535 1.00 0.00 C ATOM 564 C ASN A 35 -17.629 -1.098 12.617 1.00 0.00 C ATOM 565 O ASN A 35 -18.267 -2.017 12.098 1.00 0.00 O ATOM 566 CB ASN A 35 -15.483 -2.055 13.563 1.00 0.00 C ATOM 567 CG ASN A 35 -14.022 -2.370 13.291 1.00 0.00 C ATOM 568 OD1 ASN A 35 -13.115 -1.829 13.910 1.00 0.00 O ATOM 569 ND2 ASN A 35 -13.744 -3.259 12.360 1.00 0.00 N ATOM 0 H ASN A 35 -14.875 0.316 13.533 1.00 0.00 H new ATOM 0 HA ASN A 35 -15.835 -1.389 11.521 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -15.578 -1.628 14.562 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -16.057 -2.982 13.556 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -12.773 -3.496 12.155 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -14.499 -3.710 11.844 1.00 0.00 H new ATOM 576 N ASN A 36 -18.232 -0.077 13.239 1.00 0.00 N ATOM 577 CA ASN A 36 -19.683 0.100 13.363 1.00 0.00 C ATOM 578 C ASN A 36 -20.300 0.924 12.206 1.00 0.00 C ATOM 579 O ASN A 36 -21.509 1.162 12.202 1.00 0.00 O ATOM 580 CB ASN A 36 -19.964 0.745 14.735 1.00 0.00 C ATOM 581 CG ASN A 36 -19.544 -0.146 15.897 1.00 0.00 C ATOM 582 OD1 ASN A 36 -19.975 -1.285 16.029 1.00 0.00 O ATOM 583 ND2 ASN A 36 -18.696 0.337 16.778 1.00 0.00 N ATOM 0 H ASN A 36 -17.704 0.674 13.685 1.00 0.00 H new ATOM 0 HA ASN A 36 -20.163 -0.876 13.295 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -19.435 1.696 14.801 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -21.028 0.966 14.817 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -18.399 -0.236 17.568 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -18.335 1.285 16.672 1.00 0.00 H new ATOM 590 N GLY A 37 -19.493 1.396 11.244 1.00 0.00 N ATOM 591 CA GLY A 37 -19.957 2.210 10.108 1.00 0.00 C ATOM 592 C GLY A 37 -20.239 3.678 10.462 1.00 0.00 C ATOM 593 O GLY A 37 -21.139 4.297 9.888 1.00 0.00 O ATOM 0 H GLY A 37 -18.488 1.222 11.232 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -19.205 2.176 9.319 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -20.865 1.764 9.702 1.00 0.00 H new ATOM 597 N ASN A 38 -19.484 4.232 11.419 1.00 0.00 N ATOM 598 CA ASN A 38 -19.614 5.608 11.919 1.00 0.00 C ATOM 599 C ASN A 38 -18.376 6.416 11.523 1.00 0.00 C ATOM 600 O ASN A 38 -17.264 6.041 11.896 1.00 0.00 O ATOM 601 CB ASN A 38 -19.752 5.592 13.454 1.00 0.00 C ATOM 602 CG ASN A 38 -21.147 5.220 13.920 1.00 0.00 C ATOM 603 OD1 ASN A 38 -21.965 6.067 14.254 1.00 0.00 O ATOM 604 ND2 ASN A 38 -21.466 3.948 13.957 1.00 0.00 N ATOM 0 H ASN A 38 -18.738 3.715 11.884 1.00 0.00 H new ATOM 0 HA ASN A 38 -20.501 6.068 11.483 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -19.035 4.884 13.870 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -19.494 6.575 13.847 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -22.396 3.664 14.264 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -20.784 3.243 13.678 1.00 0.00 H new ATOM 611 N ILE A 39 -18.558 7.514 10.781 1.00 0.00 N ATOM 612 CA ILE A 39 -17.478 8.449 10.448 1.00 0.00 C ATOM 613 C ILE A 39 -16.976 9.113 11.740 1.00 0.00 C ATOM 614 O ILE A 39 -17.696 9.891 12.376 1.00 0.00 O ATOM 615 CB ILE A 39 -17.921 9.491 9.396 1.00 0.00 C ATOM 616 CG1 ILE A 39 -18.449 8.806 8.113 1.00 0.00 C ATOM 617 CG2 ILE A 39 -16.727 10.404 9.047 1.00 0.00 C ATOM 618 CD1 ILE A 39 -19.083 9.784 7.120 1.00 0.00 C ATOM 0 H ILE A 39 -19.463 7.780 10.393 1.00 0.00 H new ATOM 0 HA ILE A 39 -16.657 7.896 9.992 1.00 0.00 H new ATOM 0 HB ILE A 39 -18.732 10.084 9.819 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -17.627 8.284 7.623 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -19.185 8.051 8.389 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -17.037 11.140 8.305 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -16.386 10.917 9.946 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -15.914 9.801 8.643 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -19.432 9.238 6.244 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -19.926 10.288 7.593 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -18.343 10.524 6.815 1.00 0.00 H new ATOM 630 N TYR A 40 -15.736 8.809 12.112 1.00 0.00 N ATOM 631 CA TYR A 40 -14.998 9.409 13.229 1.00 0.00 C ATOM 632 C TYR A 40 -13.756 10.161 12.714 1.00 0.00 C ATOM 633 O TYR A 40 -13.474 10.166 11.511 1.00 0.00 O ATOM 634 CB TYR A 40 -14.637 8.320 14.261 1.00 0.00 C ATOM 635 CG TYR A 40 -13.509 7.388 13.842 1.00 0.00 C ATOM 636 CD1 TYR A 40 -13.784 6.233 13.086 1.00 0.00 C ATOM 637 CD2 TYR A 40 -12.177 7.682 14.198 1.00 0.00 C ATOM 638 CE1 TYR A 40 -12.735 5.407 12.643 1.00 0.00 C ATOM 639 CE2 TYR A 40 -11.127 6.865 13.739 1.00 0.00 C ATOM 640 CZ TYR A 40 -11.401 5.737 12.941 1.00 0.00 C ATOM 641 OH TYR A 40 -10.373 4.980 12.479 1.00 0.00 O ATOM 0 H TYR A 40 -15.188 8.103 11.621 1.00 0.00 H new ATOM 0 HA TYR A 40 -15.628 10.144 13.730 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.359 8.805 15.197 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.526 7.723 14.463 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.806 5.980 12.845 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.962 8.535 14.824 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.955 4.517 12.072 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -10.107 7.104 14.000 1.00 0.00 H new ATOM 0 HH TYR A 40 -10.697 4.078 12.276 1.00 0.00 H new ATOM 651 N THR A 41 -13.001 10.792 13.621 1.00 0.00 N ATOM 652 CA THR A 41 -11.782 11.554 13.289 1.00 0.00 C ATOM 653 C THR A 41 -10.569 11.139 14.123 1.00 0.00 C ATOM 654 O THR A 41 -10.702 10.854 15.315 1.00 0.00 O ATOM 655 CB THR A 41 -12.008 13.072 13.417 1.00 0.00 C ATOM 656 OG1 THR A 41 -12.643 13.420 14.635 1.00 0.00 O ATOM 657 CG2 THR A 41 -12.873 13.608 12.278 1.00 0.00 C ATOM 0 H THR A 41 -13.218 10.790 14.618 1.00 0.00 H new ATOM 0 HA THR A 41 -11.563 11.313 12.249 1.00 0.00 H new ATOM 0 HB THR A 41 -11.014 13.518 13.382 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.765 14.392 14.674 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.012 14.682 12.401 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.382 13.412 11.325 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.844 13.113 12.294 1.00 0.00 H new ATOM 665 N GLN A 42 -9.379 11.134 13.508 1.00 0.00 N ATOM 666 CA GLN A 42 -8.118 10.699 14.140 1.00 0.00 C ATOM 667 C GLN A 42 -6.889 11.508 13.685 1.00 0.00 C ATOM 668 O GLN A 42 -6.842 11.927 12.527 1.00 0.00 O ATOM 669 CB GLN A 42 -7.881 9.206 13.858 1.00 0.00 C ATOM 670 CG GLN A 42 -7.719 8.830 12.368 1.00 0.00 C ATOM 671 CD GLN A 42 -7.431 7.341 12.157 1.00 0.00 C ATOM 672 OE1 GLN A 42 -6.984 6.625 13.044 1.00 0.00 O ATOM 673 NE2 GLN A 42 -7.656 6.818 10.969 1.00 0.00 N ATOM 0 H GLN A 42 -9.259 11.436 12.541 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.233 10.877 15.209 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.986 8.890 14.394 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -8.716 8.639 14.269 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -8.628 9.099 11.830 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -6.908 9.416 11.937 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -8.028 7.399 10.218 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -7.458 5.832 10.800 1.00 0.00 H new ATOM 682 N PRO A 43 -5.885 11.724 14.556 1.00 0.00 N ATOM 683 CA PRO A 43 -4.652 12.421 14.196 1.00 0.00 C ATOM 684 C PRO A 43 -3.740 11.568 13.299 1.00 0.00 C ATOM 685 O PRO A 43 -3.706 10.337 13.400 1.00 0.00 O ATOM 686 CB PRO A 43 -3.972 12.750 15.528 1.00 0.00 C ATOM 687 CG PRO A 43 -4.443 11.632 16.455 1.00 0.00 C ATOM 688 CD PRO A 43 -5.858 11.341 15.963 1.00 0.00 C ATOM 0 HA PRO A 43 -4.864 13.317 13.612 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -2.886 12.761 15.432 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.269 13.731 15.899 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -3.803 10.753 16.382 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -4.437 11.945 17.499 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.103 10.286 16.084 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -6.593 11.907 16.535 1.00 0.00 H new ATOM 696 N VAL A 44 -2.963 12.233 12.441 1.00 0.00 N ATOM 697 CA VAL A 44 -1.868 11.621 11.673 1.00 0.00 C ATOM 698 C VAL A 44 -0.777 11.075 12.615 1.00 0.00 C ATOM 699 O VAL A 44 -0.522 11.651 13.677 1.00 0.00 O ATOM 700 CB VAL A 44 -1.304 12.627 10.650 1.00 0.00 C ATOM 701 CG1 VAL A 44 -0.564 13.808 11.285 1.00 0.00 C ATOM 702 CG2 VAL A 44 -0.368 11.953 9.645 1.00 0.00 C ATOM 0 H VAL A 44 -3.076 13.229 12.255 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.260 10.771 11.114 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.186 13.016 10.141 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.197 14.471 10.502 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.245 14.357 11.935 1.00 0.00 H new ATOM 0 HG13 VAL A 44 0.277 13.438 11.871 1.00 0.00 H new ATOM 0 HG21 VAL A 44 0.007 12.697 8.942 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.469 11.500 10.175 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.913 11.182 9.101 1.00 0.00 H new ATOM 712 N ALA A 45 -0.114 9.982 12.225 1.00 0.00 N ATOM 713 CA ALA A 45 0.969 9.360 12.995 1.00 0.00 C ATOM 714 C ALA A 45 2.336 9.509 12.294 1.00 0.00 C ATOM 715 O ALA A 45 3.316 9.901 12.935 1.00 0.00 O ATOM 716 CB ALA A 45 0.599 7.890 13.244 1.00 0.00 C ATOM 0 H ALA A 45 -0.318 9.496 11.351 1.00 0.00 H new ATOM 0 HA ALA A 45 1.078 9.871 13.952 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.391 7.407 13.816 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.335 7.840 13.804 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.477 7.379 12.289 1.00 0.00 H new ATOM 722 N GLN A 46 2.391 9.268 10.978 1.00 0.00 N ATOM 723 CA GLN A 46 3.577 9.431 10.123 1.00 0.00 C ATOM 724 C GLN A 46 3.199 9.980 8.731 1.00 0.00 C ATOM 725 O GLN A 46 2.021 10.148 8.410 1.00 0.00 O ATOM 726 CB GLN A 46 4.319 8.086 9.962 1.00 0.00 C ATOM 727 CG GLN A 46 4.952 7.502 11.236 1.00 0.00 C ATOM 728 CD GLN A 46 4.015 6.664 12.110 1.00 0.00 C ATOM 729 OE1 GLN A 46 3.897 6.861 13.312 1.00 0.00 O ATOM 730 NE2 GLN A 46 3.346 5.668 11.566 1.00 0.00 N ATOM 0 H GLN A 46 1.578 8.941 10.457 1.00 0.00 H new ATOM 0 HA GLN A 46 4.233 10.151 10.612 1.00 0.00 H new ATOM 0 HB2 GLN A 46 3.618 7.354 9.562 1.00 0.00 H new ATOM 0 HB3 GLN A 46 5.105 8.215 9.218 1.00 0.00 H new ATOM 0 HG2 GLN A 46 5.802 6.884 10.948 1.00 0.00 H new ATOM 0 HG3 GLN A 46 5.343 8.323 11.836 1.00 0.00 H new ATOM 0 HE21 GLN A 46 3.428 5.484 10.566 1.00 0.00 H new ATOM 0 HE22 GLN A 46 2.746 5.081 12.145 1.00 0.00 H new ATOM 739 N TRP A 47 4.198 10.207 7.875 1.00 0.00 N ATOM 740 CA TRP A 47 4.043 10.703 6.504 1.00 0.00 C ATOM 741 C TRP A 47 4.982 9.921 5.572 1.00 0.00 C ATOM 742 O TRP A 47 6.201 9.937 5.775 1.00 0.00 O ATOM 743 CB TRP A 47 4.368 12.206 6.478 1.00 0.00 C ATOM 744 CG TRP A 47 3.547 13.078 7.383 1.00 0.00 C ATOM 745 CD1 TRP A 47 2.440 13.778 7.041 1.00 0.00 C ATOM 746 CD2 TRP A 47 3.771 13.360 8.799 1.00 0.00 C ATOM 747 NE1 TRP A 47 1.968 14.476 8.135 1.00 0.00 N ATOM 748 CE2 TRP A 47 2.745 14.243 9.249 1.00 0.00 C ATOM 749 CE3 TRP A 47 4.744 12.965 9.744 1.00 0.00 C ATOM 750 CZ2 TRP A 47 2.687 14.701 10.568 1.00 0.00 C ATOM 751 CZ3 TRP A 47 4.680 13.408 11.080 1.00 0.00 C ATOM 752 CH2 TRP A 47 3.649 14.271 11.493 1.00 0.00 C ATOM 0 H TRP A 47 5.173 10.045 8.126 1.00 0.00 H new ATOM 0 HA TRP A 47 3.019 10.559 6.160 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.418 12.334 6.740 1.00 0.00 H new ATOM 0 HB3 TRP A 47 4.248 12.565 5.456 1.00 0.00 H new ATOM 0 HD1 TRP A 47 1.992 13.789 6.058 1.00 0.00 H new ATOM 0 HE1 TRP A 47 1.150 15.085 8.120 1.00 0.00 H new ATOM 0 HE3 TRP A 47 5.549 12.314 9.438 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 1.906 15.382 10.873 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 5.426 13.083 11.790 1.00 0.00 H new ATOM 0 HH2 TRP A 47 3.598 14.602 12.520 1.00 0.00 H new ATOM 763 N HIS A 48 4.434 9.239 4.560 1.00 0.00 N ATOM 764 CA HIS A 48 5.198 8.393 3.633 1.00 0.00 C ATOM 765 C HIS A 48 5.077 8.905 2.184 1.00 0.00 C ATOM 766 O HIS A 48 4.008 9.309 1.719 1.00 0.00 O ATOM 767 CB HIS A 48 4.761 6.921 3.743 1.00 0.00 C ATOM 768 CG HIS A 48 4.609 6.390 5.151 1.00 0.00 C ATOM 769 ND1 HIS A 48 5.625 6.037 6.014 1.00 0.00 N ATOM 770 CD2 HIS A 48 3.428 6.125 5.795 1.00 0.00 C ATOM 771 CE1 HIS A 48 5.073 5.570 7.147 1.00 0.00 C ATOM 772 NE2 HIS A 48 3.730 5.607 7.064 1.00 0.00 N ATOM 0 H HIS A 48 3.434 9.259 4.358 1.00 0.00 H new ATOM 0 HA HIS A 48 6.249 8.450 3.916 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.810 6.803 3.224 1.00 0.00 H new ATOM 0 HB3 HIS A 48 5.489 6.304 3.217 1.00 0.00 H new ATOM 0 HD1 HIS A 48 6.624 6.117 5.825 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.438 6.287 5.395 1.00 0.00 H new ATOM 0 HE1 HIS A 48 5.628 5.215 8.003 1.00 0.00 H new ATOM 780 N ASP A 49 6.198 8.882 1.465 1.00 0.00 N ATOM 781 CA ASP A 49 6.376 9.466 0.132 1.00 0.00 C ATOM 782 C ASP A 49 7.045 8.450 -0.802 1.00 0.00 C ATOM 783 O ASP A 49 8.183 8.018 -0.579 1.00 0.00 O ATOM 784 CB ASP A 49 7.204 10.757 0.260 1.00 0.00 C ATOM 785 CG ASP A 49 7.688 11.343 -1.082 1.00 0.00 C ATOM 786 OD1 ASP A 49 7.009 11.179 -2.123 1.00 0.00 O ATOM 787 OD2 ASP A 49 8.767 11.986 -1.087 1.00 0.00 O ATOM 0 H ASP A 49 7.048 8.435 1.810 1.00 0.00 H new ATOM 0 HA ASP A 49 5.409 9.718 -0.303 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.605 11.508 0.775 1.00 0.00 H new ATOM 0 HB3 ASP A 49 8.072 10.556 0.888 1.00 0.00 H new ATOM 792 N ARG A 50 6.303 8.044 -1.836 1.00 0.00 N ATOM 793 CA ARG A 50 6.712 7.029 -2.822 1.00 0.00 C ATOM 794 C ARG A 50 7.653 7.581 -3.895 1.00 0.00 C ATOM 795 O ARG A 50 8.500 6.851 -4.414 1.00 0.00 O ATOM 796 CB ARG A 50 5.460 6.487 -3.504 1.00 0.00 C ATOM 797 CG ARG A 50 4.417 5.894 -2.538 1.00 0.00 C ATOM 798 CD ARG A 50 4.936 4.734 -1.679 1.00 0.00 C ATOM 799 NE ARG A 50 5.457 3.625 -2.510 1.00 0.00 N ATOM 800 CZ ARG A 50 5.864 2.440 -2.097 1.00 0.00 C ATOM 801 NH1 ARG A 50 5.820 2.084 -0.847 1.00 0.00 N ATOM 802 NH2 ARG A 50 6.319 1.587 -2.967 1.00 0.00 N ATOM 0 H ARG A 50 5.373 8.421 -2.019 1.00 0.00 H new ATOM 0 HA ARG A 50 7.254 6.251 -2.285 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.994 7.291 -4.074 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.754 5.718 -4.219 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.058 6.685 -1.880 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.560 5.547 -3.116 1.00 0.00 H new ATOM 0 HD2 ARG A 50 5.725 5.095 -1.019 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.132 4.365 -1.043 1.00 0.00 H new ATOM 0 HE ARG A 50 5.507 3.796 -3.514 1.00 0.00 H new ATOM 0 HH11 ARG A 50 5.461 2.731 -0.145 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.145 1.158 -0.569 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.358 1.838 -3.955 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.637 0.667 -2.661 1.00 0.00 H new ATOM 816 N GLY A 51 7.480 8.854 -4.240 1.00 0.00 N ATOM 817 CA GLY A 51 8.330 9.614 -5.152 1.00 0.00 C ATOM 818 C GLY A 51 7.822 9.688 -6.594 1.00 0.00 C ATOM 819 O GLY A 51 7.682 10.791 -7.111 1.00 0.00 O ATOM 0 H GLY A 51 6.707 9.410 -3.874 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.436 10.628 -4.767 1.00 0.00 H new ATOM 0 HA3 GLY A 51 9.325 9.169 -5.155 1.00 0.00 H new ATOM 823 N GLU A 52 7.523 8.552 -7.242 1.00 0.00 N ATOM 824 CA GLU A 52 7.176 8.463 -8.681 1.00 0.00 C ATOM 825 C GLU A 52 6.674 7.055 -9.057 1.00 0.00 C ATOM 826 O GLU A 52 7.467 6.135 -9.280 1.00 0.00 O ATOM 827 CB GLU A 52 8.380 8.764 -9.602 1.00 0.00 C ATOM 828 CG GLU A 52 8.677 10.241 -9.892 1.00 0.00 C ATOM 829 CD GLU A 52 9.614 10.404 -11.106 1.00 0.00 C ATOM 830 OE1 GLU A 52 9.175 10.210 -12.266 1.00 0.00 O ATOM 831 OE2 GLU A 52 10.808 10.739 -10.912 1.00 0.00 O ATOM 0 H GLU A 52 7.514 7.645 -6.775 1.00 0.00 H new ATOM 0 HA GLU A 52 6.396 9.210 -8.829 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.269 8.320 -9.154 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.215 8.258 -10.553 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.743 10.771 -10.079 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.134 10.700 -9.015 1.00 0.00 H new ATOM 838 N GLN A 53 5.352 6.882 -9.148 1.00 0.00 N ATOM 839 CA GLN A 53 4.702 5.631 -9.575 1.00 0.00 C ATOM 840 C GLN A 53 3.566 5.856 -10.597 1.00 0.00 C ATOM 841 O GLN A 53 3.144 6.984 -10.838 1.00 0.00 O ATOM 842 CB GLN A 53 4.183 4.915 -8.323 1.00 0.00 C ATOM 843 CG GLN A 53 5.300 4.714 -7.284 1.00 0.00 C ATOM 844 CD GLN A 53 4.863 3.983 -6.036 1.00 0.00 C ATOM 845 OE1 GLN A 53 5.581 3.183 -5.452 1.00 0.00 O ATOM 846 NE2 GLN A 53 3.739 4.353 -5.475 1.00 0.00 N ATOM 0 H GLN A 53 4.686 7.621 -8.923 1.00 0.00 H new ATOM 0 HA GLN A 53 5.439 5.017 -10.093 1.00 0.00 H new ATOM 0 HB2 GLN A 53 3.373 5.495 -7.880 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.766 3.947 -8.602 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.117 4.161 -7.748 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.696 5.689 -7.000 1.00 0.00 H new ATOM 0 HE21 GLN A 53 3.128 5.019 -5.948 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.474 3.975 -4.565 1.00 0.00 H new ATOM 855 N GLU A 54 3.090 4.775 -11.220 1.00 0.00 N ATOM 856 CA GLU A 54 2.101 4.766 -12.314 1.00 0.00 C ATOM 857 C GLU A 54 0.685 5.226 -11.895 1.00 0.00 C ATOM 858 O GLU A 54 -0.106 4.446 -11.357 1.00 0.00 O ATOM 859 CB GLU A 54 2.114 3.379 -12.992 1.00 0.00 C ATOM 860 CG GLU A 54 1.784 2.170 -12.095 1.00 0.00 C ATOM 861 CD GLU A 54 2.419 0.887 -12.660 1.00 0.00 C ATOM 862 OE1 GLU A 54 1.839 0.266 -13.585 1.00 0.00 O ATOM 863 OE2 GLU A 54 3.515 0.493 -12.191 1.00 0.00 O ATOM 0 H GLU A 54 3.395 3.835 -10.967 1.00 0.00 H new ATOM 0 HA GLU A 54 2.401 5.520 -13.041 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.401 3.396 -13.817 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.101 3.221 -13.427 1.00 0.00 H new ATOM 0 HG2 GLU A 54 2.151 2.349 -11.084 1.00 0.00 H new ATOM 0 HG3 GLU A 54 0.703 2.047 -12.025 1.00 0.00 H new ATOM 870 N VAL A 55 0.354 6.499 -12.142 1.00 0.00 N ATOM 871 CA VAL A 55 -0.938 7.125 -11.796 1.00 0.00 C ATOM 872 C VAL A 55 -1.918 7.066 -12.969 1.00 0.00 C ATOM 873 O VAL A 55 -1.573 7.360 -14.117 1.00 0.00 O ATOM 874 CB VAL A 55 -0.759 8.596 -11.357 1.00 0.00 C ATOM 875 CG1 VAL A 55 -2.065 9.229 -10.857 1.00 0.00 C ATOM 876 CG2 VAL A 55 0.228 8.698 -10.195 1.00 0.00 C ATOM 0 H VAL A 55 0.994 7.146 -12.602 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.346 6.555 -10.961 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.404 9.119 -12.245 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.879 10.262 -10.562 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.808 9.207 -11.654 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.436 8.668 -9.999 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.339 9.742 -9.902 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.146 8.122 -9.349 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.196 8.303 -10.504 1.00 0.00 H new ATOM 886 N PHE A 56 -3.178 6.771 -12.652 1.00 0.00 N ATOM 887 CA PHE A 56 -4.290 6.766 -13.605 1.00 0.00 C ATOM 888 C PHE A 56 -5.360 7.784 -13.186 1.00 0.00 C ATOM 889 O PHE A 56 -5.579 8.046 -12.002 1.00 0.00 O ATOM 890 CB PHE A 56 -4.867 5.353 -13.738 1.00 0.00 C ATOM 891 CG PHE A 56 -3.959 4.341 -14.417 1.00 0.00 C ATOM 892 CD1 PHE A 56 -2.828 3.834 -13.746 1.00 0.00 C ATOM 893 CD2 PHE A 56 -4.247 3.899 -15.721 1.00 0.00 C ATOM 894 CE1 PHE A 56 -1.972 2.923 -14.388 1.00 0.00 C ATOM 895 CE2 PHE A 56 -3.423 2.939 -16.341 1.00 0.00 C ATOM 896 CZ PHE A 56 -2.278 2.461 -15.680 1.00 0.00 C ATOM 0 H PHE A 56 -3.462 6.523 -11.704 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.922 7.066 -14.586 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -5.114 4.984 -12.742 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -5.801 5.411 -14.297 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -2.618 4.147 -12.734 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -5.102 4.296 -16.248 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -1.079 2.578 -13.889 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -3.671 2.570 -17.325 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.635 1.741 -16.164 1.00 0.00 H new ATOM 906 N GLU A 57 -6.018 8.375 -14.181 1.00 0.00 N ATOM 907 CA GLU A 57 -7.206 9.209 -14.010 1.00 0.00 C ATOM 908 C GLU A 57 -8.442 8.316 -13.897 1.00 0.00 C ATOM 909 O GLU A 57 -8.719 7.541 -14.815 1.00 0.00 O ATOM 910 CB GLU A 57 -7.335 10.132 -15.231 1.00 0.00 C ATOM 911 CG GLU A 57 -8.475 11.145 -15.107 1.00 0.00 C ATOM 912 CD GLU A 57 -8.356 12.209 -16.213 1.00 0.00 C ATOM 913 OE1 GLU A 57 -7.609 13.198 -16.010 1.00 0.00 O ATOM 914 OE2 GLU A 57 -8.997 12.066 -17.281 1.00 0.00 O ATOM 0 H GLU A 57 -5.732 8.285 -15.156 1.00 0.00 H new ATOM 0 HA GLU A 57 -7.120 9.808 -13.103 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.396 10.668 -15.374 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -7.494 9.524 -16.122 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -9.435 10.635 -15.183 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -8.444 11.622 -14.127 1.00 0.00 H new ATOM 921 N TYR A 58 -9.207 8.455 -12.815 1.00 0.00 N ATOM 922 CA TYR A 58 -10.481 7.774 -12.613 1.00 0.00 C ATOM 923 C TYR A 58 -11.604 8.817 -12.627 1.00 0.00 C ATOM 924 O TYR A 58 -11.764 9.597 -11.682 1.00 0.00 O ATOM 925 CB TYR A 58 -10.451 6.972 -11.304 1.00 0.00 C ATOM 926 CG TYR A 58 -9.163 6.207 -11.062 1.00 0.00 C ATOM 927 CD1 TYR A 58 -8.868 5.037 -11.791 1.00 0.00 C ATOM 928 CD2 TYR A 58 -8.249 6.697 -10.110 1.00 0.00 C ATOM 929 CE1 TYR A 58 -7.653 4.358 -11.562 1.00 0.00 C ATOM 930 CE2 TYR A 58 -7.034 6.028 -9.898 1.00 0.00 C ATOM 931 CZ TYR A 58 -6.728 4.866 -10.629 1.00 0.00 C ATOM 932 OH TYR A 58 -5.528 4.255 -10.442 1.00 0.00 O ATOM 0 H TYR A 58 -8.949 9.061 -12.036 1.00 0.00 H new ATOM 0 HA TYR A 58 -10.664 7.061 -13.417 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -10.615 7.655 -10.471 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -11.282 6.267 -11.306 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -9.569 4.662 -12.522 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -8.483 7.586 -9.544 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -7.432 3.449 -12.102 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -6.331 6.407 -9.171 1.00 0.00 H new ATOM 0 HH TYR A 58 -4.878 4.906 -10.104 1.00 0.00 H new ATOM 942 N CYS A 59 -12.360 8.863 -13.724 1.00 0.00 N ATOM 943 CA CYS A 59 -13.511 9.749 -13.865 1.00 0.00 C ATOM 944 C CYS A 59 -14.790 8.978 -13.512 1.00 0.00 C ATOM 945 O CYS A 59 -15.073 7.931 -14.101 1.00 0.00 O ATOM 946 CB CYS A 59 -13.526 10.305 -15.294 1.00 0.00 C ATOM 947 SG CYS A 59 -14.745 11.648 -15.407 1.00 0.00 S ATOM 0 H CYS A 59 -12.188 8.282 -14.544 1.00 0.00 H new ATOM 0 HA CYS A 59 -13.449 10.595 -13.180 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -12.536 10.674 -15.563 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -13.774 9.514 -16.001 1.00 0.00 H new ATOM 0 HG CYS A 59 -15.858 11.272 -14.850 1.00 0.00 H new ATOM 953 N LEU A 60 -15.547 9.466 -12.527 1.00 0.00 N ATOM 954 CA LEU A 60 -16.866 8.931 -12.173 1.00 0.00 C ATOM 955 C LEU A 60 -17.940 9.442 -13.144 1.00 0.00 C ATOM 956 O LEU A 60 -17.807 10.504 -13.754 1.00 0.00 O ATOM 957 CB LEU A 60 -17.199 9.320 -10.714 1.00 0.00 C ATOM 958 CG LEU A 60 -17.155 8.166 -9.691 1.00 0.00 C ATOM 959 CD1 LEU A 60 -15.880 7.322 -9.712 1.00 0.00 C ATOM 960 CD2 LEU A 60 -17.275 8.713 -8.267 1.00 0.00 C ATOM 0 H LEU A 60 -15.259 10.253 -11.945 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.848 7.844 -12.253 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -16.500 10.092 -10.394 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -18.195 9.763 -10.693 1.00 0.00 H new ATOM 0 HG LEU A 60 -17.991 7.530 -9.983 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -15.949 6.539 -8.957 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.761 6.868 -10.696 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -15.020 7.957 -9.499 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -17.242 7.887 -7.556 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -16.449 9.395 -8.069 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -18.220 9.246 -8.161 1.00 0.00 H new ATOM 972 N GLU A 61 -19.043 8.697 -13.250 1.00 0.00 N ATOM 973 CA GLU A 61 -20.137 9.015 -14.193 1.00 0.00 C ATOM 974 C GLU A 61 -20.903 10.308 -13.843 1.00 0.00 C ATOM 975 O GLU A 61 -21.569 10.889 -14.705 1.00 0.00 O ATOM 976 CB GLU A 61 -21.112 7.832 -14.347 1.00 0.00 C ATOM 977 CG GLU A 61 -21.727 7.350 -13.033 1.00 0.00 C ATOM 978 CD GLU A 61 -23.105 6.702 -13.276 1.00 0.00 C ATOM 979 OE1 GLU A 61 -24.126 7.432 -13.302 1.00 0.00 O ATOM 980 OE2 GLU A 61 -23.176 5.462 -13.451 1.00 0.00 O ATOM 0 H GLU A 61 -19.210 7.860 -12.692 1.00 0.00 H new ATOM 0 HA GLU A 61 -19.649 9.197 -15.151 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -21.914 8.123 -15.025 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -20.585 7.000 -14.815 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -21.061 6.630 -12.557 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -21.832 8.190 -12.346 1.00 0.00 H new ATOM 987 N ASP A 62 -20.792 10.786 -12.596 1.00 0.00 N ATOM 988 CA ASP A 62 -21.376 12.065 -12.160 1.00 0.00 C ATOM 989 C ASP A 62 -20.551 13.286 -12.620 1.00 0.00 C ATOM 990 O ASP A 62 -21.097 14.381 -12.792 1.00 0.00 O ATOM 991 CB ASP A 62 -21.502 12.049 -10.631 1.00 0.00 C ATOM 992 CG ASP A 62 -22.175 13.320 -10.086 1.00 0.00 C ATOM 993 OD1 ASP A 62 -23.406 13.481 -10.270 1.00 0.00 O ATOM 994 OD2 ASP A 62 -21.481 14.150 -9.449 1.00 0.00 O ATOM 0 H ASP A 62 -20.292 10.294 -11.856 1.00 0.00 H new ATOM 0 HA ASP A 62 -22.357 12.167 -12.625 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -22.079 11.176 -10.326 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.511 11.947 -10.188 1.00 0.00 H new ATOM 999 N GLY A 63 -19.243 13.097 -12.837 1.00 0.00 N ATOM 1000 CA GLY A 63 -18.294 14.130 -13.281 1.00 0.00 C ATOM 1001 C GLY A 63 -17.069 14.297 -12.368 1.00 0.00 C ATOM 1002 O GLY A 63 -16.106 14.964 -12.755 1.00 0.00 O ATOM 0 H GLY A 63 -18.799 12.188 -12.704 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -17.952 13.885 -14.287 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -18.817 15.084 -13.346 1.00 0.00 H new ATOM 1006 N SER A 64 -17.092 13.706 -11.165 1.00 0.00 N ATOM 1007 CA SER A 64 -15.968 13.712 -10.213 1.00 0.00 C ATOM 1008 C SER A 64 -14.705 13.058 -10.794 1.00 0.00 C ATOM 1009 O SER A 64 -14.780 12.097 -11.564 1.00 0.00 O ATOM 1010 CB SER A 64 -16.367 12.995 -8.916 1.00 0.00 C ATOM 1011 OG SER A 64 -17.359 13.742 -8.232 1.00 0.00 O ATOM 0 H SER A 64 -17.907 13.200 -10.818 1.00 0.00 H new ATOM 0 HA SER A 64 -15.734 14.756 -10.004 1.00 0.00 H new ATOM 0 HB2 SER A 64 -16.744 11.998 -9.144 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.492 12.867 -8.278 1.00 0.00 H new ATOM 0 HG SER A 64 -17.608 13.276 -7.407 1.00 0.00 H new ATOM 1017 N LEU A 65 -13.536 13.547 -10.372 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.215 13.107 -10.830 1.00 0.00 C ATOM 1019 C LEU A 65 -11.317 12.753 -9.637 1.00 0.00 C ATOM 1020 O LEU A 65 -11.240 13.503 -8.661 1.00 0.00 O ATOM 1021 CB LEU A 65 -11.561 14.239 -11.648 1.00 0.00 C ATOM 1022 CG LEU A 65 -12.063 14.390 -13.094 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.545 15.708 -13.672 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -11.546 13.256 -13.981 1.00 0.00 C ATOM 0 H LEU A 65 -13.481 14.289 -9.675 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.335 12.218 -11.449 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.724 15.182 -11.125 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.484 14.070 -11.672 1.00 0.00 H new ATOM 0 HG LEU A 65 -13.153 14.366 -13.075 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -11.898 15.820 -14.697 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.912 16.539 -13.069 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.455 15.706 -13.662 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.918 13.390 -14.997 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.456 13.268 -13.989 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -11.895 12.300 -13.590 1.00 0.00 H new ATOM 1036 N ILE A 66 -10.612 11.625 -9.751 1.00 0.00 N ATOM 1037 CA ILE A 66 -9.716 11.064 -8.728 1.00 0.00 C ATOM 1038 C ILE A 66 -8.421 10.607 -9.425 1.00 0.00 C ATOM 1039 O ILE A 66 -8.465 10.103 -10.551 1.00 0.00 O ATOM 1040 CB ILE A 66 -10.418 9.897 -7.973 1.00 0.00 C ATOM 1041 CG1 ILE A 66 -11.837 10.281 -7.472 1.00 0.00 C ATOM 1042 CG2 ILE A 66 -9.546 9.425 -6.792 1.00 0.00 C ATOM 1043 CD1 ILE A 66 -12.617 9.160 -6.772 1.00 0.00 C ATOM 0 H ILE A 66 -10.649 11.051 -10.593 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.468 11.816 -7.978 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.539 9.081 -8.686 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -11.745 11.121 -6.783 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -12.422 10.630 -8.323 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.048 8.609 -6.272 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.583 9.079 -7.167 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.390 10.253 -6.101 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -13.593 9.534 -6.463 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -12.750 8.325 -7.460 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -12.063 8.824 -5.896 1.00 0.00 H new ATOM 1055 N ARG A 67 -7.263 10.782 -8.769 1.00 0.00 N ATOM 1056 CA ARG A 67 -5.930 10.442 -9.307 1.00 0.00 C ATOM 1057 C ARG A 67 -5.089 9.688 -8.277 1.00 0.00 C ATOM 1058 O ARG A 67 -4.665 10.249 -7.268 1.00 0.00 O ATOM 1059 CB ARG A 67 -5.211 11.715 -9.796 1.00 0.00 C ATOM 1060 CG ARG A 67 -5.936 12.340 -10.996 1.00 0.00 C ATOM 1061 CD ARG A 67 -5.141 13.491 -11.619 1.00 0.00 C ATOM 1062 NE ARG A 67 -5.802 13.955 -12.857 1.00 0.00 N ATOM 1063 CZ ARG A 67 -6.599 14.999 -12.990 1.00 0.00 C ATOM 1064 NH1 ARG A 67 -6.705 15.927 -12.086 1.00 0.00 N ATOM 1065 NH2 ARG A 67 -7.325 15.135 -14.060 1.00 0.00 N ATOM 0 H ARG A 67 -7.223 11.173 -7.828 1.00 0.00 H new ATOM 0 HA ARG A 67 -6.065 9.776 -10.160 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -5.157 12.440 -8.983 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.186 11.472 -10.074 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -6.113 11.573 -11.750 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -6.912 12.706 -10.678 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.062 14.315 -10.909 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -4.125 13.163 -11.841 1.00 0.00 H new ATOM 0 HE ARG A 67 -5.623 13.409 -13.700 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -6.158 15.867 -11.227 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.335 16.715 -12.235 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -7.280 14.434 -14.800 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -7.940 15.943 -14.160 1.00 0.00 H new ATOM 1079 N ALA A 68 -4.846 8.409 -8.539 1.00 0.00 N ATOM 1080 CA ALA A 68 -4.080 7.511 -7.669 1.00 0.00 C ATOM 1081 C ALA A 68 -3.382 6.428 -8.496 1.00 0.00 C ATOM 1082 O ALA A 68 -3.719 6.203 -9.662 1.00 0.00 O ATOM 1083 CB ALA A 68 -5.018 6.874 -6.626 1.00 0.00 C ATOM 0 H ALA A 68 -5.184 7.951 -9.385 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.314 8.088 -7.151 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.446 6.207 -5.981 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.477 7.657 -6.022 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.796 6.306 -7.135 1.00 0.00 H new ATOM 1089 N THR A 69 -2.438 5.711 -7.894 1.00 0.00 N ATOM 1090 CA THR A 69 -1.870 4.515 -8.524 1.00 0.00 C ATOM 1091 C THR A 69 -2.875 3.381 -8.565 1.00 0.00 C ATOM 1092 O THR A 69 -3.659 3.214 -7.629 1.00 0.00 O ATOM 1093 CB THR A 69 -0.645 3.998 -7.778 1.00 0.00 C ATOM 1094 OG1 THR A 69 -0.954 3.856 -6.411 1.00 0.00 O ATOM 1095 CG2 THR A 69 0.513 4.968 -7.906 1.00 0.00 C ATOM 0 H THR A 69 -2.050 5.932 -6.977 1.00 0.00 H new ATOM 0 HA THR A 69 -1.591 4.822 -9.532 1.00 0.00 H new ATOM 0 HB THR A 69 -0.362 3.039 -8.211 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.301 2.955 -6.246 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.376 4.578 -7.366 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.769 5.092 -8.958 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.228 5.933 -7.486 1.00 0.00 H new ATOM 1103 N LYS A 70 -2.759 2.524 -9.581 1.00 0.00 N ATOM 1104 CA LYS A 70 -3.635 1.350 -9.743 1.00 0.00 C ATOM 1105 C LYS A 70 -3.554 0.341 -8.580 1.00 0.00 C ATOM 1106 O LYS A 70 -4.466 -0.458 -8.378 1.00 0.00 O ATOM 1107 CB LYS A 70 -3.375 0.707 -11.109 1.00 0.00 C ATOM 1108 CG LYS A 70 -2.164 -0.237 -11.072 1.00 0.00 C ATOM 1109 CD LYS A 70 -1.486 -0.334 -12.435 1.00 0.00 C ATOM 1110 CE LYS A 70 -2.227 -1.194 -13.464 1.00 0.00 C ATOM 1111 NZ LYS A 70 -1.956 -2.645 -13.275 1.00 0.00 N ATOM 0 H LYS A 70 -2.058 2.619 -10.316 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.667 1.701 -9.708 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.259 0.153 -11.424 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -3.206 1.487 -11.852 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -1.447 0.119 -10.333 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.485 -1.229 -10.753 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -1.370 0.672 -12.839 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -0.484 -0.740 -12.298 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.299 -1.012 -13.385 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -1.927 -0.897 -14.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.598 -3.050 -14.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.245 -2.771 -12.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.835 -3.130 -13.003 1.00 0.00 H new ATOM 1125 N ASP A 71 -2.450 0.394 -7.824 1.00 0.00 N ATOM 1126 CA ASP A 71 -2.105 -0.491 -6.707 1.00 0.00 C ATOM 1127 C ASP A 71 -2.712 -0.024 -5.374 1.00 0.00 C ATOM 1128 O ASP A 71 -2.748 -0.794 -4.410 1.00 0.00 O ATOM 1129 CB ASP A 71 -0.575 -0.511 -6.555 1.00 0.00 C ATOM 1130 CG ASP A 71 0.135 -1.097 -7.785 1.00 0.00 C ATOM 1131 OD1 ASP A 71 0.113 -2.339 -7.958 1.00 0.00 O ATOM 1132 OD2 ASP A 71 0.729 -0.318 -8.567 1.00 0.00 O ATOM 0 H ASP A 71 -1.731 1.099 -7.987 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.508 -1.478 -6.932 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.218 0.504 -6.384 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.309 -1.095 -5.674 1.00 0.00 H new ATOM 1137 N HIS A 72 -3.166 1.234 -5.300 1.00 0.00 N ATOM 1138 CA HIS A 72 -3.794 1.766 -4.094 1.00 0.00 C ATOM 1139 C HIS A 72 -5.201 1.157 -3.957 1.00 0.00 C ATOM 1140 O HIS A 72 -5.947 1.069 -4.943 1.00 0.00 O ATOM 1141 CB HIS A 72 -3.867 3.298 -4.179 1.00 0.00 C ATOM 1142 CG HIS A 72 -4.288 3.927 -2.869 1.00 0.00 C ATOM 1143 ND1 HIS A 72 -5.553 3.954 -2.324 1.00 0.00 N ATOM 1144 CD2 HIS A 72 -3.454 4.463 -1.926 1.00 0.00 C ATOM 1145 CE1 HIS A 72 -5.457 4.456 -1.083 1.00 0.00 C ATOM 1146 NE2 HIS A 72 -4.193 4.779 -0.788 1.00 0.00 N ATOM 0 H HIS A 72 -3.107 1.902 -6.069 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.205 1.503 -3.216 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -2.893 3.690 -4.471 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.572 3.583 -4.960 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -6.411 3.647 -2.783 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.392 4.617 -2.045 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.292 4.583 -0.410 1.00 0.00 H new ATOM 1154 N LYS A 73 -5.573 0.726 -2.749 1.00 0.00 N ATOM 1155 CA LYS A 73 -6.859 0.071 -2.475 1.00 0.00 C ATOM 1156 C LYS A 73 -7.948 1.082 -2.101 1.00 0.00 C ATOM 1157 O LYS A 73 -7.675 2.172 -1.599 1.00 0.00 O ATOM 1158 CB LYS A 73 -6.653 -1.011 -1.400 1.00 0.00 C ATOM 1159 CG LYS A 73 -5.800 -2.173 -1.944 1.00 0.00 C ATOM 1160 CD LYS A 73 -5.088 -2.957 -0.838 1.00 0.00 C ATOM 1161 CE LYS A 73 -4.169 -3.990 -1.498 1.00 0.00 C ATOM 1162 NZ LYS A 73 -3.369 -4.739 -0.493 1.00 0.00 N ATOM 0 H LYS A 73 -4.984 0.822 -1.922 1.00 0.00 H new ATOM 0 HA LYS A 73 -7.218 -0.413 -3.383 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -6.166 -0.575 -0.528 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -7.620 -1.389 -1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -6.438 -2.851 -2.510 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -5.058 -1.779 -2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -4.510 -2.283 -0.206 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -5.815 -3.452 -0.194 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -4.768 -4.690 -2.081 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -3.498 -3.487 -2.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -2.760 -5.428 -0.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -2.778 -4.074 0.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -4.009 -5.239 0.157 1.00 0.00 H new ATOM 1176 N PHE A 74 -9.208 0.732 -2.338 1.00 0.00 N ATOM 1177 CA PHE A 74 -10.345 1.616 -2.058 1.00 0.00 C ATOM 1178 C PHE A 74 -11.499 0.854 -1.410 1.00 0.00 C ATOM 1179 O PHE A 74 -11.732 -0.320 -1.710 1.00 0.00 O ATOM 1180 CB PHE A 74 -10.783 2.345 -3.336 1.00 0.00 C ATOM 1181 CG PHE A 74 -9.821 3.408 -3.838 1.00 0.00 C ATOM 1182 CD1 PHE A 74 -8.697 3.050 -4.609 1.00 0.00 C ATOM 1183 CD2 PHE A 74 -10.060 4.764 -3.545 1.00 0.00 C ATOM 1184 CE1 PHE A 74 -7.808 4.038 -5.068 1.00 0.00 C ATOM 1185 CE2 PHE A 74 -9.176 5.752 -4.015 1.00 0.00 C ATOM 1186 CZ PHE A 74 -8.048 5.391 -4.769 1.00 0.00 C ATOM 0 H PHE A 74 -9.475 -0.171 -2.729 1.00 0.00 H new ATOM 0 HA PHE A 74 -10.025 2.369 -1.338 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -10.927 1.607 -4.125 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.752 2.811 -3.155 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -8.518 2.012 -4.848 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -10.922 5.046 -2.959 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -6.942 3.758 -5.649 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -9.366 6.792 -3.795 1.00 0.00 H new ATOM 0 HZ PHE A 74 -7.366 6.151 -5.119 1.00 0.00 H new ATOM 1196 N MET A 75 -12.199 1.527 -0.491 1.00 0.00 N ATOM 1197 CA MET A 75 -13.303 0.954 0.277 1.00 0.00 C ATOM 1198 C MET A 75 -14.547 0.802 -0.609 1.00 0.00 C ATOM 1199 O MET A 75 -15.239 1.782 -0.909 1.00 0.00 O ATOM 1200 CB MET A 75 -13.576 1.827 1.506 1.00 0.00 C ATOM 1201 CG MET A 75 -14.668 1.236 2.403 1.00 0.00 C ATOM 1202 SD MET A 75 -15.098 2.250 3.843 1.00 0.00 S ATOM 1203 CE MET A 75 -13.995 1.588 5.118 1.00 0.00 C ATOM 0 H MET A 75 -12.009 2.502 -0.258 1.00 0.00 H new ATOM 0 HA MET A 75 -13.033 -0.043 0.624 1.00 0.00 H new ATOM 0 HB2 MET A 75 -12.657 1.940 2.081 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.874 2.824 1.182 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.566 1.080 1.805 1.00 0.00 H new ATOM 0 HG3 MET A 75 -14.342 0.256 2.750 1.00 0.00 H new ATOM 0 HE1 MET A 75 -14.570 0.982 5.818 1.00 0.00 H new ATOM 0 HE2 MET A 75 -13.227 0.972 4.651 1.00 0.00 H new ATOM 0 HE3 MET A 75 -13.523 2.411 5.654 1.00 0.00 H new ATOM 1213 N THR A 76 -14.845 -0.424 -1.037 1.00 0.00 N ATOM 1214 CA THR A 76 -16.095 -0.732 -1.754 1.00 0.00 C ATOM 1215 C THR A 76 -17.305 -0.590 -0.838 1.00 0.00 C ATOM 1216 O THR A 76 -17.175 -0.540 0.388 1.00 0.00 O ATOM 1217 CB THR A 76 -16.093 -2.147 -2.344 1.00 0.00 C ATOM 1218 OG1 THR A 76 -15.938 -3.112 -1.330 1.00 0.00 O ATOM 1219 CG2 THR A 76 -14.993 -2.311 -3.385 1.00 0.00 C ATOM 0 H THR A 76 -14.236 -1.231 -0.901 1.00 0.00 H new ATOM 0 HA THR A 76 -16.160 -0.012 -2.569 1.00 0.00 H new ATOM 0 HB THR A 76 -17.056 -2.298 -2.832 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.941 -4.008 -1.728 1.00 0.00 H new ATOM 0 HG21 THR A 76 -15.018 -3.325 -3.784 1.00 0.00 H new ATOM 0 HG22 THR A 76 -15.149 -1.598 -4.195 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.024 -2.127 -2.922 1.00 0.00 H new ATOM 1227 N VAL A 77 -18.508 -0.581 -1.417 1.00 0.00 N ATOM 1228 CA VAL A 77 -19.762 -0.545 -0.645 1.00 0.00 C ATOM 1229 C VAL A 77 -19.925 -1.694 0.363 1.00 0.00 C ATOM 1230 O VAL A 77 -20.598 -1.531 1.381 1.00 0.00 O ATOM 1231 CB VAL A 77 -20.999 -0.500 -1.559 1.00 0.00 C ATOM 1232 CG1 VAL A 77 -21.054 0.832 -2.302 1.00 0.00 C ATOM 1233 CG2 VAL A 77 -21.045 -1.656 -2.567 1.00 0.00 C ATOM 0 H VAL A 77 -18.645 -0.598 -2.428 1.00 0.00 H new ATOM 0 HA VAL A 77 -19.689 0.378 -0.070 1.00 0.00 H new ATOM 0 HB VAL A 77 -21.869 -0.606 -0.911 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -21.933 0.853 -2.946 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -21.112 1.648 -1.582 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -20.156 0.947 -2.910 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -21.941 -1.567 -3.182 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -20.162 -1.618 -3.205 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -21.065 -2.605 -2.031 1.00 0.00 H new ATOM 1243 N ASP A 78 -19.293 -2.843 0.105 1.00 0.00 N ATOM 1244 CA ASP A 78 -19.274 -4.003 1.006 1.00 0.00 C ATOM 1245 C ASP A 78 -18.259 -3.862 2.162 1.00 0.00 C ATOM 1246 O ASP A 78 -18.287 -4.653 3.109 1.00 0.00 O ATOM 1247 CB ASP A 78 -18.970 -5.264 0.186 1.00 0.00 C ATOM 1248 CG ASP A 78 -20.083 -5.585 -0.822 1.00 0.00 C ATOM 1249 OD1 ASP A 78 -21.210 -5.934 -0.393 1.00 0.00 O ATOM 1250 OD2 ASP A 78 -19.830 -5.513 -2.050 1.00 0.00 O ATOM 0 H ASP A 78 -18.768 -2.998 -0.756 1.00 0.00 H new ATOM 0 HA ASP A 78 -20.257 -4.072 1.472 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -18.028 -5.131 -0.346 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -18.838 -6.110 0.860 1.00 0.00 H new ATOM 1255 N GLY A 79 -17.358 -2.873 2.096 1.00 0.00 N ATOM 1256 CA GLY A 79 -16.314 -2.614 3.094 1.00 0.00 C ATOM 1257 C GLY A 79 -14.971 -3.291 2.784 1.00 0.00 C ATOM 1258 O GLY A 79 -14.041 -3.205 3.592 1.00 0.00 O ATOM 0 H GLY A 79 -17.336 -2.210 1.321 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -16.158 -1.538 3.170 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -16.665 -2.955 4.068 1.00 0.00 H new ATOM 1262 N GLN A 80 -14.857 -3.967 1.633 1.00 0.00 N ATOM 1263 CA GLN A 80 -13.609 -4.574 1.156 1.00 0.00 C ATOM 1264 C GLN A 80 -12.599 -3.490 0.748 1.00 0.00 C ATOM 1265 O GLN A 80 -12.977 -2.353 0.458 1.00 0.00 O ATOM 1266 CB GLN A 80 -13.887 -5.507 -0.041 1.00 0.00 C ATOM 1267 CG GLN A 80 -15.036 -6.515 0.151 1.00 0.00 C ATOM 1268 CD GLN A 80 -14.745 -7.593 1.197 1.00 0.00 C ATOM 1269 OE1 GLN A 80 -14.609 -7.338 2.387 1.00 0.00 O ATOM 1270 NE2 GLN A 80 -14.647 -8.845 0.800 1.00 0.00 N ATOM 0 H GLN A 80 -15.642 -4.109 0.998 1.00 0.00 H new ATOM 0 HA GLN A 80 -13.184 -5.159 1.971 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.109 -4.892 -0.913 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -12.976 -6.061 -0.266 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.936 -5.974 0.442 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.248 -6.996 -0.804 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.757 -9.077 -0.187 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -14.461 -9.582 1.480 1.00 0.00 H new ATOM 1279 N MET A 81 -11.316 -3.855 0.667 1.00 0.00 N ATOM 1280 CA MET A 81 -10.206 -2.952 0.334 1.00 0.00 C ATOM 1281 C MET A 81 -9.387 -3.541 -0.822 1.00 0.00 C ATOM 1282 O MET A 81 -8.368 -4.207 -0.630 1.00 0.00 O ATOM 1283 CB MET A 81 -9.412 -2.577 1.604 1.00 0.00 C ATOM 1284 CG MET A 81 -8.730 -3.755 2.317 1.00 0.00 C ATOM 1285 SD MET A 81 -8.458 -3.565 4.104 1.00 0.00 S ATOM 1286 CE MET A 81 -10.175 -3.567 4.701 1.00 0.00 C ATOM 0 H MET A 81 -11.011 -4.813 0.836 1.00 0.00 H new ATOM 0 HA MET A 81 -10.576 -1.997 -0.040 1.00 0.00 H new ATOM 0 HB2 MET A 81 -8.650 -1.845 1.335 1.00 0.00 H new ATOM 0 HB3 MET A 81 -10.088 -2.090 2.306 1.00 0.00 H new ATOM 0 HG2 MET A 81 -9.333 -4.648 2.156 1.00 0.00 H new ATOM 0 HG3 MET A 81 -7.766 -3.931 1.841 1.00 0.00 H new ATOM 0 HE1 MET A 81 -10.188 -3.779 5.770 1.00 0.00 H new ATOM 0 HE2 MET A 81 -10.625 -2.591 4.519 1.00 0.00 H new ATOM 0 HE3 MET A 81 -10.743 -4.332 4.172 1.00 0.00 H new ATOM 1296 N LEU A 82 -9.894 -3.345 -2.043 1.00 0.00 N ATOM 1297 CA LEU A 82 -9.358 -3.924 -3.283 1.00 0.00 C ATOM 1298 C LEU A 82 -8.662 -2.840 -4.124 1.00 0.00 C ATOM 1299 O LEU A 82 -9.078 -1.679 -4.058 1.00 0.00 O ATOM 1300 CB LEU A 82 -10.499 -4.560 -4.105 1.00 0.00 C ATOM 1301 CG LEU A 82 -11.447 -5.513 -3.356 1.00 0.00 C ATOM 1302 CD1 LEU A 82 -12.458 -6.128 -4.335 1.00 0.00 C ATOM 1303 CD2 LEU A 82 -10.720 -6.635 -2.607 1.00 0.00 C ATOM 0 H LEU A 82 -10.715 -2.761 -2.203 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.630 -4.691 -3.020 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.096 -3.756 -4.536 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.054 -5.107 -4.936 1.00 0.00 H new ATOM 0 HG LEU A 82 -11.957 -4.908 -2.607 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.124 -6.801 -3.795 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.043 -5.335 -4.800 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -11.925 -6.686 -5.105 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.450 -7.268 -2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.148 -7.234 -3.315 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.044 -6.202 -1.870 1.00 0.00 H new ATOM 1315 N PRO A 83 -7.631 -3.179 -4.925 1.00 0.00 N ATOM 1316 CA PRO A 83 -6.970 -2.217 -5.802 1.00 0.00 C ATOM 1317 C PRO A 83 -7.944 -1.713 -6.869 1.00 0.00 C ATOM 1318 O PRO A 83 -8.740 -2.480 -7.415 1.00 0.00 O ATOM 1319 CB PRO A 83 -5.784 -2.958 -6.423 1.00 0.00 C ATOM 1320 CG PRO A 83 -6.214 -4.420 -6.374 1.00 0.00 C ATOM 1321 CD PRO A 83 -7.061 -4.505 -5.105 1.00 0.00 C ATOM 0 HA PRO A 83 -6.630 -1.336 -5.258 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.595 -2.629 -7.445 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -4.866 -2.790 -5.860 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -6.788 -4.699 -7.258 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -5.355 -5.089 -6.328 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -7.843 -5.257 -5.206 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -6.453 -4.790 -4.246 1.00 0.00 H new ATOM 1329 N ILE A 84 -7.863 -0.428 -7.209 1.00 0.00 N ATOM 1330 CA ILE A 84 -8.738 0.174 -8.229 1.00 0.00 C ATOM 1331 C ILE A 84 -8.604 -0.467 -9.622 1.00 0.00 C ATOM 1332 O ILE A 84 -9.561 -0.466 -10.399 1.00 0.00 O ATOM 1333 CB ILE A 84 -8.551 1.696 -8.234 1.00 0.00 C ATOM 1334 CG1 ILE A 84 -9.627 2.374 -9.106 1.00 0.00 C ATOM 1335 CG2 ILE A 84 -7.131 2.079 -8.662 1.00 0.00 C ATOM 1336 CD1 ILE A 84 -9.889 3.816 -8.675 1.00 0.00 C ATOM 0 H ILE A 84 -7.198 0.225 -6.794 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.770 -0.041 -7.952 1.00 0.00 H new ATOM 0 HB ILE A 84 -8.681 2.062 -7.216 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -9.310 2.359 -10.149 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.554 1.804 -9.046 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -7.029 3.164 -8.656 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.412 1.643 -7.968 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -6.940 1.702 -9.667 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -10.654 4.254 -9.316 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -10.232 3.830 -7.640 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -8.969 4.394 -8.760 1.00 0.00 H new ATOM 1348 N ASP A 85 -7.465 -1.107 -9.904 1.00 0.00 N ATOM 1349 CA ASP A 85 -7.267 -1.940 -11.096 1.00 0.00 C ATOM 1350 C ASP A 85 -8.262 -3.115 -11.208 1.00 0.00 C ATOM 1351 O ASP A 85 -8.592 -3.545 -12.315 1.00 0.00 O ATOM 1352 CB ASP A 85 -5.831 -2.479 -11.107 1.00 0.00 C ATOM 1353 CG ASP A 85 -5.387 -2.962 -12.497 1.00 0.00 C ATOM 1354 OD1 ASP A 85 -5.614 -2.234 -13.495 1.00 0.00 O ATOM 1355 OD2 ASP A 85 -4.738 -4.030 -12.585 1.00 0.00 O ATOM 0 H ASP A 85 -6.642 -1.061 -9.303 1.00 0.00 H new ATOM 0 HA ASP A 85 -7.451 -1.299 -11.958 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -5.152 -1.698 -10.765 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -5.752 -3.303 -10.398 1.00 0.00 H new ATOM 1360 N GLU A 86 -8.768 -3.611 -10.073 1.00 0.00 N ATOM 1361 CA GLU A 86 -9.833 -4.622 -10.010 1.00 0.00 C ATOM 1362 C GLU A 86 -11.229 -3.981 -9.981 1.00 0.00 C ATOM 1363 O GLU A 86 -12.142 -4.472 -10.645 1.00 0.00 O ATOM 1364 CB GLU A 86 -9.602 -5.539 -8.795 1.00 0.00 C ATOM 1365 CG GLU A 86 -10.664 -6.644 -8.685 1.00 0.00 C ATOM 1366 CD GLU A 86 -10.235 -7.789 -7.746 1.00 0.00 C ATOM 1367 OE1 GLU A 86 -9.713 -7.531 -6.634 1.00 0.00 O ATOM 1368 OE2 GLU A 86 -10.435 -8.975 -8.115 1.00 0.00 O ATOM 0 H GLU A 86 -8.443 -3.315 -9.153 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.793 -5.226 -10.917 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.614 -5.994 -8.869 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -9.609 -4.940 -7.884 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -11.596 -6.212 -8.322 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -10.865 -7.049 -9.677 1.00 0.00 H new ATOM 1375 N ILE A 87 -11.410 -2.858 -9.272 1.00 0.00 N ATOM 1376 CA ILE A 87 -12.717 -2.193 -9.127 1.00 0.00 C ATOM 1377 C ILE A 87 -13.267 -1.740 -10.488 1.00 0.00 C ATOM 1378 O ILE A 87 -14.460 -1.893 -10.759 1.00 0.00 O ATOM 1379 CB ILE A 87 -12.616 -1.018 -8.124 1.00 0.00 C ATOM 1380 CG1 ILE A 87 -12.113 -1.546 -6.757 1.00 0.00 C ATOM 1381 CG2 ILE A 87 -13.991 -0.340 -7.961 1.00 0.00 C ATOM 1382 CD1 ILE A 87 -11.708 -0.466 -5.749 1.00 0.00 C ATOM 0 H ILE A 87 -10.653 -2.382 -8.781 1.00 0.00 H new ATOM 0 HA ILE A 87 -13.428 -2.914 -8.724 1.00 0.00 H new ATOM 0 HB ILE A 87 -11.909 -0.280 -8.504 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -12.896 -2.160 -6.312 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.257 -2.198 -6.930 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -13.908 0.485 -7.253 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -14.325 0.042 -8.926 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -14.713 -1.067 -7.588 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -11.371 -0.938 -4.826 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -10.900 0.135 -6.165 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.565 0.174 -5.538 1.00 0.00 H new ATOM 1394 N PHE A 88 -12.393 -1.251 -11.375 1.00 0.00 N ATOM 1395 CA PHE A 88 -12.752 -0.897 -12.754 1.00 0.00 C ATOM 1396 C PHE A 88 -13.275 -2.095 -13.580 1.00 0.00 C ATOM 1397 O PHE A 88 -14.202 -1.933 -14.375 1.00 0.00 O ATOM 1398 CB PHE A 88 -11.530 -0.260 -13.432 1.00 0.00 C ATOM 1399 CG PHE A 88 -11.754 0.117 -14.886 1.00 0.00 C ATOM 1400 CD1 PHE A 88 -12.417 1.314 -15.217 1.00 0.00 C ATOM 1401 CD2 PHE A 88 -11.328 -0.747 -15.913 1.00 0.00 C ATOM 1402 CE1 PHE A 88 -12.635 1.660 -16.562 1.00 0.00 C ATOM 1403 CE2 PHE A 88 -11.542 -0.401 -17.261 1.00 0.00 C ATOM 1404 CZ PHE A 88 -12.190 0.805 -17.586 1.00 0.00 C ATOM 0 H PHE A 88 -11.410 -1.089 -11.155 1.00 0.00 H new ATOM 0 HA PHE A 88 -13.579 -0.189 -12.711 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -11.244 0.633 -12.876 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -10.692 -0.954 -13.373 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -12.761 1.971 -14.432 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -10.836 -1.676 -15.666 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.143 2.581 -16.808 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -11.208 -1.062 -18.047 1.00 0.00 H new ATOM 0 HZ PHE A 88 -12.345 1.074 -18.620 1.00 0.00 H new ATOM 1414 N GLU A 89 -12.721 -3.299 -13.383 1.00 0.00 N ATOM 1415 CA GLU A 89 -13.134 -4.513 -14.112 1.00 0.00 C ATOM 1416 C GLU A 89 -14.423 -5.121 -13.553 1.00 0.00 C ATOM 1417 O GLU A 89 -15.295 -5.539 -14.320 1.00 0.00 O ATOM 1418 CB GLU A 89 -12.043 -5.594 -14.047 1.00 0.00 C ATOM 1419 CG GLU A 89 -10.849 -5.273 -14.954 1.00 0.00 C ATOM 1420 CD GLU A 89 -9.915 -6.492 -15.110 1.00 0.00 C ATOM 1421 OE1 GLU A 89 -9.432 -7.044 -14.090 1.00 0.00 O ATOM 1422 OE2 GLU A 89 -9.656 -6.914 -16.265 1.00 0.00 O ATOM 0 H GLU A 89 -11.971 -3.462 -12.712 1.00 0.00 H new ATOM 0 HA GLU A 89 -13.303 -4.196 -15.141 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -11.697 -5.697 -13.018 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.469 -6.554 -14.337 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.209 -4.961 -15.934 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.289 -4.435 -14.538 1.00 0.00 H new ATOM 1429 N ARG A 90 -14.551 -5.168 -12.220 1.00 0.00 N ATOM 1430 CA ARG A 90 -15.753 -5.668 -11.537 1.00 0.00 C ATOM 1431 C ARG A 90 -16.931 -4.688 -11.602 1.00 0.00 C ATOM 1432 O ARG A 90 -18.060 -5.086 -11.311 1.00 0.00 O ATOM 1433 CB ARG A 90 -15.417 -6.039 -10.079 1.00 0.00 C ATOM 1434 CG ARG A 90 -14.294 -7.076 -9.898 1.00 0.00 C ATOM 1435 CD ARG A 90 -14.451 -8.352 -10.734 1.00 0.00 C ATOM 1436 NE ARG A 90 -15.742 -9.032 -10.509 1.00 0.00 N ATOM 1437 CZ ARG A 90 -16.080 -9.793 -9.480 1.00 0.00 C ATOM 1438 NH1 ARG A 90 -15.250 -10.070 -8.512 1.00 0.00 N ATOM 1439 NH2 ARG A 90 -17.278 -10.298 -9.401 1.00 0.00 N ATOM 0 H ARG A 90 -13.819 -4.858 -11.581 1.00 0.00 H new ATOM 0 HA ARG A 90 -16.077 -6.563 -12.069 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -15.137 -5.130 -9.547 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -16.320 -6.421 -9.603 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -13.343 -6.608 -10.152 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -14.242 -7.353 -8.845 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -14.358 -8.102 -11.791 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -13.638 -9.038 -10.496 1.00 0.00 H new ATOM 0 HE ARG A 90 -16.454 -8.901 -11.228 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -14.301 -9.696 -8.531 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -15.550 -10.661 -7.736 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -17.961 -10.108 -10.134 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -17.533 -10.884 -8.606 1.00 0.00 H new ATOM 1453 N GLU A 91 -16.684 -3.431 -11.995 1.00 0.00 N ATOM 1454 CA GLU A 91 -17.670 -2.335 -12.038 1.00 0.00 C ATOM 1455 C GLU A 91 -18.363 -2.097 -10.677 1.00 0.00 C ATOM 1456 O GLU A 91 -19.519 -1.666 -10.612 1.00 0.00 O ATOM 1457 CB GLU A 91 -18.673 -2.532 -13.197 1.00 0.00 C ATOM 1458 CG GLU A 91 -17.998 -2.719 -14.563 1.00 0.00 C ATOM 1459 CD GLU A 91 -19.020 -2.639 -15.712 1.00 0.00 C ATOM 1460 OE1 GLU A 91 -19.944 -3.488 -15.782 1.00 0.00 O ATOM 1461 OE2 GLU A 91 -18.906 -1.722 -16.562 1.00 0.00 O ATOM 0 H GLU A 91 -15.758 -3.135 -12.304 1.00 0.00 H new ATOM 0 HA GLU A 91 -17.120 -1.416 -12.243 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -19.295 -3.402 -12.985 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.337 -1.669 -13.243 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -17.234 -1.954 -14.700 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -17.492 -3.684 -14.591 1.00 0.00 H new ATOM 1468 N LEU A 92 -17.664 -2.410 -9.580 1.00 0.00 N ATOM 1469 CA LEU A 92 -18.174 -2.237 -8.219 1.00 0.00 C ATOM 1470 C LEU A 92 -18.131 -0.752 -7.825 1.00 0.00 C ATOM 1471 O LEU A 92 -17.105 -0.082 -7.958 1.00 0.00 O ATOM 1472 CB LEU A 92 -17.361 -3.119 -7.250 1.00 0.00 C ATOM 1473 CG LEU A 92 -17.658 -4.623 -7.420 1.00 0.00 C ATOM 1474 CD1 LEU A 92 -16.649 -5.460 -6.632 1.00 0.00 C ATOM 1475 CD2 LEU A 92 -19.085 -4.994 -6.989 1.00 0.00 C ATOM 0 H LEU A 92 -16.720 -2.794 -9.615 1.00 0.00 H new ATOM 0 HA LEU A 92 -19.215 -2.555 -8.167 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.297 -2.943 -7.411 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -17.582 -2.823 -6.224 1.00 0.00 H new ATOM 0 HG LEU A 92 -17.568 -4.842 -8.484 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.873 -6.519 -6.763 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -15.642 -5.254 -6.996 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -16.711 -5.204 -5.574 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -19.241 -6.064 -7.129 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -19.225 -4.742 -5.938 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -19.803 -4.440 -7.594 1.00 0.00 H new ATOM 1487 N ASP A 93 -19.253 -0.224 -7.342 1.00 0.00 N ATOM 1488 CA ASP A 93 -19.317 1.125 -6.766 1.00 0.00 C ATOM 1489 C ASP A 93 -18.554 1.228 -5.425 1.00 0.00 C ATOM 1490 O ASP A 93 -18.363 0.247 -4.694 1.00 0.00 O ATOM 1491 CB ASP A 93 -20.770 1.633 -6.668 1.00 0.00 C ATOM 1492 CG ASP A 93 -21.847 0.535 -6.555 1.00 0.00 C ATOM 1493 OD1 ASP A 93 -21.881 -0.198 -5.543 1.00 0.00 O ATOM 1494 OD2 ASP A 93 -22.676 0.411 -7.488 1.00 0.00 O ATOM 0 H ASP A 93 -20.146 -0.716 -7.337 1.00 0.00 H new ATOM 0 HA ASP A 93 -18.799 1.793 -7.454 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.850 2.288 -5.801 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -20.985 2.240 -7.547 1.00 0.00 H new ATOM 1499 N LEU A 94 -18.101 2.446 -5.106 1.00 0.00 N ATOM 1500 CA LEU A 94 -17.334 2.762 -3.893 1.00 0.00 C ATOM 1501 C LEU A 94 -18.232 3.298 -2.771 1.00 0.00 C ATOM 1502 O LEU A 94 -19.279 3.906 -3.025 1.00 0.00 O ATOM 1503 CB LEU A 94 -16.224 3.772 -4.248 1.00 0.00 C ATOM 1504 CG LEU A 94 -15.049 3.149 -5.023 1.00 0.00 C ATOM 1505 CD1 LEU A 94 -14.065 4.235 -5.462 1.00 0.00 C ATOM 1506 CD2 LEU A 94 -14.287 2.147 -4.156 1.00 0.00 C ATOM 0 H LEU A 94 -18.261 3.261 -5.699 1.00 0.00 H new ATOM 0 HA LEU A 94 -16.883 1.844 -3.516 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -16.654 4.578 -4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -15.845 4.221 -3.330 1.00 0.00 H new ATOM 0 HG LEU A 94 -15.468 2.640 -5.891 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -13.240 3.779 -6.009 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -14.576 4.950 -6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -13.677 4.751 -4.584 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -13.463 1.723 -4.729 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -13.893 2.654 -3.275 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -14.961 1.349 -3.845 1.00 0.00 H new ATOM 1518 N MET A 95 -17.817 3.085 -1.518 1.00 0.00 N ATOM 1519 CA MET A 95 -18.509 3.645 -0.353 1.00 0.00 C ATOM 1520 C MET A 95 -18.266 5.159 -0.260 1.00 0.00 C ATOM 1521 O MET A 95 -17.138 5.626 -0.440 1.00 0.00 O ATOM 1522 CB MET A 95 -18.058 2.946 0.940 1.00 0.00 C ATOM 1523 CG MET A 95 -19.099 3.162 2.049 1.00 0.00 C ATOM 1524 SD MET A 95 -18.634 2.634 3.723 1.00 0.00 S ATOM 1525 CE MET A 95 -18.342 0.863 3.469 1.00 0.00 C ATOM 0 H MET A 95 -16.998 2.524 -1.284 1.00 0.00 H new ATOM 0 HA MET A 95 -19.578 3.473 -0.477 1.00 0.00 H new ATOM 0 HB2 MET A 95 -17.925 1.879 0.758 1.00 0.00 H new ATOM 0 HB3 MET A 95 -17.092 3.338 1.256 1.00 0.00 H new ATOM 0 HG2 MET A 95 -19.343 4.224 2.083 1.00 0.00 H new ATOM 0 HG3 MET A 95 -20.010 2.634 1.767 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.014 0.410 4.405 1.00 0.00 H new ATOM 0 HE2 MET A 95 -19.265 0.386 3.139 1.00 0.00 H new ATOM 0 HE3 MET A 95 -17.571 0.726 2.710 1.00 0.00 H new ATOM 1535 N ARG A 96 -19.325 5.911 0.070 1.00 0.00 N ATOM 1536 CA ARG A 96 -19.314 7.378 0.198 1.00 0.00 C ATOM 1537 C ARG A 96 -19.555 7.876 1.629 1.00 0.00 C ATOM 1538 O ARG A 96 -20.094 7.152 2.466 1.00 0.00 O ATOM 1539 CB ARG A 96 -20.293 8.036 -0.801 1.00 0.00 C ATOM 1540 CG ARG A 96 -21.744 7.538 -0.725 1.00 0.00 C ATOM 1541 CD ARG A 96 -22.045 6.427 -1.740 1.00 0.00 C ATOM 1542 NE ARG A 96 -23.460 6.012 -1.628 1.00 0.00 N ATOM 1543 CZ ARG A 96 -24.010 5.114 -0.826 1.00 0.00 C ATOM 1544 NH1 ARG A 96 -23.322 4.416 0.038 1.00 0.00 N ATOM 1545 NH2 ARG A 96 -25.290 4.883 -0.876 1.00 0.00 N ATOM 0 H ARG A 96 -20.241 5.505 0.261 1.00 0.00 H new ATOM 0 HA ARG A 96 -18.301 7.690 -0.055 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -20.287 9.113 -0.634 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -19.921 7.868 -1.812 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -21.945 7.169 0.281 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -22.420 8.375 -0.898 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -21.840 6.780 -2.750 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -21.391 5.573 -1.562 1.00 0.00 H new ATOM 0 HE ARG A 96 -24.105 6.486 -2.260 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -22.314 4.552 0.116 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -23.793 3.735 0.634 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -25.875 5.395 -1.536 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -25.708 4.190 -0.255 1.00 0.00 H new ATOM 1559 N VAL A 97 -19.202 9.143 1.870 1.00 0.00 N ATOM 1560 CA VAL A 97 -19.415 9.865 3.146 1.00 0.00 C ATOM 1561 C VAL A 97 -20.499 10.948 3.076 1.00 0.00 C ATOM 1562 O VAL A 97 -21.092 11.281 4.103 1.00 0.00 O ATOM 1563 CB VAL A 97 -18.113 10.491 3.693 1.00 0.00 C ATOM 1564 CG1 VAL A 97 -17.103 9.416 4.100 1.00 0.00 C ATOM 1565 CG2 VAL A 97 -17.408 11.443 2.723 1.00 0.00 C ATOM 0 H VAL A 97 -18.745 9.720 1.164 1.00 0.00 H new ATOM 0 HA VAL A 97 -19.762 9.092 3.831 1.00 0.00 H new ATOM 0 HB VAL A 97 -18.444 11.071 4.554 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -16.199 9.892 4.480 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -17.536 8.786 4.877 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -16.854 8.804 3.233 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -16.505 11.835 3.190 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -17.142 10.904 1.814 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -18.075 12.268 2.474 1.00 0.00 H new ATOM 1575 N ASP A 98 -20.802 11.472 1.883 1.00 0.00 N ATOM 1576 CA ASP A 98 -21.722 12.609 1.691 1.00 0.00 C ATOM 1577 C ASP A 98 -23.128 12.186 1.217 1.00 0.00 C ATOM 1578 O ASP A 98 -23.958 13.026 0.864 1.00 0.00 O ATOM 1579 CB ASP A 98 -21.063 13.614 0.734 1.00 0.00 C ATOM 1580 CG ASP A 98 -21.709 15.012 0.793 1.00 0.00 C ATOM 1581 OD1 ASP A 98 -21.838 15.579 1.907 1.00 0.00 O ATOM 1582 OD2 ASP A 98 -22.044 15.577 -0.277 1.00 0.00 O ATOM 0 H ASP A 98 -20.412 11.117 1.010 1.00 0.00 H new ATOM 0 HA ASP A 98 -21.893 13.081 2.658 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -20.004 13.698 0.977 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -21.127 13.233 -0.285 1.00 0.00 H new ATOM 1587 N ASN A 99 -23.401 10.871 1.209 1.00 0.00 N ATOM 1588 CA ASN A 99 -24.704 10.261 0.852 1.00 0.00 C ATOM 1589 C ASN A 99 -25.047 10.450 -0.635 1.00 0.00 C ATOM 1590 O ASN A 99 -26.207 10.379 -1.054 1.00 0.00 O ATOM 1591 CB ASN A 99 -25.813 10.686 1.844 1.00 0.00 C ATOM 1592 CG ASN A 99 -25.276 10.804 3.258 1.00 0.00 C ATOM 1593 OD1 ASN A 99 -25.356 11.840 3.907 1.00 0.00 O ATOM 1594 ND2 ASN A 99 -24.579 9.788 3.719 1.00 0.00 N ATOM 0 H ASN A 99 -22.699 10.174 1.459 1.00 0.00 H new ATOM 0 HA ASN A 99 -24.623 9.180 0.966 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -26.235 11.642 1.533 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -26.623 9.957 1.821 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -24.104 9.862 4.619 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -24.514 8.926 3.177 1.00 0.00 H new ATOM 1601 N LEU A 100 -23.990 10.680 -1.414 1.00 0.00 N ATOM 1602 CA LEU A 100 -23.996 10.676 -2.884 1.00 0.00 C ATOM 1603 C LEU A 100 -24.567 9.355 -3.460 1.00 0.00 C ATOM 1604 O LEU A 100 -24.561 8.327 -2.776 1.00 0.00 O ATOM 1605 CB LEU A 100 -22.553 10.913 -3.374 1.00 0.00 C ATOM 1606 CG LEU A 100 -22.048 12.355 -3.175 1.00 0.00 C ATOM 1607 CD1 LEU A 100 -20.546 12.420 -3.444 1.00 0.00 C ATOM 1608 CD2 LEU A 100 -22.744 13.348 -4.111 1.00 0.00 C ATOM 0 H LEU A 100 -23.068 10.883 -1.027 1.00 0.00 H new ATOM 0 HA LEU A 100 -24.650 11.472 -3.240 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -21.886 10.230 -2.848 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -22.495 10.662 -4.433 1.00 0.00 H new ATOM 0 HG LEU A 100 -22.274 12.631 -2.145 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -20.195 13.442 -3.302 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -20.024 11.757 -2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -20.346 12.107 -4.469 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -22.354 14.350 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -22.557 13.064 -5.147 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -23.817 13.337 -3.920 1.00 0.00 H new ATOM 1620 N PRO A 101 -25.032 9.340 -4.722 1.00 0.00 N ATOM 1621 CA PRO A 101 -25.467 8.108 -5.383 1.00 0.00 C ATOM 1622 C PRO A 101 -24.279 7.150 -5.586 1.00 0.00 C ATOM 1623 O PRO A 101 -23.153 7.592 -5.822 1.00 0.00 O ATOM 1624 CB PRO A 101 -26.091 8.565 -6.708 1.00 0.00 C ATOM 1625 CG PRO A 101 -25.390 9.890 -7.013 1.00 0.00 C ATOM 1626 CD PRO A 101 -25.108 10.475 -5.630 1.00 0.00 C ATOM 0 HA PRO A 101 -26.188 7.545 -4.790 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -25.925 7.835 -7.500 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -27.169 8.696 -6.617 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -24.471 9.736 -7.578 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -26.022 10.551 -7.606 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -24.176 11.039 -5.628 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -25.898 11.163 -5.329 1.00 0.00 H new ATOM 1634 N ASN A 102 -24.510 5.835 -5.498 1.00 0.00 N ATOM 1635 CA ASN A 102 -23.478 4.833 -5.795 1.00 0.00 C ATOM 1636 C ASN A 102 -23.106 4.844 -7.290 1.00 0.00 C ATOM 1637 O ASN A 102 -23.961 4.625 -8.154 1.00 0.00 O ATOM 1638 CB ASN A 102 -23.955 3.433 -5.372 1.00 0.00 C ATOM 1639 CG ASN A 102 -23.917 3.194 -3.876 1.00 0.00 C ATOM 1640 OD1 ASN A 102 -24.917 2.844 -3.264 1.00 0.00 O ATOM 1641 ND2 ASN A 102 -22.780 3.357 -3.232 1.00 0.00 N ATOM 0 H ASN A 102 -25.408 5.438 -5.222 1.00 0.00 H new ATOM 0 HA ASN A 102 -22.585 5.088 -5.224 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -24.975 3.285 -5.727 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -23.334 2.685 -5.865 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -22.735 3.192 -2.227 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -21.944 3.649 -3.739 1.00 0.00 H new ATOM 1648 N ILE A 103 -21.822 5.078 -7.575 1.00 0.00 N ATOM 1649 CA ILE A 103 -21.256 5.249 -8.922 1.00 0.00 C ATOM 1650 C ILE A 103 -19.842 4.649 -8.987 1.00 0.00 C ATOM 1651 O ILE A 103 -19.043 4.798 -8.057 1.00 0.00 O ATOM 1652 CB ILE A 103 -21.299 6.741 -9.353 1.00 0.00 C ATOM 1653 CG1 ILE A 103 -20.692 7.705 -8.308 1.00 0.00 C ATOM 1654 CG2 ILE A 103 -22.748 7.144 -9.692 1.00 0.00 C ATOM 1655 CD1 ILE A 103 -20.795 9.191 -8.675 1.00 0.00 C ATOM 0 H ILE A 103 -21.115 5.157 -6.844 1.00 0.00 H new ATOM 0 HA ILE A 103 -21.867 4.702 -9.640 1.00 0.00 H new ATOM 0 HB ILE A 103 -20.671 6.832 -10.239 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -21.191 7.545 -7.352 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -19.642 7.451 -8.166 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -22.773 8.191 -9.994 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -23.117 6.522 -10.508 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -23.379 7.004 -8.815 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -20.344 9.793 -7.886 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -20.270 9.371 -9.613 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -21.844 9.466 -8.787 1.00 0.00 H new ATOM 1667 N LYS A 104 -19.547 3.942 -10.087 1.00 0.00 N ATOM 1668 CA LYS A 104 -18.247 3.306 -10.380 1.00 0.00 C ATOM 1669 C LYS A 104 -17.425 4.157 -11.360 1.00 0.00 C ATOM 1670 O LYS A 104 -17.897 5.179 -11.863 1.00 0.00 O ATOM 1671 CB LYS A 104 -18.484 1.839 -10.818 1.00 0.00 C ATOM 1672 CG LYS A 104 -19.178 1.585 -12.173 1.00 0.00 C ATOM 1673 CD LYS A 104 -18.246 1.753 -13.381 1.00 0.00 C ATOM 1674 CE LYS A 104 -18.811 1.106 -14.651 1.00 0.00 C ATOM 1675 NZ LYS A 104 -17.781 1.021 -15.725 1.00 0.00 N ATOM 0 H LYS A 104 -20.231 3.789 -10.828 1.00 0.00 H new ATOM 0 HA LYS A 104 -17.629 3.259 -9.484 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -17.516 1.338 -10.841 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -19.077 1.352 -10.044 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -19.588 0.575 -12.178 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -20.019 2.271 -12.275 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -18.078 2.815 -13.562 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -17.276 1.311 -13.152 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -19.179 0.107 -14.419 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -19.663 1.685 -15.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -17.880 0.117 -16.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -17.911 1.807 -16.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -16.833 1.079 -15.302 1.00 0.00 H new ATOM 1689 N ILE A 105 -16.189 3.737 -11.635 1.00 0.00 N ATOM 1690 CA ILE A 105 -15.267 4.410 -12.572 1.00 0.00 C ATOM 1691 C ILE A 105 -15.799 4.314 -14.016 1.00 0.00 C ATOM 1692 O ILE A 105 -15.761 3.251 -14.638 1.00 0.00 O ATOM 1693 CB ILE A 105 -13.844 3.828 -12.438 1.00 0.00 C ATOM 1694 CG1 ILE A 105 -13.332 3.838 -10.973 1.00 0.00 C ATOM 1695 CG2 ILE A 105 -12.871 4.613 -13.332 1.00 0.00 C ATOM 1696 CD1 ILE A 105 -13.124 2.419 -10.433 1.00 0.00 C ATOM 0 H ILE A 105 -15.786 2.903 -11.208 1.00 0.00 H new ATOM 0 HA ILE A 105 -15.211 5.468 -12.318 1.00 0.00 H new ATOM 0 HB ILE A 105 -13.892 2.787 -12.759 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -12.393 4.388 -10.920 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.047 4.366 -10.342 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -11.869 4.197 -13.232 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -13.192 4.540 -14.371 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -12.861 5.660 -13.028 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.765 2.470 -9.405 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -14.069 1.877 -10.461 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -12.389 1.900 -11.048 1.00 0.00 H new ATOM 1708 N ALA A 106 -16.337 5.418 -14.534 1.00 0.00 N ATOM 1709 CA ALA A 106 -16.974 5.498 -15.850 1.00 0.00 C ATOM 1710 C ALA A 106 -15.963 5.346 -17.000 1.00 0.00 C ATOM 1711 O ALA A 106 -16.226 4.631 -17.970 1.00 0.00 O ATOM 1712 CB ALA A 106 -17.715 6.839 -15.936 1.00 0.00 C ATOM 0 H ALA A 106 -16.342 6.308 -14.036 1.00 0.00 H new ATOM 0 HA ALA A 106 -17.674 4.670 -15.960 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -18.200 6.925 -16.908 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -18.468 6.890 -15.149 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -17.004 7.656 -15.811 1.00 0.00 H new ATOM 1718 N THR A 107 -14.790 5.975 -16.860 1.00 0.00 N ATOM 1719 CA THR A 107 -13.635 5.847 -17.768 1.00 0.00 C ATOM 1720 C THR A 107 -12.312 5.965 -17.005 1.00 0.00 C ATOM 1721 O THR A 107 -12.235 6.603 -15.948 1.00 0.00 O ATOM 1722 CB THR A 107 -13.644 6.906 -18.894 1.00 0.00 C ATOM 1723 OG1 THR A 107 -13.900 8.205 -18.398 1.00 0.00 O ATOM 1724 CG2 THR A 107 -14.679 6.623 -19.982 1.00 0.00 C ATOM 0 H THR A 107 -14.609 6.611 -16.084 1.00 0.00 H new ATOM 0 HA THR A 107 -13.722 4.858 -18.217 1.00 0.00 H new ATOM 0 HB THR A 107 -12.644 6.849 -19.325 1.00 0.00 H new ATOM 0 HG1 THR A 107 -13.896 8.845 -19.140 1.00 0.00 H new ATOM 0 HG21 THR A 107 -14.632 7.404 -20.741 1.00 0.00 H new ATOM 0 HG22 THR A 107 -14.469 5.657 -20.442 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.675 6.605 -19.541 1.00 0.00 H new ATOM 1732 N ARG A 108 -11.257 5.365 -17.574 1.00 0.00 N ATOM 1733 CA ARG A 108 -9.883 5.372 -17.051 1.00 0.00 C ATOM 1734 C ARG A 108 -8.876 5.685 -18.160 1.00 0.00 C ATOM 1735 O ARG A 108 -8.991 5.158 -19.270 1.00 0.00 O ATOM 1736 CB ARG A 108 -9.597 4.029 -16.352 1.00 0.00 C ATOM 1737 CG ARG A 108 -8.101 3.748 -16.115 1.00 0.00 C ATOM 1738 CD ARG A 108 -7.924 2.582 -15.141 1.00 0.00 C ATOM 1739 NE ARG A 108 -6.691 1.808 -15.391 1.00 0.00 N ATOM 1740 CZ ARG A 108 -6.437 0.584 -14.959 1.00 0.00 C ATOM 1741 NH1 ARG A 108 -7.287 -0.127 -14.282 1.00 0.00 N ATOM 1742 NH2 ARG A 108 -5.298 0.002 -15.185 1.00 0.00 N ATOM 0 H ARG A 108 -11.340 4.841 -18.445 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.776 6.165 -16.311 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -10.115 4.014 -15.393 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -10.016 3.222 -16.953 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -7.614 3.516 -17.062 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -7.616 4.639 -15.717 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -7.905 2.966 -14.121 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -8.785 1.918 -15.216 1.00 0.00 H new ATOM 0 HE ARG A 108 -5.967 2.260 -15.950 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -8.206 0.254 -14.058 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -7.035 -1.066 -13.975 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -4.571 0.490 -15.708 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -5.131 -0.943 -14.839 1.00 0.00 H new ATOM 1756 N LYS A 109 -7.871 6.505 -17.834 1.00 0.00 N ATOM 1757 CA LYS A 109 -6.765 6.900 -18.726 1.00 0.00 C ATOM 1758 C LYS A 109 -5.457 6.971 -17.938 1.00 0.00 C ATOM 1759 O LYS A 109 -5.409 7.588 -16.873 1.00 0.00 O ATOM 1760 CB LYS A 109 -7.081 8.260 -19.382 1.00 0.00 C ATOM 1761 CG LYS A 109 -8.125 8.123 -20.506 1.00 0.00 C ATOM 1762 CD LYS A 109 -8.435 9.432 -21.243 1.00 0.00 C ATOM 1763 CE LYS A 109 -7.181 10.050 -21.874 1.00 0.00 C ATOM 1764 NZ LYS A 109 -7.523 11.155 -22.810 1.00 0.00 N ATOM 0 H LYS A 109 -7.799 6.929 -16.909 1.00 0.00 H new ATOM 0 HA LYS A 109 -6.653 6.153 -19.512 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -7.450 8.952 -18.625 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -6.165 8.690 -19.787 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -7.769 7.388 -21.229 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -9.049 7.731 -20.082 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -9.176 9.243 -22.020 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -8.878 10.144 -20.546 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -6.527 10.428 -21.088 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -6.625 9.280 -22.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -6.650 11.548 -23.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -8.127 10.789 -23.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -8.031 11.902 -22.295 1.00 0.00 H new ATOM 1778 N TYR A 110 -4.399 6.336 -18.443 1.00 0.00 N ATOM 1779 CA TYR A 110 -3.059 6.450 -17.859 1.00 0.00 C ATOM 1780 C TYR A 110 -2.520 7.876 -18.032 1.00 0.00 C ATOM 1781 O TYR A 110 -2.421 8.378 -19.158 1.00 0.00 O ATOM 1782 CB TYR A 110 -2.104 5.427 -18.492 1.00 0.00 C ATOM 1783 CG TYR A 110 -0.718 5.390 -17.863 1.00 0.00 C ATOM 1784 CD1 TYR A 110 -0.575 5.381 -16.461 1.00 0.00 C ATOM 1785 CD2 TYR A 110 0.433 5.369 -18.677 1.00 0.00 C ATOM 1786 CE1 TYR A 110 0.702 5.379 -15.878 1.00 0.00 C ATOM 1787 CE2 TYR A 110 1.717 5.337 -18.092 1.00 0.00 C ATOM 1788 CZ TYR A 110 1.854 5.337 -16.687 1.00 0.00 C ATOM 1789 OH TYR A 110 3.086 5.301 -16.109 1.00 0.00 O ATOM 0 H TYR A 110 -4.444 5.731 -19.263 1.00 0.00 H new ATOM 0 HA TYR A 110 -3.127 6.236 -16.792 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -2.551 4.436 -18.417 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -2.002 5.651 -19.554 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -1.453 5.376 -15.832 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.332 5.377 -19.752 1.00 0.00 H new ATOM 0 HE1 TYR A 110 0.802 5.410 -14.803 1.00 0.00 H new ATOM 0 HE2 TYR A 110 2.595 5.312 -18.720 1.00 0.00 H new ATOM 0 HH TYR A 110 3.774 5.274 -16.806 1.00 0.00 H new ATOM 1799 N LEU A 111 -2.187 8.539 -16.920 1.00 0.00 N ATOM 1800 CA LEU A 111 -1.657 9.907 -16.937 1.00 0.00 C ATOM 1801 C LEU A 111 -0.139 9.925 -17.105 1.00 0.00 C ATOM 1802 O LEU A 111 0.403 10.775 -17.814 1.00 0.00 O ATOM 1803 CB LEU A 111 -2.016 10.598 -15.614 1.00 0.00 C ATOM 1804 CG LEU A 111 -3.517 10.843 -15.445 1.00 0.00 C ATOM 1805 CD1 LEU A 111 -3.806 11.270 -14.011 1.00 0.00 C ATOM 1806 CD2 LEU A 111 -4.004 11.940 -16.397 1.00 0.00 C ATOM 0 H LEU A 111 -2.277 8.144 -15.984 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.100 10.430 -17.785 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.659 9.987 -14.785 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -1.491 11.551 -15.556 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.042 9.916 -15.677 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.875 11.444 -13.892 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.488 10.484 -13.326 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -3.262 12.188 -13.788 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.074 12.095 -16.257 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.472 12.868 -16.185 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.813 11.639 -17.427 1.00 0.00 H new ATOM 1818 N GLY A 112 0.537 8.996 -16.428 1.00 0.00 N ATOM 1819 CA GLY A 112 1.990 8.921 -16.364 1.00 0.00 C ATOM 1820 C GLY A 112 2.498 8.568 -14.968 1.00 0.00 C ATOM 1821 O GLY A 112 1.868 7.821 -14.216 1.00 0.00 O ATOM 0 H GLY A 112 0.074 8.258 -15.897 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.343 8.174 -17.075 1.00 0.00 H new ATOM 0 HA3 GLY A 112 2.413 9.878 -16.670 1.00 0.00 H new ATOM 1825 N LYS A 113 3.644 9.147 -14.608 1.00 0.00 N ATOM 1826 CA LYS A 113 4.445 8.775 -13.432 1.00 0.00 C ATOM 1827 C LYS A 113 4.709 9.962 -12.505 1.00 0.00 C ATOM 1828 O LYS A 113 5.733 10.645 -12.566 1.00 0.00 O ATOM 1829 CB LYS A 113 5.727 8.091 -13.902 1.00 0.00 C ATOM 1830 CG LYS A 113 6.338 7.252 -12.772 1.00 0.00 C ATOM 1831 CD LYS A 113 7.729 6.713 -13.129 1.00 0.00 C ATOM 1832 CE LYS A 113 7.653 5.643 -14.227 1.00 0.00 C ATOM 1833 NZ LYS A 113 9.008 5.179 -14.627 1.00 0.00 N ATOM 0 H LYS A 113 4.057 9.912 -15.141 1.00 0.00 H new ATOM 0 HA LYS A 113 3.878 8.070 -12.824 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.512 7.454 -14.760 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.445 8.841 -14.234 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.407 7.859 -11.869 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.675 6.417 -12.544 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.364 7.534 -13.463 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.196 6.290 -12.239 1.00 0.00 H new ATOM 0 HE2 LYS A 113 7.067 4.796 -13.871 1.00 0.00 H new ATOM 0 HE3 LYS A 113 7.134 6.047 -15.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 8.922 4.457 -15.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.558 5.984 -14.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 9.493 4.771 -13.802 1.00 0.00 H new ATOM 1847 N GLN A 114 3.708 10.239 -11.685 1.00 0.00 N ATOM 1848 CA GLN A 114 3.598 11.433 -10.849 1.00 0.00 C ATOM 1849 C GLN A 114 4.038 11.138 -9.413 1.00 0.00 C ATOM 1850 O GLN A 114 4.011 9.991 -8.954 1.00 0.00 O ATOM 1851 CB GLN A 114 2.156 11.962 -10.891 1.00 0.00 C ATOM 1852 CG GLN A 114 1.682 11.848 -12.341 1.00 0.00 C ATOM 1853 CD GLN A 114 0.461 12.618 -12.724 1.00 0.00 C ATOM 1854 OE1 GLN A 114 -0.311 13.159 -11.942 1.00 0.00 O ATOM 1855 NE2 GLN A 114 0.278 12.665 -14.016 1.00 0.00 N ATOM 0 H GLN A 114 2.911 9.611 -11.576 1.00 0.00 H new ATOM 0 HA GLN A 114 4.264 12.202 -11.241 1.00 0.00 H new ATOM 0 HB2 GLN A 114 1.513 11.383 -10.228 1.00 0.00 H new ATOM 0 HB3 GLN A 114 2.114 12.997 -10.552 1.00 0.00 H new ATOM 0 HG2 GLN A 114 2.499 12.166 -12.989 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.498 10.795 -12.554 1.00 0.00 H new ATOM 0 HE21 GLN A 114 0.939 12.204 -14.642 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -0.526 13.162 -14.399 1.00 0.00 H new ATOM 1864 N ASN A 115 4.416 12.179 -8.679 1.00 0.00 N ATOM 1865 CA ASN A 115 4.683 12.104 -7.267 1.00 0.00 C ATOM 1866 C ASN A 115 3.403 11.746 -6.501 1.00 0.00 C ATOM 1867 O ASN A 115 2.420 12.493 -6.528 1.00 0.00 O ATOM 1868 CB ASN A 115 5.304 13.440 -6.822 1.00 0.00 C ATOM 1869 CG ASN A 115 6.285 13.239 -5.690 1.00 0.00 C ATOM 1870 OD1 ASN A 115 7.363 13.819 -5.654 1.00 0.00 O ATOM 1871 ND2 ASN A 115 5.973 12.384 -4.751 1.00 0.00 N ATOM 0 H ASN A 115 4.545 13.113 -9.067 1.00 0.00 H new ATOM 0 HA ASN A 115 5.396 11.310 -7.044 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.811 13.907 -7.666 1.00 0.00 H new ATOM 0 HB3 ASN A 115 4.515 14.123 -6.506 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.627 12.201 -3.990 1.00 0.00 H new ATOM 0 HD22 ASN A 115 5.076 11.900 -4.780 1.00 0.00 H new ATOM 1878 N VAL A 116 3.439 10.607 -5.802 1.00 0.00 N ATOM 1879 CA VAL A 116 2.318 10.119 -4.992 1.00 0.00 C ATOM 1880 C VAL A 116 2.744 9.886 -3.539 1.00 0.00 C ATOM 1881 O VAL A 116 3.897 9.555 -3.252 1.00 0.00 O ATOM 1882 CB VAL A 116 1.663 8.876 -5.619 1.00 0.00 C ATOM 1883 CG1 VAL A 116 0.916 9.198 -6.911 1.00 0.00 C ATOM 1884 CG2 VAL A 116 2.660 7.761 -5.948 1.00 0.00 C ATOM 0 H VAL A 116 4.253 9.993 -5.782 1.00 0.00 H new ATOM 0 HA VAL A 116 1.554 10.896 -4.978 1.00 0.00 H new ATOM 0 HB VAL A 116 0.971 8.534 -4.849 1.00 0.00 H new ATOM 0 HG11 VAL A 116 0.473 8.286 -7.312 1.00 0.00 H new ATOM 0 HG12 VAL A 116 0.129 9.924 -6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 116 1.612 9.614 -7.640 1.00 0.00 H new ATOM 0 HG21 VAL A 116 2.129 6.916 -6.387 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.400 8.132 -6.657 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.161 7.440 -5.035 1.00 0.00 H new ATOM 1894 N TYR A 117 1.793 10.066 -2.625 1.00 0.00 N ATOM 1895 CA TYR A 117 1.998 10.143 -1.179 1.00 0.00 C ATOM 1896 C TYR A 117 0.905 9.386 -0.407 1.00 0.00 C ATOM 1897 O TYR A 117 -0.202 9.178 -0.915 1.00 0.00 O ATOM 1898 CB TYR A 117 1.968 11.623 -0.760 1.00 0.00 C ATOM 1899 CG TYR A 117 2.734 12.605 -1.631 1.00 0.00 C ATOM 1900 CD1 TYR A 117 2.104 13.178 -2.753 1.00 0.00 C ATOM 1901 CD2 TYR A 117 4.047 12.990 -1.292 1.00 0.00 C ATOM 1902 CE1 TYR A 117 2.785 14.131 -3.534 1.00 0.00 C ATOM 1903 CE2 TYR A 117 4.717 13.971 -2.049 1.00 0.00 C ATOM 1904 CZ TYR A 117 4.082 14.548 -3.170 1.00 0.00 C ATOM 1905 OH TYR A 117 4.715 15.504 -3.904 1.00 0.00 O ATOM 0 H TYR A 117 0.812 10.167 -2.884 1.00 0.00 H new ATOM 0 HA TYR A 117 2.958 9.683 -0.943 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.927 11.943 -0.724 1.00 0.00 H new ATOM 0 HB3 TYR A 117 2.359 11.695 0.255 1.00 0.00 H new ATOM 0 HD1 TYR A 117 1.098 12.886 -3.014 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.541 12.531 -0.449 1.00 0.00 H new ATOM 0 HE1 TYR A 117 2.313 14.544 -4.414 1.00 0.00 H new ATOM 0 HE2 TYR A 117 5.714 14.281 -1.772 1.00 0.00 H new ATOM 0 HH TYR A 117 5.600 15.678 -3.521 1.00 0.00 H new ATOM 1915 N ASP A 118 1.193 9.002 0.837 1.00 0.00 N ATOM 1916 CA ASP A 118 0.272 8.297 1.725 1.00 0.00 C ATOM 1917 C ASP A 118 0.666 8.527 3.194 1.00 0.00 C ATOM 1918 O ASP A 118 1.790 8.260 3.617 1.00 0.00 O ATOM 1919 CB ASP A 118 0.187 6.799 1.371 1.00 0.00 C ATOM 1920 CG ASP A 118 1.490 5.996 1.571 1.00 0.00 C ATOM 1921 OD1 ASP A 118 2.429 6.118 0.746 1.00 0.00 O ATOM 1922 OD2 ASP A 118 1.535 5.155 2.504 1.00 0.00 O ATOM 0 H ASP A 118 2.101 9.179 1.266 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.729 8.706 1.584 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.597 6.344 1.977 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -0.121 6.706 0.329 1.00 0.00 H new ATOM 1927 N ILE A 119 -0.251 9.083 3.988 1.00 0.00 N ATOM 1928 CA ILE A 119 -0.024 9.302 5.423 1.00 0.00 C ATOM 1929 C ILE A 119 -0.078 7.982 6.209 1.00 0.00 C ATOM 1930 O ILE A 119 -0.727 7.015 5.794 1.00 0.00 O ATOM 1931 CB ILE A 119 -1.010 10.346 5.984 1.00 0.00 C ATOM 1932 CG1 ILE A 119 -2.484 9.948 5.747 1.00 0.00 C ATOM 1933 CG2 ILE A 119 -0.668 11.719 5.376 1.00 0.00 C ATOM 1934 CD1 ILE A 119 -3.483 10.816 6.512 1.00 0.00 C ATOM 0 H ILE A 119 -1.166 9.393 3.661 1.00 0.00 H new ATOM 0 HA ILE A 119 0.982 9.703 5.546 1.00 0.00 H new ATOM 0 HB ILE A 119 -0.900 10.397 7.067 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -2.702 10.012 4.681 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.622 8.907 6.039 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.357 12.470 5.763 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.353 11.991 5.643 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.758 11.669 4.291 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -4.497 10.479 6.297 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.292 10.734 7.582 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.373 11.855 6.203 1.00 0.00 H new ATOM 1946 N GLY A 120 0.579 7.954 7.369 1.00 0.00 N ATOM 1947 CA GLY A 120 0.580 6.823 8.298 1.00 0.00 C ATOM 1948 C GLY A 120 -0.301 7.092 9.519 1.00 0.00 C ATOM 1949 O GLY A 120 -0.426 8.229 9.975 1.00 0.00 O ATOM 0 H GLY A 120 1.141 8.739 7.698 1.00 0.00 H new ATOM 0 HA2 GLY A 120 0.226 5.930 7.784 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.600 6.620 8.623 1.00 0.00 H new ATOM 1953 N VAL A 121 -0.903 6.025 10.040 1.00 0.00 N ATOM 1954 CA VAL A 121 -1.961 6.017 11.070 1.00 0.00 C ATOM 1955 C VAL A 121 -1.942 4.678 11.828 1.00 0.00 C ATOM 1956 O VAL A 121 -1.532 3.656 11.277 1.00 0.00 O ATOM 1957 CB VAL A 121 -3.363 6.227 10.440 1.00 0.00 C ATOM 1958 CG1 VAL A 121 -3.747 7.710 10.363 1.00 0.00 C ATOM 1959 CG2 VAL A 121 -3.503 5.628 9.031 1.00 0.00 C ATOM 0 H VAL A 121 -0.656 5.081 9.742 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.764 6.839 11.758 1.00 0.00 H new ATOM 0 HB VAL A 121 -4.038 5.697 11.112 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.736 7.807 9.915 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.760 8.135 11.367 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -3.018 8.243 9.752 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.509 5.814 8.655 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -2.775 6.091 8.365 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -3.324 4.554 9.073 1.00 0.00 H new ATOM 1969 N GLU A 122 -2.387 4.671 13.091 1.00 0.00 N ATOM 1970 CA GLU A 122 -2.221 3.513 13.994 1.00 0.00 C ATOM 1971 C GLU A 122 -3.480 2.641 14.155 1.00 0.00 C ATOM 1972 O GLU A 122 -3.362 1.423 14.327 1.00 0.00 O ATOM 1973 CB GLU A 122 -1.785 4.012 15.384 1.00 0.00 C ATOM 1974 CG GLU A 122 -0.361 4.588 15.425 1.00 0.00 C ATOM 1975 CD GLU A 122 0.709 3.486 15.293 1.00 0.00 C ATOM 1976 OE1 GLU A 122 1.014 2.808 16.304 1.00 0.00 O ATOM 1977 OE2 GLU A 122 1.263 3.294 14.183 1.00 0.00 O ATOM 0 H GLU A 122 -2.870 5.461 13.519 1.00 0.00 H new ATOM 0 HA GLU A 122 -1.464 2.880 13.531 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -2.485 4.777 15.720 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -1.852 3.186 16.092 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -0.239 5.311 14.619 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -0.214 5.126 16.361 1.00 0.00 H new ATOM 1984 N ARG A 123 -4.682 3.238 14.116 1.00 0.00 N ATOM 1985 CA ARG A 123 -5.960 2.541 14.376 1.00 0.00 C ATOM 1986 C ARG A 123 -6.363 1.610 13.227 1.00 0.00 C ATOM 1987 O ARG A 123 -6.695 0.443 13.445 1.00 0.00 O ATOM 1988 CB ARG A 123 -7.039 3.603 14.640 1.00 0.00 C ATOM 1989 CG ARG A 123 -8.375 3.001 15.088 1.00 0.00 C ATOM 1990 CD ARG A 123 -9.314 4.106 15.584 1.00 0.00 C ATOM 1991 NE ARG A 123 -10.638 3.564 15.944 1.00 0.00 N ATOM 1992 CZ ARG A 123 -10.996 3.045 17.103 1.00 0.00 C ATOM 1993 NH1 ARG A 123 -10.206 3.005 18.139 1.00 0.00 N ATOM 1994 NH2 ARG A 123 -12.183 2.538 17.230 1.00 0.00 N ATOM 0 H ARG A 123 -4.799 4.228 13.901 1.00 0.00 H new ATOM 0 HA ARG A 123 -5.843 1.898 15.249 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -6.683 4.292 15.405 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -7.196 4.187 13.733 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -8.837 2.466 14.259 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -8.206 2.274 15.882 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -8.873 4.599 16.450 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -9.428 4.864 14.809 1.00 0.00 H new ATOM 0 HE ARG A 123 -11.354 3.594 15.218 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -9.262 3.386 18.076 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -10.532 2.592 19.013 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -12.827 2.544 16.439 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -12.472 2.134 18.121 1.00 0.00 H new ATOM 2008 N ASP A 124 -6.300 2.137 12.010 1.00 0.00 N ATOM 2009 CA ASP A 124 -6.497 1.465 10.723 1.00 0.00 C ATOM 2010 C ASP A 124 -5.914 2.337 9.590 1.00 0.00 C ATOM 2011 O ASP A 124 -5.640 3.524 9.785 1.00 0.00 O ATOM 2012 CB ASP A 124 -7.984 1.133 10.486 1.00 0.00 C ATOM 2013 CG ASP A 124 -8.971 2.295 10.743 1.00 0.00 C ATOM 2014 OD1 ASP A 124 -8.746 3.435 10.271 1.00 0.00 O ATOM 2015 OD2 ASP A 124 -10.003 2.050 11.418 1.00 0.00 O ATOM 0 H ASP A 124 -6.093 3.128 11.883 1.00 0.00 H new ATOM 0 HA ASP A 124 -5.965 0.514 10.734 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -8.104 0.797 9.456 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -8.259 0.296 11.128 1.00 0.00 H new ATOM 2020 N HIS A 125 -5.688 1.745 8.413 1.00 0.00 N ATOM 2021 CA HIS A 125 -4.945 2.364 7.309 1.00 0.00 C ATOM 2022 C HIS A 125 -5.878 2.859 6.185 1.00 0.00 C ATOM 2023 O HIS A 125 -5.785 2.409 5.038 1.00 0.00 O ATOM 2024 CB HIS A 125 -3.875 1.390 6.794 1.00 0.00 C ATOM 2025 CG HIS A 125 -2.899 0.874 7.824 1.00 0.00 C ATOM 2026 ND1 HIS A 125 -2.831 -0.419 8.300 1.00 0.00 N ATOM 2027 CD2 HIS A 125 -1.851 1.559 8.375 1.00 0.00 C ATOM 2028 CE1 HIS A 125 -1.771 -0.510 9.122 1.00 0.00 C ATOM 2029 NE2 HIS A 125 -1.137 0.675 9.199 1.00 0.00 N ATOM 0 H HIS A 125 -6.022 0.806 8.196 1.00 0.00 H new ATOM 0 HA HIS A 125 -4.443 3.255 7.687 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -4.378 0.536 6.339 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -3.311 1.886 6.004 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -1.614 2.599 8.206 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -1.471 -1.406 9.646 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -0.304 0.888 9.747 1.00 0.00 H new ATOM 2037 N ASN A 126 -6.824 3.744 6.517 1.00 0.00 N ATOM 2038 CA ASN A 126 -7.809 4.299 5.577 1.00 0.00 C ATOM 2039 C ASN A 126 -8.375 5.674 6.006 1.00 0.00 C ATOM 2040 O ASN A 126 -8.364 6.022 7.189 1.00 0.00 O ATOM 2041 CB ASN A 126 -8.922 3.255 5.339 1.00 0.00 C ATOM 2042 CG ASN A 126 -9.711 2.862 6.575 1.00 0.00 C ATOM 2043 OD1 ASN A 126 -9.276 2.075 7.401 1.00 0.00 O ATOM 2044 ND2 ASN A 126 -10.924 3.344 6.704 1.00 0.00 N ATOM 0 H ASN A 126 -6.930 4.103 7.466 1.00 0.00 H new ATOM 0 HA ASN A 126 -7.296 4.502 4.637 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -9.614 3.648 4.595 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -8.472 2.358 4.913 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -11.504 3.061 7.494 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -11.288 4.001 6.014 1.00 0.00 H new ATOM 2051 N PHE A 127 -8.874 6.453 5.032 1.00 0.00 N ATOM 2052 CA PHE A 127 -9.342 7.843 5.204 1.00 0.00 C ATOM 2053 C PHE A 127 -10.245 8.311 4.042 1.00 0.00 C ATOM 2054 O PHE A 127 -10.220 7.730 2.955 1.00 0.00 O ATOM 2055 CB PHE A 127 -8.135 8.796 5.359 1.00 0.00 C ATOM 2056 CG PHE A 127 -6.994 8.611 4.367 1.00 0.00 C ATOM 2057 CD1 PHE A 127 -7.139 8.996 3.018 1.00 0.00 C ATOM 2058 CD2 PHE A 127 -5.772 8.058 4.800 1.00 0.00 C ATOM 2059 CE1 PHE A 127 -6.078 8.816 2.112 1.00 0.00 C ATOM 2060 CE2 PHE A 127 -4.711 7.882 3.895 1.00 0.00 C ATOM 2061 CZ PHE A 127 -4.863 8.262 2.551 1.00 0.00 C ATOM 0 H PHE A 127 -8.967 6.124 4.071 1.00 0.00 H new ATOM 0 HA PHE A 127 -9.947 7.869 6.110 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -8.496 9.821 5.277 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -7.735 8.679 6.366 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -8.068 9.431 2.679 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -5.650 7.768 5.833 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -6.197 9.104 1.078 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -3.779 7.454 4.233 1.00 0.00 H new ATOM 0 HZ PHE A 127 -4.047 8.129 1.856 1.00 0.00 H new ATOM 2071 N ALA A 128 -11.035 9.372 4.261 1.00 0.00 N ATOM 2072 CA ALA A 128 -11.964 9.934 3.274 1.00 0.00 C ATOM 2073 C ALA A 128 -11.358 11.071 2.422 1.00 0.00 C ATOM 2074 O ALA A 128 -10.532 11.856 2.887 1.00 0.00 O ATOM 2075 CB ALA A 128 -13.235 10.415 3.989 1.00 0.00 C ATOM 0 H ALA A 128 -11.045 9.873 5.149 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.201 9.135 2.571 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.927 10.833 3.258 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.707 9.574 4.497 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.974 11.180 4.720 1.00 0.00 H new ATOM 2081 N LEU A 129 -11.822 11.185 1.175 1.00 0.00 N ATOM 2082 CA LEU A 129 -11.355 12.139 0.156 1.00 0.00 C ATOM 2083 C LEU A 129 -12.284 13.361 0.003 1.00 0.00 C ATOM 2084 O LEU A 129 -13.455 13.308 0.390 1.00 0.00 O ATOM 2085 CB LEU A 129 -11.326 11.427 -1.210 1.00 0.00 C ATOM 2086 CG LEU A 129 -10.555 10.098 -1.323 1.00 0.00 C ATOM 2087 CD1 LEU A 129 -10.767 9.521 -2.722 1.00 0.00 C ATOM 2088 CD2 LEU A 129 -9.063 10.287 -1.098 1.00 0.00 C ATOM 0 H LEU A 129 -12.571 10.586 0.828 1.00 0.00 H new ATOM 0 HA LEU A 129 -10.373 12.486 0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -12.357 11.240 -1.510 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.903 12.120 -1.938 1.00 0.00 H new ATOM 0 HG LEU A 129 -10.933 9.424 -0.555 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -10.225 8.580 -2.813 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -11.830 9.345 -2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -10.397 10.226 -3.466 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.557 9.326 -1.186 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.667 10.976 -1.844 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.894 10.695 -0.102 1.00 0.00 H new ATOM 2100 N LYS A 130 -11.813 14.414 -0.687 1.00 0.00 N ATOM 2101 CA LYS A 130 -12.636 15.583 -1.075 1.00 0.00 C ATOM 2102 C LYS A 130 -13.872 15.260 -1.925 1.00 0.00 C ATOM 2103 O LYS A 130 -14.894 15.932 -1.798 1.00 0.00 O ATOM 2104 CB LYS A 130 -11.779 16.660 -1.769 1.00 0.00 C ATOM 2105 CG LYS A 130 -11.168 16.262 -3.128 1.00 0.00 C ATOM 2106 CD LYS A 130 -10.779 17.495 -3.957 1.00 0.00 C ATOM 2107 CE LYS A 130 -10.162 17.076 -5.297 1.00 0.00 C ATOM 2108 NZ LYS A 130 -9.703 18.260 -6.076 1.00 0.00 N ATOM 0 H LYS A 130 -10.843 14.483 -0.996 1.00 0.00 H new ATOM 0 HA LYS A 130 -13.025 15.966 -0.131 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -12.394 17.548 -1.915 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -10.969 16.941 -1.096 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -10.287 15.641 -2.964 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -11.884 15.659 -3.686 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -11.659 18.113 -4.134 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -10.069 18.105 -3.399 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -9.320 16.407 -5.119 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -10.895 16.518 -5.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -9.291 17.944 -6.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -10.512 18.885 -6.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -8.986 18.778 -5.530 1.00 0.00 H new ATOM 2122 N ASN A 131 -13.784 14.235 -2.779 1.00 0.00 N ATOM 2123 CA ASN A 131 -14.873 13.825 -3.675 1.00 0.00 C ATOM 2124 C ASN A 131 -15.994 13.063 -2.937 1.00 0.00 C ATOM 2125 O ASN A 131 -17.085 12.898 -3.486 1.00 0.00 O ATOM 2126 CB ASN A 131 -14.283 12.989 -4.825 1.00 0.00 C ATOM 2127 CG ASN A 131 -13.271 13.764 -5.653 1.00 0.00 C ATOM 2128 OD1 ASN A 131 -12.070 13.657 -5.455 1.00 0.00 O ATOM 2129 ND2 ASN A 131 -13.720 14.589 -6.573 1.00 0.00 N ATOM 0 H ASN A 131 -12.946 13.660 -2.869 1.00 0.00 H new ATOM 0 HA ASN A 131 -15.344 14.721 -4.079 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -13.806 12.099 -4.414 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -15.091 12.647 -5.472 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -13.065 15.143 -7.125 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.723 14.675 -6.735 1.00 0.00 H new ATOM 2136 N GLY A 132 -15.735 12.625 -1.698 1.00 0.00 N ATOM 2137 CA GLY A 132 -16.720 12.010 -0.807 1.00 0.00 C ATOM 2138 C GLY A 132 -16.638 10.486 -0.713 1.00 0.00 C ATOM 2139 O GLY A 132 -17.671 9.877 -0.468 1.00 0.00 O ATOM 0 H GLY A 132 -14.808 12.692 -1.279 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -16.597 12.429 0.192 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -17.718 12.286 -1.147 1.00 0.00 H new ATOM 2143 N PHE A 133 -15.457 9.872 -0.869 1.00 0.00 N ATOM 2144 CA PHE A 133 -15.240 8.408 -0.823 1.00 0.00 C ATOM 2145 C PHE A 133 -14.088 8.032 0.121 1.00 0.00 C ATOM 2146 O PHE A 133 -13.296 8.902 0.477 1.00 0.00 O ATOM 2147 CB PHE A 133 -14.944 7.880 -2.237 1.00 0.00 C ATOM 2148 CG PHE A 133 -15.965 8.297 -3.274 1.00 0.00 C ATOM 2149 CD1 PHE A 133 -17.175 7.589 -3.399 1.00 0.00 C ATOM 2150 CD2 PHE A 133 -15.724 9.431 -4.072 1.00 0.00 C ATOM 2151 CE1 PHE A 133 -18.159 8.032 -4.300 1.00 0.00 C ATOM 2152 CE2 PHE A 133 -16.713 9.877 -4.968 1.00 0.00 C ATOM 2153 CZ PHE A 133 -17.934 9.187 -5.069 1.00 0.00 C ATOM 0 H PHE A 133 -14.595 10.391 -1.036 1.00 0.00 H new ATOM 0 HA PHE A 133 -16.151 7.949 -0.439 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -13.961 8.233 -2.547 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -14.897 6.791 -2.205 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -17.348 6.705 -2.803 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -14.784 9.957 -3.997 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -19.085 7.486 -4.401 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -16.534 10.750 -5.578 1.00 0.00 H new ATOM 0 HZ PHE A 133 -18.701 9.545 -5.739 1.00 0.00 H new ATOM 2163 N ILE A 134 -13.955 6.756 0.504 1.00 0.00 N ATOM 2164 CA ILE A 134 -12.893 6.269 1.407 1.00 0.00 C ATOM 2165 C ILE A 134 -11.867 5.439 0.618 1.00 0.00 C ATOM 2166 O ILE A 134 -12.222 4.601 -0.215 1.00 0.00 O ATOM 2167 CB ILE A 134 -13.462 5.460 2.605 1.00 0.00 C ATOM 2168 CG1 ILE A 134 -14.490 6.211 3.486 1.00 0.00 C ATOM 2169 CG2 ILE A 134 -12.338 4.932 3.524 1.00 0.00 C ATOM 2170 CD1 ILE A 134 -15.895 6.304 2.875 1.00 0.00 C ATOM 0 H ILE A 134 -14.588 6.019 0.194 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.394 7.141 1.829 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.992 4.640 2.120 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.559 5.710 4.452 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -14.121 7.219 3.676 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -12.776 4.372 4.350 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -11.677 4.280 2.953 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -11.766 5.772 3.919 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -16.553 6.845 3.556 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -15.844 6.833 1.923 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -16.288 5.300 2.712 1.00 0.00 H new ATOM 2182 N ALA A 135 -10.587 5.629 0.937 1.00 0.00 N ATOM 2183 CA ALA A 135 -9.449 4.931 0.342 1.00 0.00 C ATOM 2184 C ALA A 135 -8.563 4.303 1.437 1.00 0.00 C ATOM 2185 O ALA A 135 -8.540 4.800 2.564 1.00 0.00 O ATOM 2186 CB ALA A 135 -8.699 5.939 -0.538 1.00 0.00 C ATOM 0 H ALA A 135 -10.303 6.303 1.648 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.775 4.098 -0.280 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -7.841 5.451 -1.000 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.367 6.311 -1.315 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -8.356 6.773 0.075 1.00 0.00 H new ATOM 2192 N SER A 136 -7.841 3.219 1.128 1.00 0.00 N ATOM 2193 CA SER A 136 -7.035 2.435 2.083 1.00 0.00 C ATOM 2194 C SER A 136 -5.653 2.057 1.512 1.00 0.00 C ATOM 2195 O SER A 136 -5.535 1.759 0.324 1.00 0.00 O ATOM 2196 CB SER A 136 -7.825 1.185 2.496 1.00 0.00 C ATOM 2197 OG SER A 136 -7.104 0.387 3.416 1.00 0.00 O ATOM 0 H SER A 136 -7.798 2.849 0.179 1.00 0.00 H new ATOM 0 HA SER A 136 -6.842 3.053 2.960 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.774 1.485 2.941 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.061 0.595 1.610 1.00 0.00 H new ATOM 0 HG SER A 136 -6.605 0.965 4.030 1.00 0.00 H new ATOM 2203 N ASN A 137 -4.604 2.105 2.351 1.00 0.00 N ATOM 2204 CA ASN A 137 -3.193 1.994 1.926 1.00 0.00 C ATOM 2205 C ASN A 137 -2.841 0.793 1.010 1.00 0.00 C ATOM 2206 O ASN A 137 -3.320 -0.345 1.228 1.00 0.00 O ATOM 2207 CB ASN A 137 -2.243 2.114 3.143 1.00 0.00 C ATOM 2208 CG ASN A 137 -1.946 0.817 3.897 1.00 0.00 C ATOM 2209 OD1 ASN A 137 -2.798 -0.020 4.171 1.00 0.00 O ATOM 2210 ND2 ASN A 137 -0.710 0.622 4.303 1.00 0.00 N ATOM 0 H ASN A 137 -4.711 2.224 3.358 1.00 0.00 H new ATOM 0 HA ASN A 137 -3.036 2.846 1.264 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -1.298 2.535 2.800 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -2.674 2.828 3.845 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -0.474 -0.215 4.836 1.00 0.00 H new ATOM 0 HD22 ASN A 137 0.013 1.308 4.084 1.00 0.00 H new TER 2217 ASN A 137