USER MOD reduce.3.24.130724 H: found=0, std=0, add=594, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 592 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 NoAdj-H: A 143 HIS HD1 : A 143 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 142 GLN : amide:sc= -1.27 K(o=-3.6,f=-9.1!) USER MOD Set 1.2: A 147 MET CE :methyl 164:sc= -2.16 (180deg=-3.1) USER MOD Set 1.3: A 158 TYR OH : rot -12:sc= 0.314 USER MOD Set 1.4: A 164 GLN : amide:sc= -0.5 K(o=-3.6,f=-5.4) USER MOD Single : A 109 SER OG : rot -33:sc= 0.0923 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -1.81 K(o=-1.8,f=-2.5) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 MET CE :methyl -146:sc= -2.53! (180deg=-3.56) USER MOD Single : A 134 CYS SG : rot 30:sc= 0.04 USER MOD Single : A 137 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00705) USER MOD Single : A 139 SER OG : rot -48:sc= 0.101 USER MOD Single : A 152 GLN : amide:sc= 0.174 X(o=0.17,f=0) USER MOD Single : A 153 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 157 THR OG1 : rot 51:sc= 0.0208 USER MOD Single : A 167 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 170 LYS NZ :NH3+ 175:sc= 0.119 (180deg=0.115) USER MOD Single : A 177 GLN : amide:sc= 0.395 K(o=0.39,f=-2.5!) USER MOD Single : A 180 LYS NZ :NH3+ -109:sc= 0.0319 (180deg=-0.513) USER MOD Single : A 183 ASN :FLIP amide:sc=-0.00273 F(o=-0.6,f=-0.0027) USER MOD Single : A 184 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 185 SER OG : rot 57:sc= 1.4 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 109 -13.666 2.452 2.358 1.00 0.00 N ATOM 2 CA SER A 109 -12.190 2.361 2.434 1.00 0.00 C ATOM 3 C SER A 109 -11.781 1.286 3.453 1.00 0.00 C ATOM 4 O SER A 109 -12.330 1.237 4.561 1.00 0.00 O ATOM 5 CB SER A 109 -11.601 3.741 2.809 1.00 0.00 C ATOM 6 OG SER A 109 -12.153 4.235 4.021 1.00 0.00 O ATOM 0 HA SER A 109 -11.792 2.072 1.461 1.00 0.00 H new ATOM 0 HB2 SER A 109 -10.519 3.660 2.908 1.00 0.00 H new ATOM 0 HB3 SER A 109 -11.795 4.451 2.005 1.00 0.00 H new ATOM 0 HG SER A 109 -13.083 3.938 4.102 1.00 0.00 H new ATOM 12 N GLU A 110 -10.828 0.414 3.063 1.00 0.00 N ATOM 13 CA GLU A 110 -10.306 -0.660 3.938 1.00 0.00 C ATOM 14 C GLU A 110 -8.972 -0.228 4.581 1.00 0.00 C ATOM 15 O GLU A 110 -8.218 0.554 3.998 1.00 0.00 O ATOM 16 CB GLU A 110 -10.112 -1.979 3.132 1.00 0.00 C ATOM 17 CG GLU A 110 -11.411 -2.544 2.516 1.00 0.00 C ATOM 18 CD GLU A 110 -11.188 -3.839 1.714 1.00 0.00 C ATOM 19 OE1 GLU A 110 -10.578 -3.776 0.627 1.00 0.00 O ATOM 20 OE2 GLU A 110 -11.616 -4.924 2.166 1.00 0.00 O ATOM 0 H GLU A 110 -10.400 0.433 2.138 1.00 0.00 H new ATOM 0 HA GLU A 110 -11.034 -0.842 4.729 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -9.393 -1.800 2.333 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -9.678 -2.732 3.789 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -12.129 -2.737 3.313 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -11.853 -1.791 1.863 1.00 0.00 H new ATOM 27 N ASP A 111 -8.701 -0.751 5.788 1.00 0.00 N ATOM 28 CA ASP A 111 -7.446 -0.493 6.523 1.00 0.00 C ATOM 29 C ASP A 111 -6.291 -1.305 5.902 1.00 0.00 C ATOM 30 O ASP A 111 -5.188 -0.789 5.708 1.00 0.00 O ATOM 31 CB ASP A 111 -7.643 -0.863 8.019 1.00 0.00 C ATOM 32 CG ASP A 111 -6.401 -0.595 8.895 1.00 0.00 C ATOM 33 OD1 ASP A 111 -6.185 0.568 9.293 1.00 0.00 O ATOM 34 OD2 ASP A 111 -5.640 -1.544 9.195 1.00 0.00 O ATOM 0 H ASP A 111 -9.345 -1.366 6.285 1.00 0.00 H new ATOM 0 HA ASP A 111 -7.190 0.564 6.452 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -8.485 -0.296 8.416 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -7.906 -1.918 8.091 1.00 0.00 H new ATOM 39 N GLY A 112 -6.574 -2.582 5.601 1.00 0.00 N ATOM 40 CA GLY A 112 -5.593 -3.487 4.997 1.00 0.00 C ATOM 41 C GLY A 112 -6.053 -4.933 5.117 1.00 0.00 C ATOM 42 O GLY A 112 -5.385 -5.755 5.753 1.00 0.00 O ATOM 0 H GLY A 112 -7.484 -3.011 5.769 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -5.452 -3.231 3.947 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -4.627 -3.365 5.488 1.00 0.00 H new ATOM 46 N SER A 113 -7.206 -5.234 4.499 1.00 0.00 N ATOM 47 CA SER A 113 -7.881 -6.531 4.634 1.00 0.00 C ATOM 48 C SER A 113 -7.229 -7.605 3.733 1.00 0.00 C ATOM 49 O SER A 113 -7.619 -7.795 2.574 1.00 0.00 O ATOM 50 CB SER A 113 -9.379 -6.356 4.314 1.00 0.00 C ATOM 51 OG SER A 113 -9.949 -5.333 5.113 1.00 0.00 O ATOM 0 H SER A 113 -7.697 -4.580 3.889 1.00 0.00 H new ATOM 0 HA SER A 113 -7.776 -6.883 5.660 1.00 0.00 H new ATOM 0 HB2 SER A 113 -9.504 -6.112 3.259 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.905 -7.295 4.488 1.00 0.00 H new ATOM 0 HG SER A 113 -10.899 -5.237 4.893 1.00 0.00 H new ATOM 57 N TYR A 114 -6.174 -8.239 4.272 1.00 0.00 N ATOM 58 CA TYR A 114 -5.491 -9.387 3.648 1.00 0.00 C ATOM 59 C TYR A 114 -5.317 -10.472 4.724 1.00 0.00 C ATOM 60 O TYR A 114 -4.634 -10.241 5.731 1.00 0.00 O ATOM 61 CB TYR A 114 -4.102 -8.985 3.075 1.00 0.00 C ATOM 62 CG TYR A 114 -4.112 -7.805 2.081 1.00 0.00 C ATOM 63 CD1 TYR A 114 -4.302 -8.007 0.709 1.00 0.00 C ATOM 64 CD2 TYR A 114 -3.930 -6.490 2.520 1.00 0.00 C ATOM 65 CE1 TYR A 114 -4.296 -6.944 -0.178 1.00 0.00 C ATOM 66 CE2 TYR A 114 -3.927 -5.430 1.635 1.00 0.00 C ATOM 67 CZ TYR A 114 -4.114 -5.660 0.291 1.00 0.00 C ATOM 68 OH TYR A 114 -4.104 -4.598 -0.592 1.00 0.00 O ATOM 0 H TYR A 114 -5.765 -7.965 5.166 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.091 -9.753 2.815 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -3.444 -8.732 3.907 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -3.668 -9.853 2.578 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -4.456 -9.009 0.336 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -3.789 -6.299 3.574 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -4.434 -7.120 -1.235 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -3.778 -4.423 1.997 1.00 0.00 H new ATOM 0 HH TYR A 114 -3.966 -3.763 -0.098 1.00 0.00 H new ATOM 78 N GLY A 115 -5.947 -11.631 4.513 1.00 0.00 N ATOM 79 CA GLY A 115 -5.877 -12.739 5.460 1.00 0.00 C ATOM 80 C GLY A 115 -6.542 -13.994 4.919 1.00 0.00 C ATOM 81 O GLY A 115 -7.378 -13.919 4.015 1.00 0.00 O ATOM 0 H GLY A 115 -6.514 -11.824 3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.833 -12.953 5.691 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -6.357 -12.448 6.394 1.00 0.00 H new ATOM 85 N THR A 116 -6.161 -15.154 5.475 1.00 0.00 N ATOM 86 CA THR A 116 -6.736 -16.464 5.116 1.00 0.00 C ATOM 87 C THR A 116 -8.105 -16.681 5.786 1.00 0.00 C ATOM 88 O THR A 116 -8.853 -17.578 5.408 1.00 0.00 O ATOM 89 CB THR A 116 -5.766 -17.617 5.526 1.00 0.00 C ATOM 90 OG1 THR A 116 -5.424 -17.493 6.922 1.00 0.00 O ATOM 91 CG2 THR A 116 -4.486 -17.617 4.676 1.00 0.00 C ATOM 0 H THR A 116 -5.439 -15.212 6.193 1.00 0.00 H new ATOM 0 HA THR A 116 -6.876 -16.474 4.035 1.00 0.00 H new ATOM 0 HB THR A 116 -6.281 -18.562 5.352 1.00 0.00 H new ATOM 0 HG1 THR A 116 -4.817 -18.219 7.176 1.00 0.00 H new ATOM 0 HG21 THR A 116 -3.838 -18.434 4.993 1.00 0.00 H new ATOM 0 HG22 THR A 116 -4.747 -17.747 3.626 1.00 0.00 H new ATOM 0 HG23 THR A 116 -3.963 -16.669 4.805 1.00 0.00 H new ATOM 99 N ASP A 117 -8.410 -15.856 6.801 1.00 0.00 N ATOM 100 CA ASP A 117 -9.668 -15.948 7.566 1.00 0.00 C ATOM 101 C ASP A 117 -10.608 -14.771 7.246 1.00 0.00 C ATOM 102 O ASP A 117 -11.454 -14.396 8.074 1.00 0.00 O ATOM 103 CB ASP A 117 -9.349 -16.039 9.082 1.00 0.00 C ATOM 104 CG ASP A 117 -8.575 -17.324 9.436 1.00 0.00 C ATOM 105 OD1 ASP A 117 -9.221 -18.373 9.650 1.00 0.00 O ATOM 106 OD2 ASP A 117 -7.319 -17.302 9.467 1.00 0.00 O ATOM 0 H ASP A 117 -7.793 -15.107 7.115 1.00 0.00 H new ATOM 0 HA ASP A 117 -10.197 -16.854 7.270 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.764 -15.170 9.382 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -10.279 -16.008 9.650 1.00 0.00 H new ATOM 111 N VAL A 118 -10.476 -14.229 6.019 1.00 0.00 N ATOM 112 CA VAL A 118 -11.417 -13.227 5.471 1.00 0.00 C ATOM 113 C VAL A 118 -12.807 -13.868 5.275 1.00 0.00 C ATOM 114 O VAL A 118 -12.927 -14.908 4.624 1.00 0.00 O ATOM 115 CB VAL A 118 -10.891 -12.612 4.104 1.00 0.00 C ATOM 116 CG1 VAL A 118 -10.466 -13.709 3.088 1.00 0.00 C ATOM 117 CG2 VAL A 118 -11.932 -11.644 3.462 1.00 0.00 C ATOM 0 H VAL A 118 -9.718 -14.471 5.381 1.00 0.00 H new ATOM 0 HA VAL A 118 -11.494 -12.409 6.187 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.002 -12.033 4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -10.114 -13.238 2.170 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -9.665 -14.311 3.517 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -11.320 -14.348 2.864 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -11.532 -11.246 2.529 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -12.856 -12.186 3.259 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -12.137 -10.823 4.149 1.00 0.00 H new ATOM 127 N THR A 119 -13.847 -13.262 5.872 1.00 0.00 N ATOM 128 CA THR A 119 -15.230 -13.720 5.708 1.00 0.00 C ATOM 129 C THR A 119 -15.795 -13.151 4.398 1.00 0.00 C ATOM 130 O THR A 119 -16.291 -12.016 4.352 1.00 0.00 O ATOM 131 CB THR A 119 -16.118 -13.320 6.936 1.00 0.00 C ATOM 132 OG1 THR A 119 -15.568 -13.913 8.127 1.00 0.00 O ATOM 133 CG2 THR A 119 -17.588 -13.776 6.778 1.00 0.00 C ATOM 0 H THR A 119 -13.750 -12.447 6.477 1.00 0.00 H new ATOM 0 HA THR A 119 -15.240 -14.809 5.659 1.00 0.00 H new ATOM 0 HB THR A 119 -16.116 -12.232 7.002 1.00 0.00 H new ATOM 0 HG1 THR A 119 -16.118 -13.665 8.900 1.00 0.00 H new ATOM 0 HG21 THR A 119 -18.159 -13.474 7.656 1.00 0.00 H new ATOM 0 HG22 THR A 119 -18.018 -13.315 5.889 1.00 0.00 H new ATOM 0 HG23 THR A 119 -17.624 -14.861 6.678 1.00 0.00 H new ATOM 141 N ARG A 120 -15.658 -13.939 3.320 1.00 0.00 N ATOM 142 CA ARG A 120 -16.183 -13.572 1.999 1.00 0.00 C ATOM 143 C ARG A 120 -17.329 -14.528 1.656 1.00 0.00 C ATOM 144 O ARG A 120 -17.177 -15.494 0.887 1.00 0.00 O ATOM 145 CB ARG A 120 -15.049 -13.613 0.930 1.00 0.00 C ATOM 146 CG ARG A 120 -15.381 -12.902 -0.397 1.00 0.00 C ATOM 147 CD ARG A 120 -15.578 -11.388 -0.206 1.00 0.00 C ATOM 148 NE ARG A 120 -15.800 -10.689 -1.483 1.00 0.00 N ATOM 149 CZ ARG A 120 -14.915 -9.871 -2.078 1.00 0.00 C ATOM 150 NH1 ARG A 120 -13.714 -9.664 -1.543 1.00 0.00 N ATOM 151 NH2 ARG A 120 -15.239 -9.265 -3.209 1.00 0.00 N ATOM 0 H ARG A 120 -15.183 -14.842 3.340 1.00 0.00 H new ATOM 0 HA ARG A 120 -16.565 -12.551 2.010 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.153 -13.159 1.354 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -14.808 -14.654 0.717 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -14.577 -13.076 -1.112 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -16.286 -13.334 -0.823 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -16.428 -11.215 0.453 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.701 -10.969 0.288 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.694 -10.837 -1.952 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -13.457 -10.128 -0.672 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -13.051 -9.041 -2.004 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -16.157 -9.420 -3.626 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -14.571 -8.643 -3.664 1.00 0.00 H new ATOM 165 N CYS A 121 -18.465 -14.286 2.318 1.00 0.00 N ATOM 166 CA CYS A 121 -19.702 -15.043 2.092 1.00 0.00 C ATOM 167 C CYS A 121 -20.502 -14.439 0.931 1.00 0.00 C ATOM 168 O CYS A 121 -20.410 -13.236 0.669 1.00 0.00 O ATOM 169 CB CYS A 121 -20.549 -15.110 3.378 1.00 0.00 C ATOM 170 SG CYS A 121 -22.000 -16.210 3.259 1.00 0.00 S ATOM 0 H CYS A 121 -18.554 -13.558 3.027 1.00 0.00 H new ATOM 0 HA CYS A 121 -19.433 -16.063 1.819 1.00 0.00 H new ATOM 0 HB2 CYS A 121 -19.917 -15.448 4.199 1.00 0.00 H new ATOM 0 HB3 CYS A 121 -20.888 -14.105 3.629 1.00 0.00 H new ATOM 175 N ILE A 122 -21.311 -15.285 0.262 1.00 0.00 N ATOM 176 CA ILE A 122 -22.096 -14.892 -0.936 1.00 0.00 C ATOM 177 C ILE A 122 -23.231 -13.873 -0.620 1.00 0.00 C ATOM 178 O ILE A 122 -23.799 -13.286 -1.542 1.00 0.00 O ATOM 179 CB ILE A 122 -22.694 -16.143 -1.711 1.00 0.00 C ATOM 180 CG1 ILE A 122 -23.851 -16.871 -0.923 1.00 0.00 C ATOM 181 CG2 ILE A 122 -21.572 -17.139 -2.113 1.00 0.00 C ATOM 182 CD1 ILE A 122 -23.435 -17.672 0.303 1.00 0.00 C ATOM 0 H ILE A 122 -21.442 -16.260 0.533 1.00 0.00 H new ATOM 0 HA ILE A 122 -21.376 -14.395 -1.587 1.00 0.00 H new ATOM 0 HB ILE A 122 -23.150 -15.750 -2.620 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -24.577 -16.120 -0.610 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -24.364 -17.542 -1.612 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -22.009 -17.986 -2.642 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -20.855 -16.637 -2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -21.063 -17.495 -1.217 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -24.316 -18.124 0.758 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -22.737 -18.455 0.006 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -22.953 -17.011 1.023 1.00 0.00 H new ATOM 194 N CYS A 123 -23.565 -13.675 0.685 1.00 0.00 N ATOM 195 CA CYS A 123 -24.568 -12.656 1.106 1.00 0.00 C ATOM 196 C CYS A 123 -23.916 -11.278 1.332 1.00 0.00 C ATOM 197 O CYS A 123 -24.624 -10.272 1.453 1.00 0.00 O ATOM 198 CB CYS A 123 -25.344 -13.102 2.374 1.00 0.00 C ATOM 199 SG CYS A 123 -24.335 -13.295 3.880 1.00 0.00 S ATOM 0 H CYS A 123 -23.158 -14.202 1.458 1.00 0.00 H new ATOM 0 HA CYS A 123 -25.283 -12.564 0.289 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -26.129 -12.373 2.574 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -25.837 -14.051 2.163 1.00 0.00 H new ATOM 204 N GLY A 124 -22.562 -11.249 1.383 1.00 0.00 N ATOM 205 CA GLY A 124 -21.799 -10.012 1.610 1.00 0.00 C ATOM 206 C GLY A 124 -22.019 -9.400 2.992 1.00 0.00 C ATOM 207 O GLY A 124 -21.829 -8.197 3.189 1.00 0.00 O ATOM 0 H GLY A 124 -21.979 -12.078 1.268 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -20.737 -10.221 1.480 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -22.075 -9.281 0.850 1.00 0.00 H new ATOM 211 N PHE A 125 -22.429 -10.245 3.949 1.00 0.00 N ATOM 212 CA PHE A 125 -22.758 -9.836 5.326 1.00 0.00 C ATOM 213 C PHE A 125 -21.926 -10.677 6.302 1.00 0.00 C ATOM 214 O PHE A 125 -21.724 -11.877 6.071 1.00 0.00 O ATOM 215 CB PHE A 125 -24.288 -10.005 5.585 1.00 0.00 C ATOM 216 CG PHE A 125 -24.761 -9.577 6.984 1.00 0.00 C ATOM 217 CD1 PHE A 125 -24.480 -8.299 7.471 1.00 0.00 C ATOM 218 CD2 PHE A 125 -25.448 -10.461 7.816 1.00 0.00 C ATOM 219 CE1 PHE A 125 -24.887 -7.915 8.735 1.00 0.00 C ATOM 220 CE2 PHE A 125 -25.851 -10.076 9.082 1.00 0.00 C ATOM 221 CZ PHE A 125 -25.563 -8.806 9.546 1.00 0.00 C ATOM 0 H PHE A 125 -22.544 -11.246 3.788 1.00 0.00 H new ATOM 0 HA PHE A 125 -22.516 -8.784 5.475 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -24.834 -9.425 4.840 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -24.554 -11.051 5.432 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -23.937 -7.601 6.851 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -25.668 -11.459 7.467 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -24.676 -6.917 9.089 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -26.392 -10.769 9.709 1.00 0.00 H new ATOM 0 HZ PHE A 125 -25.866 -8.511 10.540 1.00 0.00 H new ATOM 231 N THR A 126 -21.439 -10.032 7.369 1.00 0.00 N ATOM 232 CA THR A 126 -20.634 -10.680 8.420 1.00 0.00 C ATOM 233 C THR A 126 -21.545 -11.443 9.401 1.00 0.00 C ATOM 234 O THR A 126 -22.766 -11.249 9.396 1.00 0.00 O ATOM 235 CB THR A 126 -19.784 -9.607 9.175 1.00 0.00 C ATOM 236 OG1 THR A 126 -20.643 -8.565 9.677 1.00 0.00 O ATOM 237 CG2 THR A 126 -18.703 -8.991 8.261 1.00 0.00 C ATOM 0 H THR A 126 -21.592 -9.037 7.532 1.00 0.00 H new ATOM 0 HA THR A 126 -19.958 -11.399 7.957 1.00 0.00 H new ATOM 0 HB THR A 126 -19.282 -10.105 10.005 1.00 0.00 H new ATOM 0 HG1 THR A 126 -20.105 -7.897 10.150 1.00 0.00 H new ATOM 0 HG21 THR A 126 -18.133 -8.250 8.821 1.00 0.00 H new ATOM 0 HG22 THR A 126 -18.033 -9.776 7.910 1.00 0.00 H new ATOM 0 HG23 THR A 126 -19.180 -8.512 7.406 1.00 0.00 H new ATOM 245 N HIS A 127 -20.952 -12.294 10.260 1.00 0.00 N ATOM 246 CA HIS A 127 -21.737 -13.195 11.131 1.00 0.00 C ATOM 247 C HIS A 127 -21.917 -12.611 12.537 1.00 0.00 C ATOM 248 O HIS A 127 -21.020 -11.958 13.085 1.00 0.00 O ATOM 249 CB HIS A 127 -21.083 -14.608 11.219 1.00 0.00 C ATOM 250 CG HIS A 127 -19.871 -14.723 12.110 1.00 0.00 C ATOM 251 ND1 HIS A 127 -18.625 -14.203 11.815 1.00 0.00 N ATOM 252 CD2 HIS A 127 -19.738 -15.331 13.316 1.00 0.00 C ATOM 253 CE1 HIS A 127 -17.801 -14.505 12.828 1.00 0.00 C ATOM 254 NE2 HIS A 127 -18.431 -15.189 13.763 1.00 0.00 N ATOM 0 H HIS A 127 -19.941 -12.378 10.371 1.00 0.00 H new ATOM 0 HA HIS A 127 -22.722 -13.295 10.676 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -21.836 -15.313 11.571 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -20.800 -14.919 10.213 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -20.526 -15.845 13.846 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -16.759 -14.225 12.873 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -18.039 -15.542 14.636 1.00 0.00 H new ATOM 262 N ASP A 128 -23.099 -12.838 13.086 1.00 0.00 N ATOM 263 CA ASP A 128 -23.382 -12.729 14.524 1.00 0.00 C ATOM 264 C ASP A 128 -23.824 -14.110 15.051 1.00 0.00 C ATOM 265 O ASP A 128 -24.155 -14.268 16.229 1.00 0.00 O ATOM 266 CB ASP A 128 -24.473 -11.649 14.768 1.00 0.00 C ATOM 267 CG ASP A 128 -25.828 -11.955 14.089 1.00 0.00 C ATOM 268 OD1 ASP A 128 -25.899 -11.935 12.838 1.00 0.00 O ATOM 269 OD2 ASP A 128 -26.826 -12.228 14.796 1.00 0.00 O ATOM 0 H ASP A 128 -23.915 -13.111 12.538 1.00 0.00 H new ATOM 0 HA ASP A 128 -22.487 -12.420 15.064 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -24.632 -11.545 15.841 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -24.106 -10.689 14.405 1.00 0.00 H new ATOM 274 N ASP A 129 -23.803 -15.110 14.143 1.00 0.00 N ATOM 275 CA ASP A 129 -24.281 -16.478 14.399 1.00 0.00 C ATOM 276 C ASP A 129 -23.251 -17.293 15.207 1.00 0.00 C ATOM 277 O ASP A 129 -23.526 -17.708 16.336 1.00 0.00 O ATOM 278 CB ASP A 129 -24.595 -17.176 13.046 1.00 0.00 C ATOM 279 CG ASP A 129 -25.071 -18.635 13.196 1.00 0.00 C ATOM 280 OD1 ASP A 129 -26.094 -18.871 13.873 1.00 0.00 O ATOM 281 OD2 ASP A 129 -24.437 -19.551 12.644 1.00 0.00 O ATOM 0 H ASP A 129 -23.446 -14.982 13.196 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.190 -16.423 14.997 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -25.362 -16.605 12.522 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.702 -17.157 12.422 1.00 0.00 H new ATOM 286 N GLY A 130 -22.080 -17.547 14.598 1.00 0.00 N ATOM 287 CA GLY A 130 -20.987 -18.277 15.254 1.00 0.00 C ATOM 288 C GLY A 130 -20.641 -19.574 14.533 1.00 0.00 C ATOM 289 O GLY A 130 -19.481 -20.006 14.532 1.00 0.00 O ATOM 0 H GLY A 130 -21.868 -17.254 13.644 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.103 -17.641 15.297 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.269 -18.500 16.283 1.00 0.00 H new ATOM 293 N TYR A 131 -21.662 -20.180 13.895 1.00 0.00 N ATOM 294 CA TYR A 131 -21.538 -21.475 13.210 1.00 0.00 C ATOM 295 C TYR A 131 -21.252 -21.208 11.735 1.00 0.00 C ATOM 296 O TYR A 131 -22.155 -20.850 10.959 1.00 0.00 O ATOM 297 CB TYR A 131 -22.824 -22.337 13.394 1.00 0.00 C ATOM 298 CG TYR A 131 -23.080 -22.794 14.843 1.00 0.00 C ATOM 299 CD1 TYR A 131 -23.384 -21.872 15.846 1.00 0.00 C ATOM 300 CD2 TYR A 131 -23.014 -24.142 15.200 1.00 0.00 C ATOM 301 CE1 TYR A 131 -23.601 -22.273 17.149 1.00 0.00 C ATOM 302 CE2 TYR A 131 -23.234 -24.546 16.503 1.00 0.00 C ATOM 303 CZ TYR A 131 -23.528 -23.610 17.472 1.00 0.00 C ATOM 304 OH TYR A 131 -23.749 -24.010 18.774 1.00 0.00 O ATOM 0 H TYR A 131 -22.599 -19.780 13.842 1.00 0.00 H new ATOM 0 HA TYR A 131 -20.718 -22.046 13.645 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -23.684 -21.763 13.049 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -22.751 -23.217 12.755 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -23.451 -20.823 15.597 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -22.787 -24.881 14.446 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -23.827 -21.542 17.911 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -23.176 -25.593 16.762 1.00 0.00 H new ATOM 0 HH TYR A 131 -23.662 -24.984 18.836 1.00 0.00 H new ATOM 314 N MET A 132 -19.978 -21.335 11.360 1.00 0.00 N ATOM 315 CA MET A 132 -19.487 -20.994 10.018 1.00 0.00 C ATOM 316 C MET A 132 -18.622 -22.125 9.458 1.00 0.00 C ATOM 317 O MET A 132 -18.313 -23.098 10.146 1.00 0.00 O ATOM 318 CB MET A 132 -18.654 -19.689 10.057 1.00 0.00 C ATOM 319 CG MET A 132 -19.357 -18.465 10.651 1.00 0.00 C ATOM 320 SD MET A 132 -18.424 -16.955 10.352 1.00 0.00 S ATOM 321 CE MET A 132 -18.562 -16.834 8.577 1.00 0.00 C ATOM 0 H MET A 132 -19.249 -21.681 11.984 1.00 0.00 H new ATOM 0 HA MET A 132 -20.353 -20.849 9.373 1.00 0.00 H new ATOM 0 HB2 MET A 132 -17.747 -19.877 10.631 1.00 0.00 H new ATOM 0 HB3 MET A 132 -18.344 -19.448 9.040 1.00 0.00 H new ATOM 0 HG2 MET A 132 -20.352 -18.370 10.217 1.00 0.00 H new ATOM 0 HG3 MET A 132 -19.489 -18.605 11.724 1.00 0.00 H new ATOM 0 HE1 MET A 132 -17.648 -16.402 8.170 1.00 0.00 H new ATOM 0 HE2 MET A 132 -18.713 -17.828 8.155 1.00 0.00 H new ATOM 0 HE3 MET A 132 -19.409 -16.198 8.320 1.00 0.00 H new ATOM 331 N ILE A 133 -18.226 -21.965 8.190 1.00 0.00 N ATOM 332 CA ILE A 133 -17.288 -22.859 7.494 1.00 0.00 C ATOM 333 C ILE A 133 -16.364 -22.011 6.619 1.00 0.00 C ATOM 334 O ILE A 133 -16.636 -20.836 6.378 1.00 0.00 O ATOM 335 CB ILE A 133 -18.003 -23.949 6.593 1.00 0.00 C ATOM 336 CG1 ILE A 133 -18.955 -23.314 5.519 1.00 0.00 C ATOM 337 CG2 ILE A 133 -18.742 -24.994 7.447 1.00 0.00 C ATOM 338 CD1 ILE A 133 -20.295 -22.800 6.000 1.00 0.00 C ATOM 0 H ILE A 133 -18.554 -21.196 7.606 1.00 0.00 H new ATOM 0 HA ILE A 133 -16.733 -23.402 8.259 1.00 0.00 H new ATOM 0 HB ILE A 133 -17.212 -24.463 6.047 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -18.426 -22.487 5.046 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -19.137 -24.060 4.746 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -19.220 -25.725 6.795 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -18.030 -25.500 8.099 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -19.500 -24.498 8.053 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -20.851 -22.388 5.157 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -20.861 -23.619 6.443 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -20.139 -22.022 6.747 1.00 0.00 H new ATOM 350 N CYS A 134 -15.271 -22.608 6.152 1.00 0.00 N ATOM 351 CA CYS A 134 -14.325 -21.955 5.238 1.00 0.00 C ATOM 352 C CYS A 134 -14.178 -22.802 3.966 1.00 0.00 C ATOM 353 O CYS A 134 -13.962 -24.017 4.056 1.00 0.00 O ATOM 354 CB CYS A 134 -12.957 -21.768 5.938 1.00 0.00 C ATOM 355 SG CYS A 134 -12.251 -23.293 6.593 1.00 0.00 S ATOM 0 H CYS A 134 -15.011 -23.564 6.396 1.00 0.00 H new ATOM 0 HA CYS A 134 -14.702 -20.970 4.961 1.00 0.00 H new ATOM 0 HB2 CYS A 134 -12.255 -21.330 5.229 1.00 0.00 H new ATOM 0 HB3 CYS A 134 -13.073 -21.054 6.754 1.00 0.00 H new ATOM 0 HG CYS A 134 -12.645 -24.299 5.870 1.00 0.00 H new ATOM 361 N CYS A 135 -14.355 -22.172 2.778 1.00 0.00 N ATOM 362 CA CYS A 135 -14.080 -22.827 1.484 1.00 0.00 C ATOM 363 C CYS A 135 -12.580 -23.099 1.418 1.00 0.00 C ATOM 364 O CYS A 135 -11.835 -22.165 1.204 1.00 0.00 O ATOM 365 CB CYS A 135 -14.539 -21.958 0.277 1.00 0.00 C ATOM 366 SG CYS A 135 -14.644 -22.896 -1.291 1.00 0.00 S ATOM 0 H CYS A 135 -14.687 -21.211 2.694 1.00 0.00 H new ATOM 0 HA CYS A 135 -14.646 -23.756 1.419 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -15.514 -21.525 0.500 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -13.844 -21.128 0.150 1.00 0.00 H new ATOM 371 N ASP A 136 -12.183 -24.371 1.643 1.00 0.00 N ATOM 372 CA ASP A 136 -10.774 -24.790 1.864 1.00 0.00 C ATOM 373 C ASP A 136 -9.787 -24.162 0.855 1.00 0.00 C ATOM 374 O ASP A 136 -8.826 -23.481 1.239 1.00 0.00 O ATOM 375 CB ASP A 136 -10.687 -26.345 1.804 1.00 0.00 C ATOM 376 CG ASP A 136 -9.243 -26.892 1.811 1.00 0.00 C ATOM 377 OD1 ASP A 136 -8.578 -26.842 2.867 1.00 0.00 O ATOM 378 OD2 ASP A 136 -8.759 -27.342 0.752 1.00 0.00 O ATOM 0 H ASP A 136 -12.840 -25.150 1.677 1.00 0.00 H new ATOM 0 HA ASP A 136 -10.477 -24.428 2.848 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -11.227 -26.762 2.654 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -11.192 -26.693 0.903 1.00 0.00 H new ATOM 383 N LYS A 137 -10.082 -24.363 -0.431 1.00 0.00 N ATOM 384 CA LYS A 137 -9.211 -23.971 -1.551 1.00 0.00 C ATOM 385 C LYS A 137 -9.193 -22.424 -1.759 1.00 0.00 C ATOM 386 O LYS A 137 -8.154 -21.851 -2.104 1.00 0.00 O ATOM 387 CB LYS A 137 -9.695 -24.744 -2.807 1.00 0.00 C ATOM 388 CG LYS A 137 -8.870 -24.562 -4.095 1.00 0.00 C ATOM 389 CD LYS A 137 -9.545 -25.244 -5.318 1.00 0.00 C ATOM 390 CE LYS A 137 -9.740 -26.764 -5.135 1.00 0.00 C ATOM 391 NZ LYS A 137 -8.463 -27.488 -4.901 1.00 0.00 N ATOM 0 H LYS A 137 -10.947 -24.810 -0.733 1.00 0.00 H new ATOM 0 HA LYS A 137 -8.175 -24.234 -1.340 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -9.717 -25.806 -2.565 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -10.722 -24.444 -3.016 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -8.743 -23.498 -4.297 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -7.874 -24.980 -3.950 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -10.514 -24.779 -5.496 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -8.938 -25.066 -6.206 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -10.411 -26.940 -4.294 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -10.226 -27.172 -6.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -8.652 -28.507 -4.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -7.817 -27.318 -5.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -8.026 -27.145 -4.022 1.00 0.00 H new ATOM 405 N CYS A 138 -10.353 -21.760 -1.523 1.00 0.00 N ATOM 406 CA CYS A 138 -10.487 -20.271 -1.587 1.00 0.00 C ATOM 407 C CYS A 138 -9.850 -19.597 -0.359 1.00 0.00 C ATOM 408 O CYS A 138 -9.346 -18.470 -0.451 1.00 0.00 O ATOM 409 CB CYS A 138 -11.978 -19.830 -1.663 1.00 0.00 C ATOM 410 SG CYS A 138 -12.777 -20.103 -3.265 1.00 0.00 S ATOM 0 H CYS A 138 -11.223 -22.235 -1.283 1.00 0.00 H new ATOM 0 HA CYS A 138 -9.967 -19.958 -2.493 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -12.539 -20.367 -0.898 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -12.040 -18.769 -1.419 1.00 0.00 H new ATOM 415 N SER A 139 -9.927 -20.306 0.781 1.00 0.00 N ATOM 416 CA SER A 139 -9.506 -19.822 2.107 1.00 0.00 C ATOM 417 C SER A 139 -10.318 -18.560 2.505 1.00 0.00 C ATOM 418 O SER A 139 -9.755 -17.518 2.858 1.00 0.00 O ATOM 419 CB SER A 139 -7.969 -19.594 2.143 1.00 0.00 C ATOM 420 OG SER A 139 -7.482 -19.446 3.469 1.00 0.00 O ATOM 0 H SER A 139 -10.294 -21.257 0.806 1.00 0.00 H new ATOM 0 HA SER A 139 -9.723 -20.583 2.856 1.00 0.00 H new ATOM 0 HB2 SER A 139 -7.467 -20.435 1.665 1.00 0.00 H new ATOM 0 HB3 SER A 139 -7.721 -18.704 1.565 1.00 0.00 H new ATOM 0 HG SER A 139 -8.042 -18.805 3.954 1.00 0.00 H new ATOM 426 N VAL A 140 -11.666 -18.661 2.387 1.00 0.00 N ATOM 427 CA VAL A 140 -12.614 -17.593 2.804 1.00 0.00 C ATOM 428 C VAL A 140 -13.789 -18.224 3.585 1.00 0.00 C ATOM 429 O VAL A 140 -14.156 -19.375 3.333 1.00 0.00 O ATOM 430 CB VAL A 140 -13.184 -16.757 1.581 1.00 0.00 C ATOM 431 CG1 VAL A 140 -12.059 -16.158 0.700 1.00 0.00 C ATOM 432 CG2 VAL A 140 -14.168 -17.581 0.714 1.00 0.00 C ATOM 0 H VAL A 140 -12.128 -19.484 2.000 1.00 0.00 H new ATOM 0 HA VAL A 140 -12.057 -16.900 3.434 1.00 0.00 H new ATOM 0 HB VAL A 140 -13.738 -15.929 2.022 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -12.501 -15.596 -0.122 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -11.440 -15.493 1.303 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -11.443 -16.963 0.299 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.530 -16.966 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -13.656 -18.456 0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -15.011 -17.902 1.326 1.00 0.00 H new ATOM 442 N TRP A 141 -14.387 -17.458 4.515 1.00 0.00 N ATOM 443 CA TRP A 141 -15.461 -17.952 5.403 1.00 0.00 C ATOM 444 C TRP A 141 -16.865 -17.587 4.873 1.00 0.00 C ATOM 445 O TRP A 141 -17.122 -16.448 4.449 1.00 0.00 O ATOM 446 CB TRP A 141 -15.258 -17.413 6.847 1.00 0.00 C ATOM 447 CG TRP A 141 -14.066 -18.020 7.549 1.00 0.00 C ATOM 448 CD1 TRP A 141 -12.753 -17.745 7.328 1.00 0.00 C ATOM 449 CD2 TRP A 141 -14.094 -19.025 8.573 1.00 0.00 C ATOM 450 NE1 TRP A 141 -11.964 -18.505 8.154 1.00 0.00 N ATOM 451 CE2 TRP A 141 -12.762 -19.298 8.928 1.00 0.00 C ATOM 452 CE3 TRP A 141 -15.118 -19.707 9.228 1.00 0.00 C ATOM 453 CZ2 TRP A 141 -12.427 -20.234 9.901 1.00 0.00 C ATOM 454 CZ3 TRP A 141 -14.791 -20.635 10.196 1.00 0.00 C ATOM 455 CH2 TRP A 141 -13.453 -20.896 10.524 1.00 0.00 C ATOM 0 H TRP A 141 -14.142 -16.481 4.674 1.00 0.00 H new ATOM 0 HA TRP A 141 -15.399 -19.040 5.421 1.00 0.00 H new ATOM 0 HB2 TRP A 141 -15.136 -16.330 6.810 1.00 0.00 H new ATOM 0 HB3 TRP A 141 -16.156 -17.613 7.432 1.00 0.00 H new ATOM 0 HD1 TRP A 141 -12.384 -17.031 6.606 1.00 0.00 H new ATOM 0 HE1 TRP A 141 -10.945 -18.481 8.185 1.00 0.00 H new ATOM 0 HE3 TRP A 141 -16.151 -19.512 8.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 -11.396 -20.432 10.156 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 -15.578 -21.168 10.709 1.00 0.00 H new ATOM 0 HH2 TRP A 141 -13.227 -21.632 11.281 1.00 0.00 H new ATOM 466 N GLN A 142 -17.762 -18.594 4.904 1.00 0.00 N ATOM 467 CA GLN A 142 -19.172 -18.500 4.486 1.00 0.00 C ATOM 468 C GLN A 142 -20.082 -19.024 5.618 1.00 0.00 C ATOM 469 O GLN A 142 -19.602 -19.631 6.582 1.00 0.00 O ATOM 470 CB GLN A 142 -19.378 -19.297 3.151 1.00 0.00 C ATOM 471 CG GLN A 142 -18.705 -18.642 1.917 1.00 0.00 C ATOM 472 CD GLN A 142 -18.692 -19.494 0.645 1.00 0.00 C ATOM 473 OE1 GLN A 142 -17.727 -20.212 0.371 1.00 0.00 O ATOM 474 NE2 GLN A 142 -19.777 -19.452 -0.121 1.00 0.00 N ATOM 0 H GLN A 142 -17.514 -19.527 5.233 1.00 0.00 H new ATOM 0 HA GLN A 142 -19.441 -17.461 4.297 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -18.982 -20.305 3.276 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -20.447 -19.396 2.960 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -19.217 -17.704 1.700 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -17.676 -18.391 2.176 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -20.558 -18.847 0.134 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -19.829 -20.024 -0.964 1.00 0.00 H new ATOM 483 N HIS A 143 -21.402 -18.767 5.504 1.00 0.00 N ATOM 484 CA HIS A 143 -22.397 -19.181 6.528 1.00 0.00 C ATOM 485 C HIS A 143 -23.045 -20.522 6.133 1.00 0.00 C ATOM 486 O HIS A 143 -23.356 -20.737 4.948 1.00 0.00 O ATOM 487 CB HIS A 143 -23.491 -18.097 6.704 1.00 0.00 C ATOM 488 CG HIS A 143 -22.989 -16.745 7.164 1.00 0.00 C ATOM 489 ND1 HIS A 143 -23.317 -15.586 6.486 1.00 0.00 N ATOM 490 CD2 HIS A 143 -22.224 -16.426 8.233 1.00 0.00 C ATOM 491 CE1 HIS A 143 -22.750 -14.610 7.159 1.00 0.00 C ATOM 492 NE2 HIS A 143 -22.078 -15.068 8.216 1.00 0.00 N ATOM 0 H HIS A 143 -21.810 -18.272 4.710 1.00 0.00 H new ATOM 0 HA HIS A 143 -21.875 -19.304 7.477 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -24.011 -17.970 5.754 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -24.226 -18.458 7.424 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -21.810 -17.111 8.958 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -22.820 -13.566 6.890 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -21.552 -14.508 8.887 1.00 0.00 H new ATOM 499 N ILE A 144 -23.262 -21.398 7.139 1.00 0.00 N ATOM 500 CA ILE A 144 -23.831 -22.754 6.945 1.00 0.00 C ATOM 501 C ILE A 144 -25.271 -22.668 6.387 1.00 0.00 C ATOM 502 O ILE A 144 -25.619 -23.338 5.403 1.00 0.00 O ATOM 503 CB ILE A 144 -23.817 -23.558 8.306 1.00 0.00 C ATOM 504 CG1 ILE A 144 -22.374 -23.611 8.899 1.00 0.00 C ATOM 505 CG2 ILE A 144 -24.381 -24.987 8.136 1.00 0.00 C ATOM 506 CD1 ILE A 144 -22.258 -24.313 10.238 1.00 0.00 C ATOM 0 H ILE A 144 -23.047 -21.185 8.113 1.00 0.00 H new ATOM 0 HA ILE A 144 -23.213 -23.284 6.220 1.00 0.00 H new ATOM 0 HB ILE A 144 -24.466 -23.028 9.003 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -21.722 -24.113 8.185 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -22.004 -22.591 9.007 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -24.354 -25.505 9.094 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -25.411 -24.932 7.782 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -23.777 -25.533 7.411 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -21.219 -24.299 10.568 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -22.879 -23.800 10.973 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -22.592 -25.346 10.138 1.00 0.00 H new ATOM 518 N ASP A 145 -26.068 -21.794 7.026 1.00 0.00 N ATOM 519 CA ASP A 145 -27.482 -21.536 6.672 1.00 0.00 C ATOM 520 C ASP A 145 -27.618 -20.979 5.233 1.00 0.00 C ATOM 521 O ASP A 145 -28.547 -21.336 4.500 1.00 0.00 O ATOM 522 CB ASP A 145 -28.104 -20.543 7.694 1.00 0.00 C ATOM 523 CG ASP A 145 -27.409 -19.169 7.694 1.00 0.00 C ATOM 524 OD1 ASP A 145 -26.338 -19.029 8.320 1.00 0.00 O ATOM 525 OD2 ASP A 145 -27.909 -18.231 7.036 1.00 0.00 O ATOM 0 H ASP A 145 -25.746 -21.236 7.817 1.00 0.00 H new ATOM 0 HA ASP A 145 -28.019 -22.484 6.709 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -29.161 -20.410 7.466 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -28.046 -20.974 8.693 1.00 0.00 H new ATOM 530 N CYS A 146 -26.655 -20.110 4.853 1.00 0.00 N ATOM 531 CA CYS A 146 -26.593 -19.486 3.516 1.00 0.00 C ATOM 532 C CYS A 146 -26.464 -20.542 2.418 1.00 0.00 C ATOM 533 O CYS A 146 -27.171 -20.496 1.405 1.00 0.00 O ATOM 534 CB CYS A 146 -25.408 -18.496 3.423 1.00 0.00 C ATOM 535 SG CYS A 146 -25.708 -16.903 4.223 1.00 0.00 S ATOM 0 H CYS A 146 -25.896 -19.821 5.470 1.00 0.00 H new ATOM 0 HA CYS A 146 -27.525 -18.940 3.369 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -24.529 -18.956 3.874 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -25.175 -18.324 2.372 1.00 0.00 H new ATOM 540 N MET A 147 -25.562 -21.504 2.644 1.00 0.00 N ATOM 541 CA MET A 147 -25.271 -22.558 1.660 1.00 0.00 C ATOM 542 C MET A 147 -26.345 -23.680 1.680 1.00 0.00 C ATOM 543 O MET A 147 -26.269 -24.630 0.893 1.00 0.00 O ATOM 544 CB MET A 147 -23.863 -23.138 1.953 1.00 0.00 C ATOM 545 CG MET A 147 -23.171 -23.732 0.732 1.00 0.00 C ATOM 546 SD MET A 147 -22.778 -22.448 -0.472 1.00 0.00 S ATOM 547 CE MET A 147 -21.538 -23.264 -1.460 1.00 0.00 C ATOM 0 H MET A 147 -25.018 -21.576 3.504 1.00 0.00 H new ATOM 0 HA MET A 147 -25.292 -22.122 0.661 1.00 0.00 H new ATOM 0 HB2 MET A 147 -23.235 -22.349 2.366 1.00 0.00 H new ATOM 0 HB3 MET A 147 -23.951 -23.909 2.719 1.00 0.00 H new ATOM 0 HG2 MET A 147 -22.257 -24.241 1.038 1.00 0.00 H new ATOM 0 HG3 MET A 147 -23.815 -24.482 0.273 1.00 0.00 H new ATOM 0 HE1 MET A 147 -21.405 -22.723 -2.397 1.00 0.00 H new ATOM 0 HE2 MET A 147 -20.594 -23.285 -0.915 1.00 0.00 H new ATOM 0 HE3 MET A 147 -21.856 -24.285 -1.673 1.00 0.00 H new ATOM 557 N GLY A 148 -27.335 -23.549 2.592 1.00 0.00 N ATOM 558 CA GLY A 148 -28.386 -24.555 2.777 1.00 0.00 C ATOM 559 C GLY A 148 -27.868 -25.851 3.396 1.00 0.00 C ATOM 560 O GLY A 148 -28.574 -26.863 3.407 1.00 0.00 O ATOM 0 H GLY A 148 -27.421 -22.745 3.213 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -29.169 -24.142 3.413 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -28.843 -24.777 1.813 1.00 0.00 H new ATOM 564 N ILE A 149 -26.630 -25.808 3.924 1.00 0.00 N ATOM 565 CA ILE A 149 -25.969 -26.964 4.552 1.00 0.00 C ATOM 566 C ILE A 149 -26.520 -27.128 5.979 1.00 0.00 C ATOM 567 O ILE A 149 -26.906 -26.140 6.613 1.00 0.00 O ATOM 568 CB ILE A 149 -24.394 -26.776 4.549 1.00 0.00 C ATOM 569 CG1 ILE A 149 -23.851 -26.825 3.081 1.00 0.00 C ATOM 570 CG2 ILE A 149 -23.658 -27.807 5.444 1.00 0.00 C ATOM 571 CD1 ILE A 149 -22.339 -26.743 2.949 1.00 0.00 C ATOM 0 H ILE A 149 -26.058 -24.964 3.926 1.00 0.00 H new ATOM 0 HA ILE A 149 -26.180 -27.870 3.984 1.00 0.00 H new ATOM 0 HB ILE A 149 -24.188 -25.796 4.980 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -24.191 -27.750 2.615 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -24.294 -26.003 2.519 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -22.584 -27.626 5.400 1.00 0.00 H new ATOM 0 HG22 ILE A 149 -24.001 -27.705 6.474 1.00 0.00 H new ATOM 0 HG23 ILE A 149 -23.871 -28.815 5.088 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -22.063 -26.785 1.895 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -21.986 -25.806 3.379 1.00 0.00 H new ATOM 0 HD13 ILE A 149 -21.882 -27.580 3.477 1.00 0.00 H new ATOM 583 N ASP A 150 -26.586 -28.378 6.456 1.00 0.00 N ATOM 584 CA ASP A 150 -27.074 -28.679 7.810 1.00 0.00 C ATOM 585 C ASP A 150 -25.925 -28.509 8.809 1.00 0.00 C ATOM 586 O ASP A 150 -24.785 -28.846 8.494 1.00 0.00 O ATOM 587 CB ASP A 150 -27.641 -30.121 7.880 1.00 0.00 C ATOM 588 CG ASP A 150 -28.614 -30.304 9.054 1.00 0.00 C ATOM 589 OD1 ASP A 150 -29.770 -29.855 8.948 1.00 0.00 O ATOM 590 OD2 ASP A 150 -28.221 -30.836 10.092 1.00 0.00 O ATOM 0 H ASP A 150 -26.306 -29.201 5.922 1.00 0.00 H new ATOM 0 HA ASP A 150 -27.879 -27.989 8.061 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -28.153 -30.354 6.946 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -26.818 -30.829 7.978 1.00 0.00 H new ATOM 595 N ARG A 151 -26.228 -27.994 10.009 1.00 0.00 N ATOM 596 CA ARG A 151 -25.212 -27.778 11.062 1.00 0.00 C ATOM 597 C ARG A 151 -24.744 -29.119 11.676 1.00 0.00 C ATOM 598 O ARG A 151 -23.723 -29.161 12.362 1.00 0.00 O ATOM 599 CB ARG A 151 -25.761 -26.812 12.144 1.00 0.00 C ATOM 600 CG ARG A 151 -26.181 -25.432 11.589 1.00 0.00 C ATOM 601 CD ARG A 151 -26.779 -24.505 12.658 1.00 0.00 C ATOM 602 NE ARG A 151 -27.229 -23.228 12.070 1.00 0.00 N ATOM 603 CZ ARG A 151 -26.891 -21.999 12.508 1.00 0.00 C ATOM 604 NH1 ARG A 151 -26.164 -21.842 13.603 1.00 0.00 N ATOM 605 NH2 ARG A 151 -27.309 -20.926 11.860 1.00 0.00 N ATOM 0 H ARG A 151 -27.171 -27.717 10.280 1.00 0.00 H new ATOM 0 HA ARG A 151 -24.336 -27.315 10.608 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -26.620 -27.275 12.630 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -25.000 -26.669 12.911 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -25.313 -24.948 11.142 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -26.911 -25.575 10.792 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -27.620 -25.001 13.143 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -26.035 -24.310 13.431 1.00 0.00 H new ATOM 0 HE ARG A 151 -27.850 -23.280 11.262 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -25.851 -22.658 14.129 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -25.917 -20.905 13.921 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -27.889 -21.027 11.027 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -27.052 -19.997 12.193 1.00 0.00 H new ATOM 619 N GLN A 152 -25.510 -30.205 11.442 1.00 0.00 N ATOM 620 CA GLN A 152 -25.091 -31.577 11.807 1.00 0.00 C ATOM 621 C GLN A 152 -24.267 -32.210 10.669 1.00 0.00 C ATOM 622 O GLN A 152 -23.289 -32.929 10.921 1.00 0.00 O ATOM 623 CB GLN A 152 -26.332 -32.468 12.095 1.00 0.00 C ATOM 624 CG GLN A 152 -27.333 -31.874 13.107 1.00 0.00 C ATOM 625 CD GLN A 152 -28.630 -32.687 13.222 1.00 0.00 C ATOM 626 OE1 GLN A 152 -28.751 -33.578 14.060 1.00 0.00 O ATOM 627 NE2 GLN A 152 -29.595 -32.407 12.352 1.00 0.00 N ATOM 0 H GLN A 152 -26.428 -30.158 10.999 1.00 0.00 H new ATOM 0 HA GLN A 152 -24.477 -31.513 12.705 1.00 0.00 H new ATOM 0 HB2 GLN A 152 -26.853 -32.655 11.156 1.00 0.00 H new ATOM 0 HB3 GLN A 152 -25.990 -33.434 12.467 1.00 0.00 H new ATOM 0 HG2 GLN A 152 -26.859 -31.818 14.087 1.00 0.00 H new ATOM 0 HG3 GLN A 152 -27.576 -30.853 12.811 1.00 0.00 H new ATOM 0 HE21 GLN A 152 -29.465 -31.661 11.668 1.00 0.00 H new ATOM 0 HE22 GLN A 152 -30.466 -32.938 12.368 1.00 0.00 H new ATOM 636 N HIS A 153 -24.679 -31.936 9.409 1.00 0.00 N ATOM 637 CA HIS A 153 -24.073 -32.546 8.199 1.00 0.00 C ATOM 638 C HIS A 153 -23.314 -31.487 7.378 1.00 0.00 C ATOM 639 O HIS A 153 -23.882 -30.835 6.494 1.00 0.00 O ATOM 640 CB HIS A 153 -25.166 -33.244 7.342 1.00 0.00 C ATOM 641 CG HIS A 153 -25.876 -34.370 8.051 1.00 0.00 C ATOM 642 ND1 HIS A 153 -27.245 -34.451 8.195 1.00 0.00 N ATOM 643 CD2 HIS A 153 -25.374 -35.481 8.658 1.00 0.00 C ATOM 644 CE1 HIS A 153 -27.524 -35.579 8.857 1.00 0.00 C ATOM 645 NE2 HIS A 153 -26.426 -36.239 9.164 1.00 0.00 N ATOM 0 H HIS A 153 -25.439 -31.288 9.201 1.00 0.00 H new ATOM 0 HA HIS A 153 -23.353 -33.302 8.512 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -25.902 -32.501 7.035 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -24.707 -33.633 6.433 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -24.327 -35.734 8.735 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -28.522 -35.907 9.108 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -26.360 -37.123 9.668 1.00 0.00 H new ATOM 653 N ILE A 154 -22.019 -31.322 7.705 1.00 0.00 N ATOM 654 CA ILE A 154 -21.113 -30.337 7.085 1.00 0.00 C ATOM 655 C ILE A 154 -19.937 -31.075 6.401 1.00 0.00 C ATOM 656 O ILE A 154 -19.317 -31.923 7.054 1.00 0.00 O ATOM 657 CB ILE A 154 -20.533 -29.348 8.169 1.00 0.00 C ATOM 658 CG1 ILE A 154 -21.672 -28.608 8.950 1.00 0.00 C ATOM 659 CG2 ILE A 154 -19.556 -28.336 7.528 1.00 0.00 C ATOM 660 CD1 ILE A 154 -21.203 -27.771 10.133 1.00 0.00 C ATOM 0 H ILE A 154 -21.563 -31.883 8.424 1.00 0.00 H new ATOM 0 HA ILE A 154 -21.680 -29.765 6.350 1.00 0.00 H new ATOM 0 HB ILE A 154 -19.979 -29.947 8.892 1.00 0.00 H new ATOM 0 HG12 ILE A 154 -22.207 -27.960 8.255 1.00 0.00 H new ATOM 0 HG13 ILE A 154 -22.386 -29.349 9.309 1.00 0.00 H new ATOM 0 HG21 ILE A 154 -19.170 -27.666 8.296 1.00 0.00 H new ATOM 0 HG22 ILE A 154 -18.728 -28.873 7.066 1.00 0.00 H new ATOM 0 HG23 ILE A 154 -20.080 -27.755 6.769 1.00 0.00 H new ATOM 0 HD11 ILE A 154 -22.063 -27.299 10.608 1.00 0.00 H new ATOM 0 HD12 ILE A 154 -20.696 -28.412 10.854 1.00 0.00 H new ATOM 0 HD13 ILE A 154 -20.514 -27.002 9.784 1.00 0.00 H new ATOM 672 N PRO A 155 -19.613 -30.801 5.090 1.00 0.00 N ATOM 673 CA PRO A 155 -18.406 -31.366 4.445 1.00 0.00 C ATOM 674 C PRO A 155 -17.117 -30.768 5.069 1.00 0.00 C ATOM 675 O PRO A 155 -17.046 -29.551 5.314 1.00 0.00 O ATOM 676 CB PRO A 155 -18.577 -30.965 2.956 1.00 0.00 C ATOM 677 CG PRO A 155 -19.399 -29.719 3.001 1.00 0.00 C ATOM 678 CD PRO A 155 -20.377 -29.933 4.145 1.00 0.00 C ATOM 0 HA PRO A 155 -18.306 -32.444 4.573 1.00 0.00 H new ATOM 0 HB2 PRO A 155 -17.613 -30.789 2.478 1.00 0.00 H new ATOM 0 HB3 PRO A 155 -19.076 -31.750 2.387 1.00 0.00 H new ATOM 0 HG2 PRO A 155 -18.776 -28.841 3.174 1.00 0.00 H new ATOM 0 HG3 PRO A 155 -19.923 -29.558 2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 155 -20.666 -28.990 4.609 1.00 0.00 H new ATOM 0 HD3 PRO A 155 -21.293 -30.416 3.806 1.00 0.00 H new ATOM 686 N ASP A 156 -16.130 -31.639 5.340 1.00 0.00 N ATOM 687 CA ASP A 156 -14.845 -31.254 5.971 1.00 0.00 C ATOM 688 C ASP A 156 -14.084 -30.224 5.108 1.00 0.00 C ATOM 689 O ASP A 156 -13.642 -29.179 5.603 1.00 0.00 O ATOM 690 CB ASP A 156 -13.977 -32.520 6.201 1.00 0.00 C ATOM 691 CG ASP A 156 -12.638 -32.236 6.918 1.00 0.00 C ATOM 692 OD1 ASP A 156 -12.631 -32.134 8.170 1.00 0.00 O ATOM 693 OD2 ASP A 156 -11.595 -32.104 6.239 1.00 0.00 O ATOM 0 H ASP A 156 -16.196 -32.635 5.129 1.00 0.00 H new ATOM 0 HA ASP A 156 -15.058 -30.785 6.932 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -14.548 -33.239 6.789 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -13.771 -32.988 5.238 1.00 0.00 H new ATOM 698 N THR A 157 -13.951 -30.537 3.811 1.00 0.00 N ATOM 699 CA THR A 157 -13.342 -29.648 2.817 1.00 0.00 C ATOM 700 C THR A 157 -14.465 -28.954 2.027 1.00 0.00 C ATOM 701 O THR A 157 -14.796 -29.335 0.898 1.00 0.00 O ATOM 702 CB THR A 157 -12.359 -30.426 1.868 1.00 0.00 C ATOM 703 OG1 THR A 157 -12.967 -31.648 1.417 1.00 0.00 O ATOM 704 CG2 THR A 157 -11.019 -30.750 2.557 1.00 0.00 C ATOM 0 H THR A 157 -14.267 -31.425 3.421 1.00 0.00 H new ATOM 0 HA THR A 157 -12.740 -28.895 3.325 1.00 0.00 H new ATOM 0 HB THR A 157 -12.153 -29.774 1.019 1.00 0.00 H new ATOM 0 HG1 THR A 157 -13.857 -31.456 1.054 1.00 0.00 H new ATOM 0 HG21 THR A 157 -10.373 -31.287 1.862 1.00 0.00 H new ATOM 0 HG22 THR A 157 -10.533 -29.823 2.861 1.00 0.00 H new ATOM 0 HG23 THR A 157 -11.202 -31.369 3.435 1.00 0.00 H new ATOM 712 N TYR A 158 -15.098 -27.970 2.692 1.00 0.00 N ATOM 713 CA TYR A 158 -16.181 -27.161 2.118 1.00 0.00 C ATOM 714 C TYR A 158 -15.736 -26.440 0.824 1.00 0.00 C ATOM 715 O TYR A 158 -14.609 -25.935 0.727 1.00 0.00 O ATOM 716 CB TYR A 158 -16.669 -26.148 3.184 1.00 0.00 C ATOM 717 CG TYR A 158 -17.657 -25.087 2.666 1.00 0.00 C ATOM 718 CD1 TYR A 158 -18.967 -25.412 2.330 1.00 0.00 C ATOM 719 CD2 TYR A 158 -17.272 -23.754 2.540 1.00 0.00 C ATOM 720 CE1 TYR A 158 -19.842 -24.443 1.885 1.00 0.00 C ATOM 721 CE2 TYR A 158 -18.138 -22.794 2.097 1.00 0.00 C ATOM 722 CZ TYR A 158 -19.421 -23.138 1.775 1.00 0.00 C ATOM 723 OH TYR A 158 -20.291 -22.163 1.346 1.00 0.00 O ATOM 0 H TYR A 158 -14.867 -27.714 3.652 1.00 0.00 H new ATOM 0 HA TYR A 158 -17.003 -27.820 1.838 1.00 0.00 H new ATOM 0 HB2 TYR A 158 -17.143 -26.698 3.997 1.00 0.00 H new ATOM 0 HB3 TYR A 158 -15.801 -25.640 3.606 1.00 0.00 H new ATOM 0 HD1 TYR A 158 -19.303 -26.435 2.419 1.00 0.00 H new ATOM 0 HD2 TYR A 158 -16.262 -23.472 2.799 1.00 0.00 H new ATOM 0 HE1 TYR A 158 -20.856 -24.708 1.623 1.00 0.00 H new ATOM 0 HE2 TYR A 158 -17.810 -21.769 2.002 1.00 0.00 H new ATOM 0 HH TYR A 158 -21.101 -22.582 0.987 1.00 0.00 H new ATOM 733 N LEU A 159 -16.651 -26.398 -0.156 1.00 0.00 N ATOM 734 CA LEU A 159 -16.439 -25.757 -1.469 1.00 0.00 C ATOM 735 C LEU A 159 -17.606 -24.794 -1.763 1.00 0.00 C ATOM 736 O LEU A 159 -18.724 -25.017 -1.302 1.00 0.00 O ATOM 737 CB LEU A 159 -16.323 -26.836 -2.577 1.00 0.00 C ATOM 738 CG LEU A 159 -15.135 -27.843 -2.434 1.00 0.00 C ATOM 739 CD1 LEU A 159 -15.251 -28.986 -3.470 1.00 0.00 C ATOM 740 CD2 LEU A 159 -13.752 -27.132 -2.531 1.00 0.00 C ATOM 0 H LEU A 159 -17.577 -26.815 -0.060 1.00 0.00 H new ATOM 0 HA LEU A 159 -15.509 -25.188 -1.451 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -17.253 -27.404 -2.602 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -16.232 -26.332 -3.539 1.00 0.00 H new ATOM 0 HG LEU A 159 -15.199 -28.280 -1.438 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -14.413 -29.673 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -16.186 -29.524 -3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -15.236 -28.568 -4.476 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -12.956 -27.869 -2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -13.664 -26.638 -3.498 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -13.667 -26.391 -1.736 1.00 0.00 H new ATOM 752 N CYS A 160 -17.332 -23.711 -2.523 1.00 0.00 N ATOM 753 CA CYS A 160 -18.365 -22.702 -2.902 1.00 0.00 C ATOM 754 C CYS A 160 -18.821 -22.914 -4.357 1.00 0.00 C ATOM 755 O CYS A 160 -18.412 -23.884 -4.977 1.00 0.00 O ATOM 756 CB CYS A 160 -17.837 -21.266 -2.706 1.00 0.00 C ATOM 757 SG CYS A 160 -16.518 -20.801 -3.856 1.00 0.00 S ATOM 0 H CYS A 160 -16.403 -23.506 -2.891 1.00 0.00 H new ATOM 0 HA CYS A 160 -19.224 -22.839 -2.245 1.00 0.00 H new ATOM 0 HB2 CYS A 160 -18.666 -20.567 -2.818 1.00 0.00 H new ATOM 0 HB3 CYS A 160 -17.468 -21.162 -1.686 1.00 0.00 H new ATOM 762 N GLU A 161 -19.634 -21.963 -4.881 1.00 0.00 N ATOM 763 CA GLU A 161 -20.250 -21.998 -6.243 1.00 0.00 C ATOM 764 C GLU A 161 -19.312 -22.572 -7.341 1.00 0.00 C ATOM 765 O GLU A 161 -19.659 -23.503 -8.065 1.00 0.00 O ATOM 766 CB GLU A 161 -20.622 -20.550 -6.656 1.00 0.00 C ATOM 767 CG GLU A 161 -21.497 -19.767 -5.663 1.00 0.00 C ATOM 768 CD GLU A 161 -21.614 -18.287 -6.064 1.00 0.00 C ATOM 769 OE1 GLU A 161 -22.294 -17.991 -7.062 1.00 0.00 O ATOM 770 OE2 GLU A 161 -20.990 -17.419 -5.414 1.00 0.00 O ATOM 0 H GLU A 161 -19.890 -21.125 -4.358 1.00 0.00 H new ATOM 0 HA GLU A 161 -21.117 -22.655 -6.174 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -19.700 -19.991 -6.815 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -21.141 -20.589 -7.614 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -22.490 -20.214 -5.620 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -21.071 -19.842 -4.663 1.00 0.00 H new ATOM 777 N ARG A 162 -18.104 -22.000 -7.403 1.00 0.00 N ATOM 778 CA ARG A 162 -17.148 -22.196 -8.515 1.00 0.00 C ATOM 779 C ARG A 162 -16.270 -23.447 -8.298 1.00 0.00 C ATOM 780 O ARG A 162 -15.641 -23.952 -9.236 1.00 0.00 O ATOM 781 CB ARG A 162 -16.278 -20.910 -8.652 1.00 0.00 C ATOM 782 CG ARG A 162 -17.104 -19.595 -8.635 1.00 0.00 C ATOM 783 CD ARG A 162 -18.142 -19.505 -9.780 1.00 0.00 C ATOM 784 NE ARG A 162 -19.280 -18.632 -9.424 1.00 0.00 N ATOM 785 CZ ARG A 162 -20.284 -18.299 -10.246 1.00 0.00 C ATOM 786 NH1 ARG A 162 -20.228 -18.566 -11.547 1.00 0.00 N ATOM 787 NH2 ARG A 162 -21.336 -17.677 -9.760 1.00 0.00 N ATOM 0 H ARG A 162 -17.752 -21.378 -6.675 1.00 0.00 H new ATOM 0 HA ARG A 162 -17.700 -22.365 -9.439 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -15.553 -20.884 -7.839 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -15.712 -20.962 -9.582 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -17.621 -19.512 -7.679 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -16.423 -18.746 -8.704 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -17.659 -19.123 -10.679 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -18.510 -20.503 -10.016 1.00 0.00 H new ATOM 0 HE ARG A 162 -19.303 -18.253 -8.477 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -19.409 -19.033 -11.937 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -21.004 -18.304 -12.155 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -21.382 -17.453 -8.766 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -22.106 -17.419 -10.377 1.00 0.00 H new ATOM 801 N CYS A 163 -16.225 -23.923 -7.045 1.00 0.00 N ATOM 802 CA CYS A 163 -15.392 -25.066 -6.635 1.00 0.00 C ATOM 803 C CYS A 163 -16.215 -26.365 -6.553 1.00 0.00 C ATOM 804 O CYS A 163 -15.679 -27.461 -6.715 1.00 0.00 O ATOM 805 CB CYS A 163 -14.762 -24.767 -5.265 1.00 0.00 C ATOM 806 SG CYS A 163 -13.905 -23.184 -5.185 1.00 0.00 S ATOM 0 H CYS A 163 -16.770 -23.523 -6.281 1.00 0.00 H new ATOM 0 HA CYS A 163 -14.614 -25.209 -7.385 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -15.543 -24.785 -4.505 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -14.059 -25.562 -5.018 1.00 0.00 H new ATOM 811 N GLN A 164 -17.521 -26.223 -6.289 1.00 0.00 N ATOM 812 CA GLN A 164 -18.434 -27.331 -6.058 1.00 0.00 C ATOM 813 C GLN A 164 -19.264 -27.563 -7.339 1.00 0.00 C ATOM 814 O GLN A 164 -19.832 -26.598 -7.848 1.00 0.00 O ATOM 815 CB GLN A 164 -19.322 -26.958 -4.834 1.00 0.00 C ATOM 816 CG GLN A 164 -19.864 -28.156 -4.057 1.00 0.00 C ATOM 817 CD GLN A 164 -20.527 -27.790 -2.718 1.00 0.00 C ATOM 818 OE1 GLN A 164 -21.093 -26.709 -2.556 1.00 0.00 O ATOM 819 NE2 GLN A 164 -20.450 -28.692 -1.748 1.00 0.00 N ATOM 0 H GLN A 164 -17.974 -25.311 -6.231 1.00 0.00 H new ATOM 0 HA GLN A 164 -17.910 -28.261 -5.837 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -18.740 -26.334 -4.156 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -20.162 -26.355 -5.180 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -20.590 -28.680 -4.678 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -19.047 -28.852 -3.867 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -19.974 -29.579 -1.913 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -20.867 -28.498 -0.837 1.00 0.00 H new ATOM 828 N PRO A 165 -19.334 -28.834 -7.885 1.00 0.00 N ATOM 829 CA PRO A 165 -20.036 -29.146 -9.177 1.00 0.00 C ATOM 830 C PRO A 165 -21.530 -28.719 -9.206 1.00 0.00 C ATOM 831 O PRO A 165 -22.094 -28.467 -10.279 1.00 0.00 O ATOM 832 CB PRO A 165 -19.882 -30.689 -9.301 1.00 0.00 C ATOM 833 CG PRO A 165 -18.672 -31.009 -8.477 1.00 0.00 C ATOM 834 CD PRO A 165 -18.717 -30.055 -7.305 1.00 0.00 C ATOM 0 HA PRO A 165 -19.604 -28.589 -10.009 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -20.765 -31.208 -8.929 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -19.748 -30.993 -10.339 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -18.690 -32.045 -8.140 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -17.757 -30.877 -9.055 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -19.311 -30.455 -6.483 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -17.721 -29.854 -6.911 1.00 0.00 H new ATOM 842 N ARG A 166 -22.136 -28.645 -8.013 1.00 0.00 N ATOM 843 CA ARG A 166 -23.532 -28.205 -7.810 1.00 0.00 C ATOM 844 C ARG A 166 -23.603 -26.673 -7.580 1.00 0.00 C ATOM 845 O ARG A 166 -22.662 -26.075 -7.039 1.00 0.00 O ATOM 846 CB ARG A 166 -24.135 -28.976 -6.597 1.00 0.00 C ATOM 847 CG ARG A 166 -23.335 -28.805 -5.280 1.00 0.00 C ATOM 848 CD ARG A 166 -23.836 -29.695 -4.133 1.00 0.00 C ATOM 849 NE ARG A 166 -25.187 -29.323 -3.693 1.00 0.00 N ATOM 850 CZ ARG A 166 -25.969 -30.060 -2.890 1.00 0.00 C ATOM 851 NH1 ARG A 166 -25.612 -31.280 -2.506 1.00 0.00 N ATOM 852 NH2 ARG A 166 -27.132 -29.582 -2.509 1.00 0.00 N ATOM 0 H ARG A 166 -21.665 -28.893 -7.143 1.00 0.00 H new ATOM 0 HA ARG A 166 -24.113 -28.427 -8.705 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -25.158 -28.636 -6.435 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -24.187 -30.037 -6.843 1.00 0.00 H new ATOM 0 HG2 ARG A 166 -22.286 -29.030 -5.471 1.00 0.00 H new ATOM 0 HG3 ARG A 166 -23.386 -27.762 -4.967 1.00 0.00 H new ATOM 0 HD2 ARG A 166 -23.834 -30.736 -4.456 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -23.148 -29.621 -3.291 1.00 0.00 H new ATOM 0 HE ARG A 166 -25.560 -28.433 -4.024 1.00 0.00 H new ATOM 0 HH11 ARG A 166 -24.727 -31.675 -2.822 1.00 0.00 H new ATOM 0 HH12 ARG A 166 -26.223 -31.822 -1.895 1.00 0.00 H new ATOM 0 HH21 ARG A 166 -27.432 -28.659 -2.824 1.00 0.00 H new ATOM 0 HH22 ARG A 166 -27.735 -30.134 -1.899 1.00 0.00 H new ATOM 866 N ASN A 167 -24.716 -26.046 -8.020 1.00 0.00 N ATOM 867 CA ASN A 167 -24.999 -24.612 -7.760 1.00 0.00 C ATOM 868 C ASN A 167 -25.990 -24.490 -6.598 1.00 0.00 C ATOM 869 O ASN A 167 -27.019 -25.170 -6.574 1.00 0.00 O ATOM 870 CB ASN A 167 -25.558 -23.894 -9.012 1.00 0.00 C ATOM 871 CG ASN A 167 -24.540 -23.806 -10.144 1.00 0.00 C ATOM 872 OD1 ASN A 167 -23.752 -22.863 -10.213 1.00 0.00 O ATOM 873 ND2 ASN A 167 -24.531 -24.791 -11.032 1.00 0.00 N ATOM 0 H ASN A 167 -25.442 -26.514 -8.563 1.00 0.00 H new ATOM 0 HA ASN A 167 -24.059 -24.126 -7.500 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -26.443 -24.424 -9.365 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -25.877 -22.889 -8.737 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -23.858 -24.780 -11.799 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -25.197 -25.559 -10.948 1.00 0.00 H new ATOM 880 N LEU A 168 -25.665 -23.604 -5.646 1.00 0.00 N ATOM 881 CA LEU A 168 -26.398 -23.456 -4.379 1.00 0.00 C ATOM 882 C LEU A 168 -27.260 -22.182 -4.413 1.00 0.00 C ATOM 883 O LEU A 168 -27.088 -21.327 -5.293 1.00 0.00 O ATOM 884 CB LEU A 168 -25.403 -23.411 -3.176 1.00 0.00 C ATOM 885 CG LEU A 168 -24.527 -24.688 -2.909 1.00 0.00 C ATOM 886 CD1 LEU A 168 -25.393 -25.942 -2.692 1.00 0.00 C ATOM 887 CD2 LEU A 168 -23.456 -24.915 -4.002 1.00 0.00 C ATOM 0 H LEU A 168 -24.877 -22.962 -5.734 1.00 0.00 H new ATOM 0 HA LEU A 168 -27.053 -24.318 -4.250 1.00 0.00 H new ATOM 0 HB2 LEU A 168 -24.730 -22.567 -3.328 1.00 0.00 H new ATOM 0 HB3 LEU A 168 -25.977 -23.202 -2.273 1.00 0.00 H new ATOM 0 HG LEU A 168 -23.987 -24.500 -1.981 1.00 0.00 H new ATOM 0 HD11 LEU A 168 -24.749 -26.802 -2.511 1.00 0.00 H new ATOM 0 HD12 LEU A 168 -26.045 -25.789 -1.832 1.00 0.00 H new ATOM 0 HD13 LEU A 168 -25.999 -26.123 -3.579 1.00 0.00 H new ATOM 0 HD21 LEU A 168 -22.880 -25.810 -3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 168 -23.944 -25.041 -4.969 1.00 0.00 H new ATOM 0 HD23 LEU A 168 -22.788 -24.054 -4.042 1.00 0.00 H new ATOM 899 N ASP A 169 -28.178 -22.067 -3.440 1.00 0.00 N ATOM 900 CA ASP A 169 -29.090 -20.913 -3.308 1.00 0.00 C ATOM 901 C ASP A 169 -28.325 -19.675 -2.805 1.00 0.00 C ATOM 902 O ASP A 169 -28.244 -19.429 -1.600 1.00 0.00 O ATOM 903 CB ASP A 169 -30.269 -21.262 -2.357 1.00 0.00 C ATOM 904 CG ASP A 169 -31.225 -22.313 -2.938 1.00 0.00 C ATOM 905 OD1 ASP A 169 -30.886 -23.512 -2.903 1.00 0.00 O ATOM 906 OD2 ASP A 169 -32.308 -21.943 -3.447 1.00 0.00 O ATOM 0 H ASP A 169 -28.311 -22.774 -2.717 1.00 0.00 H new ATOM 0 HA ASP A 169 -29.502 -20.679 -4.290 1.00 0.00 H new ATOM 0 HB2 ASP A 169 -29.868 -21.628 -1.412 1.00 0.00 H new ATOM 0 HB3 ASP A 169 -30.829 -20.354 -2.135 1.00 0.00 H new ATOM 911 N LYS A 170 -27.738 -18.924 -3.752 1.00 0.00 N ATOM 912 CA LYS A 170 -26.969 -17.700 -3.466 1.00 0.00 C ATOM 913 C LYS A 170 -27.914 -16.525 -3.177 1.00 0.00 C ATOM 914 O LYS A 170 -27.738 -15.805 -2.188 1.00 0.00 O ATOM 915 CB LYS A 170 -26.041 -17.354 -4.662 1.00 0.00 C ATOM 916 CG LYS A 170 -25.245 -16.032 -4.498 1.00 0.00 C ATOM 917 CD LYS A 170 -24.251 -15.794 -5.653 1.00 0.00 C ATOM 918 CE LYS A 170 -23.282 -14.629 -5.387 1.00 0.00 C ATOM 919 NZ LYS A 170 -22.175 -14.613 -6.375 1.00 0.00 N ATOM 0 H LYS A 170 -27.784 -19.151 -4.745 1.00 0.00 H new ATOM 0 HA LYS A 170 -26.355 -17.879 -2.583 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -25.336 -18.172 -4.807 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -26.645 -17.290 -5.567 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -25.942 -15.196 -4.445 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -24.701 -16.054 -3.554 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -23.676 -16.705 -5.823 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -24.808 -15.593 -6.568 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -23.825 -13.685 -5.430 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -22.873 -14.716 -4.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -21.586 -13.769 -6.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -21.593 -15.467 -6.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -22.569 -14.591 -7.337 1.00 0.00 H new ATOM 933 N GLU A 171 -28.907 -16.346 -4.061 1.00 0.00 N ATOM 934 CA GLU A 171 -29.906 -15.266 -3.946 1.00 0.00 C ATOM 935 C GLU A 171 -30.755 -15.429 -2.673 1.00 0.00 C ATOM 936 O GLU A 171 -31.034 -14.453 -1.978 1.00 0.00 O ATOM 937 CB GLU A 171 -30.804 -15.212 -5.216 1.00 0.00 C ATOM 938 CG GLU A 171 -31.557 -16.521 -5.539 1.00 0.00 C ATOM 939 CD GLU A 171 -32.374 -16.448 -6.841 1.00 0.00 C ATOM 940 OE1 GLU A 171 -33.549 -16.030 -6.795 1.00 0.00 O ATOM 941 OE2 GLU A 171 -31.831 -16.785 -7.917 1.00 0.00 O ATOM 0 H GLU A 171 -29.042 -16.944 -4.876 1.00 0.00 H new ATOM 0 HA GLU A 171 -29.373 -14.318 -3.867 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -31.534 -14.412 -5.093 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -30.182 -14.948 -6.071 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -30.838 -17.336 -5.615 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -32.225 -16.761 -4.712 1.00 0.00 H new ATOM 948 N ARG A 172 -31.095 -16.690 -2.354 1.00 0.00 N ATOM 949 CA ARG A 172 -31.900 -17.038 -1.165 1.00 0.00 C ATOM 950 C ARG A 172 -31.050 -16.889 0.114 1.00 0.00 C ATOM 951 O ARG A 172 -31.583 -16.629 1.188 1.00 0.00 O ATOM 952 CB ARG A 172 -32.438 -18.492 -1.297 1.00 0.00 C ATOM 953 CG ARG A 172 -33.667 -18.842 -0.419 1.00 0.00 C ATOM 954 CD ARG A 172 -34.936 -18.079 -0.851 1.00 0.00 C ATOM 955 NE ARG A 172 -36.163 -18.614 -0.219 1.00 0.00 N ATOM 956 CZ ARG A 172 -37.362 -18.732 -0.829 1.00 0.00 C ATOM 957 NH1 ARG A 172 -37.533 -18.329 -2.083 1.00 0.00 N ATOM 958 NH2 ARG A 172 -38.390 -19.245 -0.169 1.00 0.00 N ATOM 0 H ARG A 172 -30.820 -17.498 -2.912 1.00 0.00 H new ATOM 0 HA ARG A 172 -32.748 -16.357 -1.096 1.00 0.00 H new ATOM 0 HB2 ARG A 172 -32.699 -18.669 -2.340 1.00 0.00 H new ATOM 0 HB3 ARG A 172 -31.631 -19.181 -1.049 1.00 0.00 H new ATOM 0 HG2 ARG A 172 -33.855 -19.914 -0.473 1.00 0.00 H new ATOM 0 HG3 ARG A 172 -33.444 -18.610 0.622 1.00 0.00 H new ATOM 0 HD2 ARG A 172 -34.828 -17.026 -0.593 1.00 0.00 H new ATOM 0 HD3 ARG A 172 -35.037 -18.133 -1.935 1.00 0.00 H new ATOM 0 HE ARG A 172 -36.098 -18.917 0.753 1.00 0.00 H new ATOM 0 HH11 ARG A 172 -36.752 -17.924 -2.599 1.00 0.00 H new ATOM 0 HH12 ARG A 172 -38.445 -18.425 -2.530 1.00 0.00 H new ATOM 0 HH21 ARG A 172 -38.275 -19.550 0.798 1.00 0.00 H new ATOM 0 HH22 ARG A 172 -39.297 -19.335 -0.627 1.00 0.00 H new ATOM 972 N ALA A 173 -29.724 -17.063 -0.038 1.00 0.00 N ATOM 973 CA ALA A 173 -28.741 -16.850 1.042 1.00 0.00 C ATOM 974 C ALA A 173 -28.661 -15.370 1.447 1.00 0.00 C ATOM 975 O ALA A 173 -28.500 -15.041 2.630 1.00 0.00 O ATOM 976 CB ALA A 173 -27.362 -17.340 0.591 1.00 0.00 C ATOM 0 H ALA A 173 -29.301 -17.357 -0.919 1.00 0.00 H new ATOM 0 HA ALA A 173 -29.068 -17.419 1.912 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -26.640 -17.181 1.391 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -27.413 -18.403 0.354 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -27.051 -16.786 -0.294 1.00 0.00 H new ATOM 982 N VAL A 174 -28.741 -14.492 0.434 1.00 0.00 N ATOM 983 CA VAL A 174 -28.788 -13.036 0.627 1.00 0.00 C ATOM 984 C VAL A 174 -30.092 -12.660 1.356 1.00 0.00 C ATOM 985 O VAL A 174 -30.061 -11.953 2.371 1.00 0.00 O ATOM 986 CB VAL A 174 -28.689 -12.268 -0.747 1.00 0.00 C ATOM 987 CG1 VAL A 174 -28.804 -10.737 -0.556 1.00 0.00 C ATOM 988 CG2 VAL A 174 -27.384 -12.624 -1.504 1.00 0.00 C ATOM 0 H VAL A 174 -28.775 -14.775 -0.545 1.00 0.00 H new ATOM 0 HA VAL A 174 -27.930 -12.740 1.231 1.00 0.00 H new ATOM 0 HB VAL A 174 -29.533 -12.595 -1.354 1.00 0.00 H new ATOM 0 HG11 VAL A 174 -28.731 -10.243 -1.525 1.00 0.00 H new ATOM 0 HG12 VAL A 174 -29.764 -10.499 -0.098 1.00 0.00 H new ATOM 0 HG13 VAL A 174 -27.998 -10.389 0.090 1.00 0.00 H new ATOM 0 HG21 VAL A 174 -27.349 -12.077 -2.446 1.00 0.00 H new ATOM 0 HG22 VAL A 174 -26.523 -12.351 -0.894 1.00 0.00 H new ATOM 0 HG23 VAL A 174 -27.361 -13.695 -1.705 1.00 0.00 H new ATOM 998 N LEU A 175 -31.217 -13.201 0.841 1.00 0.00 N ATOM 999 CA LEU A 175 -32.567 -12.980 1.396 1.00 0.00 C ATOM 1000 C LEU A 175 -32.662 -13.429 2.864 1.00 0.00 C ATOM 1001 O LEU A 175 -33.223 -12.713 3.697 1.00 0.00 O ATOM 1002 CB LEU A 175 -33.631 -13.731 0.551 1.00 0.00 C ATOM 1003 CG LEU A 175 -33.793 -13.250 -0.927 1.00 0.00 C ATOM 1004 CD1 LEU A 175 -34.774 -14.152 -1.707 1.00 0.00 C ATOM 1005 CD2 LEU A 175 -34.221 -11.763 -0.991 1.00 0.00 C ATOM 0 H LEU A 175 -31.212 -13.808 0.021 1.00 0.00 H new ATOM 0 HA LEU A 175 -32.761 -11.908 1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 175 -33.377 -14.791 0.542 1.00 0.00 H new ATOM 0 HB3 LEU A 175 -34.595 -13.638 1.051 1.00 0.00 H new ATOM 0 HG LEU A 175 -32.819 -13.332 -1.409 1.00 0.00 H new ATOM 0 HD11 LEU A 175 -34.865 -13.791 -2.731 1.00 0.00 H new ATOM 0 HD12 LEU A 175 -34.399 -15.175 -1.715 1.00 0.00 H new ATOM 0 HD13 LEU A 175 -35.752 -14.128 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 175 -34.325 -11.459 -2.033 1.00 0.00 H new ATOM 0 HD22 LEU A 175 -35.175 -11.637 -0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 175 -33.465 -11.145 -0.507 1.00 0.00 H new ATOM 1017 N LEU A 176 -32.076 -14.597 3.156 1.00 0.00 N ATOM 1018 CA LEU A 176 -32.132 -15.221 4.485 1.00 0.00 C ATOM 1019 C LEU A 176 -31.391 -14.366 5.526 1.00 0.00 C ATOM 1020 O LEU A 176 -31.936 -14.081 6.582 1.00 0.00 O ATOM 1021 CB LEU A 176 -31.538 -16.655 4.425 1.00 0.00 C ATOM 1022 CG LEU A 176 -31.602 -17.499 5.743 1.00 0.00 C ATOM 1023 CD1 LEU A 176 -33.060 -17.678 6.236 1.00 0.00 C ATOM 1024 CD2 LEU A 176 -30.909 -18.870 5.552 1.00 0.00 C ATOM 0 H LEU A 176 -31.547 -15.139 2.473 1.00 0.00 H new ATOM 0 HA LEU A 176 -33.176 -15.288 4.793 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -32.059 -17.206 3.642 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -30.494 -16.578 4.120 1.00 0.00 H new ATOM 0 HG LEU A 176 -31.063 -16.948 6.514 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -33.064 -18.269 7.152 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -33.500 -16.700 6.432 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -33.642 -18.191 5.471 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -30.966 -19.439 6.480 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -31.409 -19.423 4.757 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -29.864 -18.715 5.285 1.00 0.00 H new ATOM 1036 N GLN A 177 -30.167 -13.934 5.185 1.00 0.00 N ATOM 1037 CA GLN A 177 -29.302 -13.137 6.089 1.00 0.00 C ATOM 1038 C GLN A 177 -29.833 -11.707 6.312 1.00 0.00 C ATOM 1039 O GLN A 177 -29.761 -11.191 7.443 1.00 0.00 O ATOM 1040 CB GLN A 177 -27.850 -13.112 5.541 1.00 0.00 C ATOM 1041 CG GLN A 177 -27.058 -14.419 5.790 1.00 0.00 C ATOM 1042 CD GLN A 177 -26.575 -14.600 7.243 1.00 0.00 C ATOM 1043 OE1 GLN A 177 -26.308 -13.633 7.948 1.00 0.00 O ATOM 1044 NE2 GLN A 177 -26.427 -15.842 7.689 1.00 0.00 N ATOM 0 H GLN A 177 -29.743 -14.124 4.277 1.00 0.00 H new ATOM 0 HA GLN A 177 -29.311 -13.622 7.065 1.00 0.00 H new ATOM 0 HB2 GLN A 177 -27.881 -12.917 4.469 1.00 0.00 H new ATOM 0 HB3 GLN A 177 -27.314 -12.282 6.001 1.00 0.00 H new ATOM 0 HG2 GLN A 177 -27.686 -15.268 5.520 1.00 0.00 H new ATOM 0 HG3 GLN A 177 -26.193 -14.438 5.127 1.00 0.00 H new ATOM 0 HE21 GLN A 177 -26.655 -16.631 7.085 1.00 0.00 H new ATOM 0 HE22 GLN A 177 -26.085 -16.007 8.636 1.00 0.00 H new ATOM 1053 N ARG A 178 -30.366 -11.067 5.243 1.00 0.00 N ATOM 1054 CA ARG A 178 -30.876 -9.678 5.338 1.00 0.00 C ATOM 1055 C ARG A 178 -32.153 -9.629 6.201 1.00 0.00 C ATOM 1056 O ARG A 178 -32.314 -8.732 7.037 1.00 0.00 O ATOM 1057 CB ARG A 178 -31.140 -9.024 3.944 1.00 0.00 C ATOM 1058 CG ARG A 178 -32.270 -9.665 3.095 1.00 0.00 C ATOM 1059 CD ARG A 178 -32.975 -8.664 2.160 1.00 0.00 C ATOM 1060 NE ARG A 178 -33.733 -7.656 2.927 1.00 0.00 N ATOM 1061 CZ ARG A 178 -34.421 -6.634 2.404 1.00 0.00 C ATOM 1062 NH1 ARG A 178 -34.487 -6.449 1.091 1.00 0.00 N ATOM 1063 NH2 ARG A 178 -35.064 -5.810 3.208 1.00 0.00 N ATOM 0 H ARG A 178 -30.453 -11.484 4.316 1.00 0.00 H new ATOM 0 HA ARG A 178 -30.090 -9.093 5.815 1.00 0.00 H new ATOM 0 HB2 ARG A 178 -31.381 -7.972 4.098 1.00 0.00 H new ATOM 0 HB3 ARG A 178 -30.215 -9.059 3.368 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -31.851 -10.475 2.498 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -33.008 -10.110 3.762 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -32.236 -8.166 1.533 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -33.650 -9.200 1.493 1.00 0.00 H new ATOM 0 HE ARG A 178 -33.732 -7.746 3.943 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -34.008 -7.092 0.461 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -35.017 -5.664 0.713 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -35.034 -5.955 4.217 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -35.592 -5.028 2.821 1.00 0.00 H new ATOM 1077 N ARG A 179 -33.040 -10.630 6.024 1.00 0.00 N ATOM 1078 CA ARG A 179 -34.300 -10.698 6.781 1.00 0.00 C ATOM 1079 C ARG A 179 -34.034 -11.164 8.213 1.00 0.00 C ATOM 1080 O ARG A 179 -34.749 -10.786 9.124 1.00 0.00 O ATOM 1081 CB ARG A 179 -35.346 -11.621 6.090 1.00 0.00 C ATOM 1082 CG ARG A 179 -35.055 -13.134 6.187 1.00 0.00 C ATOM 1083 CD ARG A 179 -36.091 -14.000 5.452 1.00 0.00 C ATOM 1084 NE ARG A 179 -36.116 -13.739 4.000 1.00 0.00 N ATOM 1085 CZ ARG A 179 -37.001 -14.270 3.143 1.00 0.00 C ATOM 1086 NH1 ARG A 179 -37.984 -15.053 3.573 1.00 0.00 N ATOM 1087 NH2 ARG A 179 -36.908 -13.996 1.852 1.00 0.00 N ATOM 0 H ARG A 179 -32.905 -11.397 5.366 1.00 0.00 H new ATOM 0 HA ARG A 179 -34.723 -9.694 6.807 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -36.324 -11.427 6.529 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -35.409 -11.346 5.037 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -34.066 -13.334 5.775 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -35.027 -13.425 7.237 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -35.868 -15.053 5.625 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -37.080 -13.811 5.869 1.00 0.00 H new ATOM 0 HE ARG A 179 -35.409 -13.109 3.620 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -38.074 -15.258 4.568 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -38.649 -15.449 2.908 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -36.166 -13.384 1.513 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -37.578 -14.397 1.196 1.00 0.00 H new ATOM 1101 N LYS A 180 -32.974 -11.968 8.385 1.00 0.00 N ATOM 1102 CA LYS A 180 -32.583 -12.527 9.687 1.00 0.00 C ATOM 1103 C LYS A 180 -32.191 -11.411 10.667 1.00 0.00 C ATOM 1104 O LYS A 180 -32.636 -11.406 11.812 1.00 0.00 O ATOM 1105 CB LYS A 180 -31.407 -13.515 9.503 1.00 0.00 C ATOM 1106 CG LYS A 180 -30.958 -14.258 10.774 1.00 0.00 C ATOM 1107 CD LYS A 180 -29.850 -15.293 10.487 1.00 0.00 C ATOM 1108 CE LYS A 180 -30.312 -16.397 9.518 1.00 0.00 C ATOM 1109 NZ LYS A 180 -29.319 -17.489 9.398 1.00 0.00 N ATOM 0 H LYS A 180 -32.361 -12.250 7.620 1.00 0.00 H new ATOM 0 HA LYS A 180 -33.437 -13.060 10.105 1.00 0.00 H new ATOM 0 HB2 LYS A 180 -31.690 -14.253 8.753 1.00 0.00 H new ATOM 0 HB3 LYS A 180 -30.554 -12.966 9.104 1.00 0.00 H new ATOM 0 HG2 LYS A 180 -30.597 -13.536 11.506 1.00 0.00 H new ATOM 0 HG3 LYS A 180 -31.816 -14.762 11.220 1.00 0.00 H new ATOM 0 HD2 LYS A 180 -28.982 -14.785 10.067 1.00 0.00 H new ATOM 0 HD3 LYS A 180 -29.530 -15.747 11.425 1.00 0.00 H new ATOM 0 HE2 LYS A 180 -31.261 -16.808 9.864 1.00 0.00 H new ATOM 0 HE3 LYS A 180 -30.492 -15.963 8.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 -28.871 -17.449 8.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 -28.593 -17.380 10.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 -29.796 -18.406 9.515 1.00 0.00 H new ATOM 1123 N ARG A 181 -31.366 -10.466 10.185 1.00 0.00 N ATOM 1124 CA ARG A 181 -30.894 -9.329 10.994 1.00 0.00 C ATOM 1125 C ARG A 181 -32.037 -8.312 11.261 1.00 0.00 C ATOM 1126 O ARG A 181 -32.162 -7.805 12.384 1.00 0.00 O ATOM 1127 CB ARG A 181 -29.669 -8.645 10.315 1.00 0.00 C ATOM 1128 CG ARG A 181 -29.960 -8.054 8.926 1.00 0.00 C ATOM 1129 CD ARG A 181 -28.739 -7.429 8.243 1.00 0.00 C ATOM 1130 NE ARG A 181 -29.108 -6.805 6.959 1.00 0.00 N ATOM 1131 CZ ARG A 181 -28.491 -5.750 6.398 1.00 0.00 C ATOM 1132 NH1 ARG A 181 -27.438 -5.184 6.975 1.00 0.00 N ATOM 1133 NH2 ARG A 181 -28.950 -5.262 5.256 1.00 0.00 N ATOM 0 H ARG A 181 -31.009 -10.468 9.229 1.00 0.00 H new ATOM 0 HA ARG A 181 -30.572 -9.712 11.962 1.00 0.00 H new ATOM 0 HB2 ARG A 181 -29.306 -7.850 10.966 1.00 0.00 H new ATOM 0 HB3 ARG A 181 -28.865 -9.375 10.224 1.00 0.00 H new ATOM 0 HG2 ARG A 181 -30.359 -8.840 8.285 1.00 0.00 H new ATOM 0 HG3 ARG A 181 -30.737 -7.296 9.021 1.00 0.00 H new ATOM 0 HD2 ARG A 181 -28.295 -6.681 8.900 1.00 0.00 H new ATOM 0 HD3 ARG A 181 -27.982 -8.195 8.074 1.00 0.00 H new ATOM 0 HE ARG A 181 -29.898 -7.207 6.454 1.00 0.00 H new ATOM 0 HH11 ARG A 181 -27.084 -5.549 7.859 1.00 0.00 H new ATOM 0 HH12 ARG A 181 -26.983 -4.384 6.534 1.00 0.00 H new ATOM 0 HH21 ARG A 181 -29.764 -5.686 4.811 1.00 0.00 H new ATOM 0 HH22 ARG A 181 -28.490 -4.462 4.822 1.00 0.00 H new ATOM 1147 N GLU A 182 -32.902 -8.054 10.243 1.00 0.00 N ATOM 1148 CA GLU A 182 -34.007 -7.069 10.381 1.00 0.00 C ATOM 1149 C GLU A 182 -35.206 -7.652 11.171 1.00 0.00 C ATOM 1150 O GLU A 182 -36.034 -6.899 11.700 1.00 0.00 O ATOM 1151 CB GLU A 182 -34.432 -6.513 8.985 1.00 0.00 C ATOM 1152 CG GLU A 182 -35.214 -7.474 8.075 1.00 0.00 C ATOM 1153 CD GLU A 182 -35.370 -6.952 6.627 1.00 0.00 C ATOM 1154 OE1 GLU A 182 -34.380 -6.985 5.862 1.00 0.00 O ATOM 1155 OE2 GLU A 182 -36.467 -6.476 6.257 1.00 0.00 O ATOM 0 H GLU A 182 -32.856 -8.508 9.331 1.00 0.00 H new ATOM 0 HA GLU A 182 -33.635 -6.229 10.968 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -35.040 -5.622 9.143 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -33.533 -6.196 8.455 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -34.706 -8.438 8.054 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -36.203 -7.644 8.501 1.00 0.00 H new ATOM 1162 N ASN A 183 -35.278 -8.995 11.266 1.00 0.00 N ATOM 1163 CA ASN A 183 -36.317 -9.705 12.055 1.00 0.00 C ATOM 1164 C ASN A 183 -35.725 -10.229 13.389 1.00 0.00 C ATOM 1165 O ASN A 183 -36.446 -10.802 14.213 1.00 0.00 O ATOM 1166 CB ASN A 183 -36.939 -10.864 11.212 1.00 0.00 C ATOM 1167 CG ASN A 183 -38.221 -11.492 11.789 1.00 0.00 C ATOM 1168 OD1 ASN A 183 -39.076 -10.692 12.422 1.00 0.00 O flip ATOM 1169 ND2 ASN A 183 -38.461 -12.691 11.629 1.00 0.00 N flip ATOM 0 H ASN A 183 -34.621 -9.621 10.801 1.00 0.00 H new ATOM 0 HA ASN A 183 -37.114 -9.003 12.301 1.00 0.00 H new ATOM 0 HB2 ASN A 183 -37.159 -10.486 10.214 1.00 0.00 H new ATOM 0 HB3 ASN A 183 -36.191 -11.649 11.098 1.00 0.00 H new ATOM 0 HD21 ASN A 183 -37.791 -13.285 11.141 1.00 0.00 H new ATOM 0 HD22 ASN A 183 -39.330 -13.089 11.985 1.00 0.00 H new ATOM 1176 N MET A 184 -34.400 -10.026 13.596 1.00 0.00 N ATOM 1177 CA MET A 184 -33.728 -10.325 14.886 1.00 0.00 C ATOM 1178 C MET A 184 -34.213 -9.337 15.956 1.00 0.00 C ATOM 1179 O MET A 184 -34.392 -9.702 17.120 1.00 0.00 O ATOM 1180 CB MET A 184 -32.176 -10.266 14.724 1.00 0.00 C ATOM 1181 CG MET A 184 -31.348 -10.636 15.976 1.00 0.00 C ATOM 1182 SD MET A 184 -31.342 -9.339 17.244 1.00 0.00 S ATOM 1183 CE MET A 184 -30.377 -10.101 18.555 1.00 0.00 C ATOM 0 H MET A 184 -33.773 -9.655 12.882 1.00 0.00 H new ATOM 0 HA MET A 184 -33.986 -11.336 15.201 1.00 0.00 H new ATOM 0 HB2 MET A 184 -31.890 -10.936 13.913 1.00 0.00 H new ATOM 0 HB3 MET A 184 -31.901 -9.257 14.416 1.00 0.00 H new ATOM 0 HG2 MET A 184 -31.746 -11.554 16.408 1.00 0.00 H new ATOM 0 HG3 MET A 184 -30.321 -10.845 15.675 1.00 0.00 H new ATOM 0 HE1 MET A 184 -30.296 -9.411 19.395 1.00 0.00 H new ATOM 0 HE2 MET A 184 -30.869 -11.017 18.884 1.00 0.00 H new ATOM 0 HE3 MET A 184 -29.380 -10.338 18.183 1.00 0.00 H new ATOM 1193 N SER A 185 -34.431 -8.085 15.529 1.00 0.00 N ATOM 1194 CA SER A 185 -34.979 -7.009 16.366 1.00 0.00 C ATOM 1195 C SER A 185 -36.006 -6.205 15.545 1.00 0.00 C ATOM 1196 O SER A 185 -35.658 -5.597 14.519 1.00 0.00 O ATOM 1197 CB SER A 185 -33.833 -6.094 16.869 1.00 0.00 C ATOM 1198 OG SER A 185 -32.887 -6.814 17.645 1.00 0.00 O ATOM 0 H SER A 185 -34.228 -7.787 14.575 1.00 0.00 H new ATOM 0 HA SER A 185 -35.478 -7.434 17.237 1.00 0.00 H new ATOM 0 HB2 SER A 185 -33.331 -5.637 16.016 1.00 0.00 H new ATOM 0 HB3 SER A 185 -34.250 -5.283 17.465 1.00 0.00 H new ATOM 0 HG SER A 185 -32.533 -7.561 17.119 1.00 0.00 H new ATOM 1204 N ASP A 186 -37.277 -6.242 15.981 1.00 0.00 N ATOM 1205 CA ASP A 186 -38.373 -5.446 15.387 1.00 0.00 C ATOM 1206 C ASP A 186 -38.320 -4.004 15.947 1.00 0.00 C ATOM 1207 O ASP A 186 -39.176 -3.592 16.742 1.00 0.00 O ATOM 1208 CB ASP A 186 -39.751 -6.117 15.678 1.00 0.00 C ATOM 1209 CG ASP A 186 -39.882 -7.543 15.110 1.00 0.00 C ATOM 1210 OD1 ASP A 186 -39.350 -8.490 15.727 1.00 0.00 O ATOM 1211 OD2 ASP A 186 -40.527 -7.728 14.051 1.00 0.00 O ATOM 0 H ASP A 186 -37.578 -6.828 16.760 1.00 0.00 H new ATOM 0 HA ASP A 186 -38.250 -5.404 14.305 1.00 0.00 H new ATOM 0 HB2 ASP A 186 -39.908 -6.150 16.756 1.00 0.00 H new ATOM 0 HB3 ASP A 186 -40.543 -5.495 15.260 1.00 0.00 H new ATOM 1216 N GLY A 187 -37.259 -3.264 15.556 1.00 0.00 N ATOM 1217 CA GLY A 187 -37.026 -1.894 16.034 1.00 0.00 C ATOM 1218 C GLY A 187 -37.781 -0.858 15.209 1.00 0.00 C ATOM 1219 O GLY A 187 -38.402 0.056 15.763 1.00 0.00 O ATOM 0 H GLY A 187 -36.549 -3.601 14.906 1.00 0.00 H new ATOM 0 HA2 GLY A 187 -37.333 -1.818 17.077 1.00 0.00 H new ATOM 0 HA3 GLY A 187 -35.959 -1.676 15.999 1.00 0.00 H new ATOM 1223 N ASP A 188 -37.734 -1.031 13.881 1.00 0.00 N ATOM 1224 CA ASP A 188 -38.346 -0.119 12.899 1.00 0.00 C ATOM 1225 C ASP A 188 -38.377 -0.802 11.509 1.00 0.00 C ATOM 1226 O ASP A 188 -37.375 -1.453 11.130 1.00 0.00 O ATOM 1227 CB ASP A 188 -37.604 1.257 12.838 1.00 0.00 C ATOM 1228 CG ASP A 188 -36.125 1.173 12.397 1.00 0.00 C ATOM 1229 OD1 ASP A 188 -35.303 0.599 13.149 1.00 0.00 O ATOM 1230 OD2 ASP A 188 -35.771 1.696 11.315 1.00 0.00 O ATOM 1231 OXT ASP A 188 -39.388 -0.670 10.792 1.00 0.00 O ATOM 0 H ASP A 188 -37.260 -1.824 13.448 1.00 0.00 H new ATOM 0 HA ASP A 188 -39.367 0.093 13.216 1.00 0.00 H new ATOM 0 HB2 ASP A 188 -38.138 1.912 12.150 1.00 0.00 H new ATOM 0 HB3 ASP A 188 -37.650 1.723 13.822 1.00 0.00 H new TER 1236 ASP A 188 HETATM 1237 ZN ZN A 201 -23.850 -15.502 4.485 1.00 0.00 ZN HETATM 1238 ZN ZN A 202 -14.443 -21.742 -3.377 1.00 0.00 ZN