USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 946 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 60 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 120 HIS : no HD1:sc= -0.815 K(o=-0.82,f=-2.3!) USER MOD Set 2.1: A 96 HIS : no HD1:sc= 0 X(o=1.2,f=1.1) USER MOD Set 2.2: A 100 THR OG1 : rot 94:sc= 1.24 USER MOD Set 3.1: A 80 THR OG1 : rot -176:sc= 1.14 USER MOD Set 3.2: A 94 CYS SG : rot 151:sc= -0.0354 USER MOD Set 4.1: A 33 THR OG1 : rot 105:sc= 1.91 USER MOD Set 4.2: A 71 SER OG : rot -112:sc= 0.785 USER MOD Set 5.1: A 53 TYR OH : rot 30:sc= -0.072 USER MOD Set 5.2: A 61 HIS : no HD1:sc= -0.928 K(o=-1,f=-4.8!) USER MOD Set 6.1: A 57 CYS SG : rot -162:sc= -0.257 USER MOD Set 6.2: A 65 SER OG : rot -66:sc= 2.03 USER MOD Set 7.1: A 27 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 31 LYS NZ :NH3+ 149:sc= 1.17 (180deg=0.365) USER MOD Single : A 8 GLN : amide:sc= -0.0396 K(o=-0.04,f=-0.68) USER MOD Single : A 9 ASN : amide:sc= 0.803 K(o=0.8,f=-0.017) USER MOD Single : A 13 THR OG1 : rot 89:sc= 1.22 USER MOD Single : A 16 SER OG : rot 91:sc= 1.25 USER MOD Single : A 18 LYS NZ :NH3+ -161:sc= -0.347 (180deg=-0.918!) USER MOD Single : A 21 LYS NZ :NH3+ 172:sc= 1.25 (180deg=1.2) USER MOD Single : A 22 SER OG : rot 97:sc= 0.034 USER MOD Single : A 25 SER OG : rot 140:sc= 0.145 USER MOD Single : A 30 LYS NZ :NH3+ -178:sc= -0.433 (180deg=-0.526) USER MOD Single : A 34 THR OG1 : rot 100:sc= 1.33 USER MOD Single : A 35 TYR OH : rot 151:sc= 1.24 USER MOD Single : A 39 HIS : no HD1:sc= -0.932 K(o=-0.93,f=-1.5) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -132:sc= -0.789 (180deg=-3.84!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 140:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 140:sc= 3.21 (180deg=1.56) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 164:sc= 0.614 USER MOD Single : A 82 SER OG : rot 91:sc= 1.21 USER MOD Single : A 93 THR OG1 : rot 180:sc=-0.00319 USER MOD Single : A 99 ASN :FLIP amide:sc= -0.42 F(o=-1.4,f=-0.42) USER MOD Single : A 106 GLN : amide:sc= 1.15 K(o=1.2,f=-0.57) USER MOD Single : A 110 SER OG : rot 85:sc= 1.17 USER MOD Single : A 115 LYS NZ :NH3+ -154:sc= 1.08 (180deg=-0.327) USER MOD Single : A 116 SER OG : rot -87:sc= 1.19 USER MOD Single : A 117 ASN : amide:sc= -0.561 K(o=-0.56,f=-1.2) USER MOD Single : A 118 GLN : amide:sc= -0.33 X(o=-0.33,f=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 139:sc= 1.09 (180deg=-0.0404) USER MOD Single : A 126 MET CE :methyl -163:sc= -0.0597 (180deg=-0.445) USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 -0.170 -9.895 -1.823 1.00 0.00 N ATOM 79 CA ASP A 6 0.090 -10.807 -2.921 1.00 0.00 C ATOM 80 C ASP A 6 -1.190 -10.891 -3.743 1.00 0.00 C ATOM 81 O ASP A 6 -1.150 -11.100 -4.956 1.00 0.00 O ATOM 82 CB ASP A 6 0.477 -12.196 -2.409 1.00 0.00 C ATOM 83 CG ASP A 6 -0.534 -12.833 -1.453 1.00 0.00 C ATOM 84 OD1 ASP A 6 -1.306 -12.084 -0.810 1.00 0.00 O ATOM 85 OD2 ASP A 6 -0.518 -14.083 -1.383 1.00 0.00 O1- ATOM 0 HA ASP A 6 0.924 -10.443 -3.521 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.614 -12.858 -3.264 1.00 0.00 H new ATOM 0 HB3 ASP A 6 1.440 -12.126 -1.903 1.00 0.00 H new ATOM 90 N PHE A 7 -2.317 -10.726 -3.045 1.00 0.00 N ATOM 91 CA PHE A 7 -3.641 -10.663 -3.633 1.00 0.00 C ATOM 92 C PHE A 7 -3.666 -9.577 -4.705 1.00 0.00 C ATOM 93 O PHE A 7 -4.350 -9.710 -5.715 1.00 0.00 O ATOM 94 CB PHE A 7 -4.648 -10.303 -2.541 1.00 0.00 C ATOM 95 CG PHE A 7 -6.106 -10.439 -2.937 1.00 0.00 C ATOM 96 CD1 PHE A 7 -6.475 -11.136 -4.099 1.00 0.00 C ATOM 97 CD2 PHE A 7 -7.096 -9.871 -2.125 1.00 0.00 C ATOM 98 CE1 PHE A 7 -7.822 -11.265 -4.450 1.00 0.00 C ATOM 99 CE2 PHE A 7 -8.448 -10.000 -2.476 1.00 0.00 C ATOM 100 CZ PHE A 7 -8.809 -10.701 -3.634 1.00 0.00 C ATOM 0 H PHE A 7 -2.325 -10.631 -2.029 1.00 0.00 H new ATOM 0 HA PHE A 7 -3.894 -11.625 -4.078 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -4.463 -10.938 -1.675 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -4.468 -9.275 -2.227 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -5.713 -11.575 -4.726 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -6.819 -9.334 -1.230 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -8.100 -11.798 -5.347 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -9.212 -9.558 -1.853 1.00 0.00 H new ATOM 0 HZ PHE A 7 -9.851 -10.806 -3.897 1.00 0.00 H new ATOM 110 N GLN A 8 -2.913 -8.498 -4.478 1.00 0.00 N ATOM 111 CA GLN A 8 -2.836 -7.345 -5.361 1.00 0.00 C ATOM 112 C GLN A 8 -2.528 -7.752 -6.799 1.00 0.00 C ATOM 113 O GLN A 8 -3.032 -7.133 -7.736 1.00 0.00 O ATOM 114 CB GLN A 8 -1.738 -6.425 -4.823 1.00 0.00 C ATOM 115 CG GLN A 8 -1.454 -5.280 -5.797 1.00 0.00 C ATOM 116 CD GLN A 8 -2.706 -4.450 -6.062 1.00 0.00 C ATOM 117 OE1 GLN A 8 -3.558 -4.294 -5.193 1.00 0.00 O ATOM 118 NE2 GLN A 8 -2.823 -3.908 -7.270 1.00 0.00 N ATOM 0 H GLN A 8 -2.325 -8.406 -3.649 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.799 -6.835 -5.379 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -2.040 -6.019 -3.858 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.827 -7.000 -4.656 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.671 -4.640 -5.390 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -1.078 -5.685 -6.737 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -2.095 -4.058 -7.969 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.640 -3.342 -7.498 1.00 0.00 H new ATOM 127 N ASN A 9 -1.706 -8.786 -6.989 1.00 0.00 N ATOM 128 CA ASN A 9 -1.352 -9.241 -8.325 1.00 0.00 C ATOM 129 C ASN A 9 -2.541 -9.957 -8.960 1.00 0.00 C ATOM 130 O ASN A 9 -2.741 -9.875 -10.171 1.00 0.00 O ATOM 131 CB ASN A 9 -0.138 -10.166 -8.220 1.00 0.00 C ATOM 132 CG ASN A 9 0.987 -9.521 -7.426 1.00 0.00 C ATOM 133 OD1 ASN A 9 1.737 -8.704 -7.951 1.00 0.00 O ATOM 134 ND2 ASN A 9 1.109 -9.886 -6.151 1.00 0.00 N ATOM 0 H ASN A 9 -1.276 -9.320 -6.233 1.00 0.00 H new ATOM 0 HA ASN A 9 -1.097 -8.393 -8.961 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -0.432 -11.101 -7.743 1.00 0.00 H new ATOM 0 HB3 ASN A 9 0.218 -10.416 -9.220 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.847 -9.483 -5.573 1.00 0.00 H new ATOM 0 HD22 ASN A 9 0.465 -10.569 -5.752 1.00 0.00 H new ATOM 141 N PHE A 10 -3.327 -10.658 -8.140 1.00 0.00 N ATOM 142 CA PHE A 10 -4.541 -11.320 -8.567 1.00 0.00 C ATOM 143 C PHE A 10 -5.591 -10.269 -8.907 1.00 0.00 C ATOM 144 O PHE A 10 -6.336 -10.428 -9.869 1.00 0.00 O ATOM 145 CB PHE A 10 -5.033 -12.188 -7.410 1.00 0.00 C ATOM 146 CG PHE A 10 -5.927 -13.335 -7.816 1.00 0.00 C ATOM 147 CD1 PHE A 10 -7.248 -13.099 -8.224 1.00 0.00 C ATOM 148 CD2 PHE A 10 -5.432 -14.645 -7.782 1.00 0.00 C ATOM 149 CE1 PHE A 10 -8.070 -14.176 -8.583 1.00 0.00 C ATOM 150 CE2 PHE A 10 -6.251 -15.720 -8.147 1.00 0.00 C ATOM 151 CZ PHE A 10 -7.572 -15.484 -8.550 1.00 0.00 C ATOM 0 H PHE A 10 -3.126 -10.778 -7.147 1.00 0.00 H new ATOM 0 HA PHE A 10 -4.358 -11.935 -9.448 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -4.168 -12.589 -6.882 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.573 -11.557 -6.704 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.631 -12.090 -8.261 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -4.413 -14.827 -7.473 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -9.091 -13.996 -8.886 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -5.866 -16.729 -8.118 1.00 0.00 H new ATOM 0 HZ PHE A 10 -8.206 -16.311 -8.835 1.00 0.00 H new ATOM 161 N VAL A 11 -5.651 -9.190 -8.115 1.00 0.00 N ATOM 162 CA VAL A 11 -6.591 -8.114 -8.365 1.00 0.00 C ATOM 163 C VAL A 11 -6.235 -7.435 -9.679 1.00 0.00 C ATOM 164 O VAL A 11 -7.086 -7.301 -10.551 1.00 0.00 O ATOM 165 CB VAL A 11 -6.579 -7.093 -7.221 1.00 0.00 C ATOM 166 CG1 VAL A 11 -7.540 -5.946 -7.527 1.00 0.00 C ATOM 167 CG2 VAL A 11 -7.003 -7.731 -5.896 1.00 0.00 C ATOM 0 H VAL A 11 -5.056 -9.049 -7.299 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.596 -8.532 -8.427 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.558 -6.722 -7.131 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.522 -5.228 -6.707 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -7.235 -5.452 -8.449 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.550 -6.339 -7.643 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.983 -6.979 -5.107 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -8.013 -8.130 -5.991 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -6.316 -8.539 -5.645 1.00 0.00 H new ATOM 177 N ALA A 12 -4.978 -7.004 -9.831 1.00 0.00 N ATOM 178 CA ALA A 12 -4.513 -6.362 -11.050 1.00 0.00 C ATOM 179 C ALA A 12 -4.716 -7.263 -12.265 1.00 0.00 C ATOM 180 O ALA A 12 -4.902 -6.759 -13.370 1.00 0.00 O ATOM 181 CB ALA A 12 -3.034 -6.017 -10.886 1.00 0.00 C ATOM 0 H ALA A 12 -4.262 -7.093 -9.110 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.093 -5.455 -11.218 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.670 -5.534 -11.793 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.910 -5.341 -10.040 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.465 -6.929 -10.707 1.00 0.00 H new ATOM 187 N THR A 13 -4.685 -8.588 -12.084 1.00 0.00 N ATOM 188 CA THR A 13 -4.950 -9.510 -13.179 1.00 0.00 C ATOM 189 C THR A 13 -6.437 -9.480 -13.516 1.00 0.00 C ATOM 190 O THR A 13 -6.817 -9.531 -14.684 1.00 0.00 O ATOM 191 CB THR A 13 -4.547 -10.932 -12.779 1.00 0.00 C ATOM 192 OG1 THR A 13 -3.181 -10.972 -12.427 1.00 0.00 O ATOM 193 CG2 THR A 13 -4.757 -11.900 -13.941 1.00 0.00 C ATOM 0 H THR A 13 -4.480 -9.038 -11.192 1.00 0.00 H new ATOM 0 HA THR A 13 -4.368 -9.207 -14.049 1.00 0.00 H new ATOM 0 HB THR A 13 -5.168 -11.224 -11.932 1.00 0.00 H new ATOM 0 HG1 THR A 13 -3.084 -10.780 -11.471 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.464 -12.904 -13.635 1.00 0.00 H new ATOM 0 HG22 THR A 13 -5.808 -11.900 -14.229 1.00 0.00 H new ATOM 0 HG23 THR A 13 -4.148 -11.587 -14.790 1.00 0.00 H new ATOM 201 N LEU A 14 -7.276 -9.393 -12.481 1.00 0.00 N ATOM 202 CA LEU A 14 -8.720 -9.319 -12.637 1.00 0.00 C ATOM 203 C LEU A 14 -9.088 -8.023 -13.352 1.00 0.00 C ATOM 204 O LEU A 14 -9.903 -8.020 -14.276 1.00 0.00 O ATOM 205 CB LEU A 14 -9.356 -9.370 -11.248 1.00 0.00 C ATOM 206 CG LEU A 14 -10.132 -10.664 -10.985 1.00 0.00 C ATOM 207 CD1 LEU A 14 -11.332 -10.779 -11.919 1.00 0.00 C ATOM 208 CD2 LEU A 14 -9.251 -11.904 -11.136 1.00 0.00 C ATOM 0 H LEU A 14 -6.966 -9.372 -11.510 1.00 0.00 H new ATOM 0 HA LEU A 14 -9.086 -10.154 -13.234 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.576 -9.263 -10.494 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.029 -8.521 -11.133 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.478 -10.615 -9.953 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.866 -11.706 -11.712 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.000 -9.932 -11.760 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.989 -10.781 -12.954 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -9.844 -12.798 -10.940 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.854 -11.947 -12.150 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.426 -11.853 -10.425 1.00 0.00 H new ATOM 220 N GLU A 15 -8.478 -6.922 -12.913 1.00 0.00 N ATOM 221 CA GLU A 15 -8.685 -5.610 -13.502 1.00 0.00 C ATOM 222 C GLU A 15 -8.187 -5.619 -14.946 1.00 0.00 C ATOM 223 O GLU A 15 -8.734 -4.922 -15.801 1.00 0.00 O ATOM 224 CB GLU A 15 -7.937 -4.584 -12.644 1.00 0.00 C ATOM 225 CG GLU A 15 -8.451 -4.608 -11.196 1.00 0.00 C ATOM 226 CD GLU A 15 -9.811 -3.933 -11.034 1.00 0.00 C ATOM 227 OE1 GLU A 15 -10.320 -3.950 -9.892 1.00 0.00 O ATOM 228 OE2 GLU A 15 -10.338 -3.405 -12.037 1.00 0.00 O1- ATOM 0 H GLU A 15 -7.822 -6.921 -12.132 1.00 0.00 H new ATOM 0 HA GLU A 15 -9.742 -5.345 -13.524 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.869 -4.800 -12.659 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -8.067 -3.587 -13.065 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.522 -5.642 -10.859 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -7.726 -4.112 -10.551 1.00 0.00 H new ATOM 235 N SER A 16 -7.148 -6.411 -15.220 1.00 0.00 N ATOM 236 CA SER A 16 -6.628 -6.539 -16.567 1.00 0.00 C ATOM 237 C SER A 16 -7.657 -7.213 -17.466 1.00 0.00 C ATOM 238 O SER A 16 -7.728 -6.869 -18.643 1.00 0.00 O ATOM 239 CB SER A 16 -5.323 -7.340 -16.575 1.00 0.00 C ATOM 240 OG SER A 16 -4.325 -6.679 -15.826 1.00 0.00 O ATOM 0 H SER A 16 -6.656 -6.969 -14.522 1.00 0.00 H new ATOM 0 HA SER A 16 -6.421 -5.539 -16.948 1.00 0.00 H new ATOM 0 HB2 SER A 16 -5.498 -8.333 -16.160 1.00 0.00 H new ATOM 0 HB3 SER A 16 -4.982 -7.479 -17.601 1.00 0.00 H new ATOM 0 HG SER A 16 -4.358 -6.984 -14.895 1.00 0.00 H new ATOM 246 N PHE A 17 -8.458 -8.157 -16.946 1.00 0.00 N ATOM 247 CA PHE A 17 -9.501 -8.753 -17.770 1.00 0.00 C ATOM 248 C PHE A 17 -10.572 -7.721 -18.087 1.00 0.00 C ATOM 249 O PHE A 17 -11.071 -7.707 -19.209 1.00 0.00 O ATOM 250 CB PHE A 17 -10.173 -9.937 -17.082 1.00 0.00 C ATOM 251 CG PHE A 17 -9.276 -11.100 -16.751 1.00 0.00 C ATOM 252 CD1 PHE A 17 -9.183 -11.525 -15.421 1.00 0.00 C ATOM 253 CD2 PHE A 17 -8.552 -11.760 -17.750 1.00 0.00 C ATOM 254 CE1 PHE A 17 -8.335 -12.582 -15.078 1.00 0.00 C ATOM 255 CE2 PHE A 17 -7.723 -12.839 -17.409 1.00 0.00 C ATOM 256 CZ PHE A 17 -7.605 -13.244 -16.074 1.00 0.00 C ATOM 0 H PHE A 17 -8.402 -8.509 -15.990 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.017 -9.104 -18.681 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -10.633 -9.583 -16.159 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.979 -10.295 -17.723 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -9.768 -11.035 -14.657 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -8.631 -11.440 -18.779 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.243 -12.888 -14.046 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.174 -13.359 -18.179 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.953 -14.064 -15.813 1.00 0.00 H new ATOM 266 N LYS A 18 -10.933 -6.863 -17.122 1.00 0.00 N ATOM 267 CA LYS A 18 -11.961 -5.854 -17.367 1.00 0.00 C ATOM 268 C LYS A 18 -11.526 -4.938 -18.504 1.00 0.00 C ATOM 269 O LYS A 18 -12.352 -4.425 -19.255 1.00 0.00 O ATOM 270 CB LYS A 18 -12.201 -4.988 -16.130 1.00 0.00 C ATOM 271 CG LYS A 18 -12.244 -5.797 -14.837 1.00 0.00 C ATOM 272 CD LYS A 18 -12.796 -4.913 -13.727 1.00 0.00 C ATOM 273 CE LYS A 18 -12.581 -5.589 -12.375 1.00 0.00 C ATOM 274 NZ LYS A 18 -12.710 -4.617 -11.275 1.00 0.00 N1+ ATOM 0 H LYS A 18 -10.534 -6.850 -16.183 1.00 0.00 H new ATOM 0 HA LYS A 18 -12.880 -6.381 -17.622 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.412 -4.240 -16.058 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -13.141 -4.449 -16.247 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.871 -6.680 -14.964 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.246 -6.149 -14.578 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.300 -3.942 -13.742 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.859 -4.731 -13.888 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -13.308 -6.390 -12.245 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.593 -6.048 -12.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -12.257 -4.998 -10.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -12.247 -3.725 -11.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.717 -4.440 -11.084 1.00 0.00 H new ATOM 288 N ASP A 19 -10.211 -4.748 -18.612 1.00 0.00 N ATOM 289 CA ASP A 19 -9.597 -3.901 -19.630 1.00 0.00 C ATOM 290 C ASP A 19 -9.604 -4.557 -21.017 1.00 0.00 C ATOM 291 O ASP A 19 -9.415 -3.870 -22.020 1.00 0.00 O ATOM 292 CB ASP A 19 -8.164 -3.589 -19.187 1.00 0.00 C ATOM 293 CG ASP A 19 -7.495 -2.494 -20.018 1.00 0.00 C ATOM 294 OD1 ASP A 19 -6.248 -2.440 -19.960 1.00 0.00 O ATOM 295 OD2 ASP A 19 -8.230 -1.736 -20.689 1.00 0.00 O1- ATOM 0 H ASP A 19 -9.535 -5.185 -17.986 1.00 0.00 H new ATOM 0 HA ASP A 19 -10.179 -2.984 -19.724 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.173 -3.285 -18.140 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.566 -4.498 -19.250 1.00 0.00 H new ATOM 300 N LEU A 20 -9.819 -5.876 -21.102 1.00 0.00 N ATOM 301 CA LEU A 20 -9.768 -6.563 -22.385 1.00 0.00 C ATOM 302 C LEU A 20 -10.985 -6.255 -23.248 1.00 0.00 C ATOM 303 O LEU A 20 -12.035 -5.846 -22.755 1.00 0.00 O ATOM 304 CB LEU A 20 -9.664 -8.076 -22.189 1.00 0.00 C ATOM 305 CG LEU A 20 -8.425 -8.471 -21.390 1.00 0.00 C ATOM 306 CD1 LEU A 20 -8.381 -9.986 -21.261 1.00 0.00 C ATOM 307 CD2 LEU A 20 -7.131 -8.014 -22.059 1.00 0.00 C ATOM 0 H LEU A 20 -10.027 -6.477 -20.304 1.00 0.00 H new ATOM 0 HA LEU A 20 -8.879 -6.197 -22.899 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.555 -8.436 -21.675 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -9.638 -8.566 -23.162 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.497 -7.985 -20.417 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -7.499 -10.277 -20.691 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -9.276 -10.333 -20.746 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -8.336 -10.435 -22.253 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.279 -8.320 -21.451 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.053 -8.467 -23.047 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.136 -6.928 -22.157 1.00 0.00 H new ATOM 319 N LYS A 21 -10.819 -6.464 -24.558 1.00 0.00 N ATOM 320 CA LYS A 21 -11.877 -6.311 -25.542 1.00 0.00 C ATOM 321 C LYS A 21 -12.480 -7.682 -25.870 1.00 0.00 C ATOM 322 O LYS A 21 -13.432 -7.762 -26.642 1.00 0.00 O ATOM 323 CB LYS A 21 -11.316 -5.636 -26.801 1.00 0.00 C ATOM 324 CG LYS A 21 -11.260 -4.106 -26.697 1.00 0.00 C ATOM 325 CD LYS A 21 -10.442 -3.580 -25.513 1.00 0.00 C ATOM 326 CE LYS A 21 -8.995 -4.073 -25.555 1.00 0.00 C ATOM 327 NZ LYS A 21 -8.220 -3.530 -24.425 1.00 0.00 N1+ ATOM 0 H LYS A 21 -9.928 -6.749 -24.964 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.668 -5.679 -25.139 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.313 -6.017 -26.992 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.931 -5.913 -27.657 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.839 -3.707 -27.620 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.277 -3.722 -26.619 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.454 -2.490 -25.519 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.907 -3.899 -24.580 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.977 -5.162 -25.523 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -8.532 -3.774 -26.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.284 -3.982 -24.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.105 -2.503 -24.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -8.724 -3.721 -23.535 1.00 0.00 H new ATOM 341 N SER A 22 -11.929 -8.753 -25.283 1.00 0.00 N ATOM 342 CA SER A 22 -12.395 -10.118 -25.483 1.00 0.00 C ATOM 343 C SER A 22 -12.823 -10.750 -24.161 1.00 0.00 C ATOM 344 O SER A 22 -13.570 -11.728 -24.154 1.00 0.00 O ATOM 345 CB SER A 22 -11.251 -10.936 -26.078 1.00 0.00 C ATOM 346 OG SER A 22 -10.165 -10.954 -25.178 1.00 0.00 O ATOM 0 H SER A 22 -11.134 -8.686 -24.647 1.00 0.00 H new ATOM 0 HA SER A 22 -13.255 -10.105 -26.152 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.585 -11.953 -26.281 1.00 0.00 H new ATOM 0 HB3 SER A 22 -10.940 -10.507 -27.030 1.00 0.00 H new ATOM 0 HG SER A 22 -10.192 -11.779 -24.650 1.00 0.00 H new ATOM 352 N GLY A 23 -12.346 -10.189 -23.049 1.00 0.00 N ATOM 353 CA GLY A 23 -12.658 -10.651 -21.702 1.00 0.00 C ATOM 354 C GLY A 23 -11.874 -11.912 -21.334 1.00 0.00 C ATOM 355 O GLY A 23 -11.591 -12.137 -20.159 1.00 0.00 O ATOM 0 H GLY A 23 -11.719 -9.384 -23.063 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.431 -9.861 -20.986 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.726 -10.853 -21.626 1.00 0.00 H new ATOM 359 N ILE A 24 -11.526 -12.730 -22.330 1.00 0.00 N ATOM 360 CA ILE A 24 -10.696 -13.907 -22.144 1.00 0.00 C ATOM 361 C ILE A 24 -9.233 -13.495 -22.219 1.00 0.00 C ATOM 362 O ILE A 24 -8.901 -12.536 -22.910 1.00 0.00 O ATOM 363 CB ILE A 24 -10.998 -14.928 -23.250 1.00 0.00 C ATOM 364 CG1 ILE A 24 -12.413 -15.490 -23.083 1.00 0.00 C ATOM 365 CG2 ILE A 24 -9.969 -16.069 -23.233 1.00 0.00 C ATOM 366 CD1 ILE A 24 -12.796 -16.353 -24.284 1.00 0.00 C ATOM 0 H ILE A 24 -11.819 -12.586 -23.296 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.905 -14.357 -21.173 1.00 0.00 H new ATOM 0 HB ILE A 24 -10.932 -14.419 -24.212 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -12.469 -16.083 -22.170 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.125 -14.671 -22.975 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.202 -16.781 -24.025 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.971 -15.661 -23.394 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.003 -16.575 -22.268 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -13.805 -16.742 -24.145 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -12.761 -15.750 -25.191 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -12.096 -17.183 -24.373 1.00 0.00 H new ATOM 378 N SER A 25 -8.358 -14.212 -21.511 1.00 0.00 N ATOM 379 CA SER A 25 -6.923 -14.045 -21.674 1.00 0.00 C ATOM 380 C SER A 25 -6.215 -15.258 -21.112 1.00 0.00 C ATOM 381 O SER A 25 -5.957 -15.318 -19.915 1.00 0.00 O ATOM 382 CB SER A 25 -6.408 -12.776 -20.998 1.00 0.00 C ATOM 383 OG SER A 25 -4.996 -12.772 -21.055 1.00 0.00 O ATOM 0 H SER A 25 -8.624 -14.913 -20.820 1.00 0.00 H new ATOM 0 HA SER A 25 -6.714 -13.946 -22.739 1.00 0.00 H new ATOM 0 HB2 SER A 25 -6.809 -11.893 -21.497 1.00 0.00 H new ATOM 0 HB3 SER A 25 -6.744 -12.737 -19.962 1.00 0.00 H new ATOM 0 HG SER A 25 -4.679 -11.865 -21.249 1.00 0.00 H new ATOM 389 N GLY A 26 -5.897 -16.231 -21.964 1.00 0.00 N ATOM 390 CA GLY A 26 -5.265 -17.445 -21.500 1.00 0.00 C ATOM 391 C GLY A 26 -3.987 -17.133 -20.735 1.00 0.00 C ATOM 392 O GLY A 26 -3.670 -17.838 -19.782 1.00 0.00 O ATOM 0 H GLY A 26 -6.068 -16.195 -22.969 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -5.953 -17.995 -20.858 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.037 -18.089 -22.349 1.00 0.00 H new ATOM 396 N SER A 27 -3.249 -16.092 -21.131 1.00 0.00 N ATOM 397 CA SER A 27 -2.026 -15.741 -20.426 1.00 0.00 C ATOM 398 C SER A 27 -2.355 -15.292 -19.010 1.00 0.00 C ATOM 399 O SER A 27 -1.806 -15.838 -18.054 1.00 0.00 O ATOM 400 CB SER A 27 -1.288 -14.632 -21.169 1.00 0.00 C ATOM 401 OG SER A 27 -0.255 -14.120 -20.356 1.00 0.00 O ATOM 0 H SER A 27 -3.476 -15.490 -21.923 1.00 0.00 H new ATOM 0 HA SER A 27 -1.382 -16.619 -20.380 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.873 -15.018 -22.100 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.982 -13.835 -21.436 1.00 0.00 H new ATOM 0 HG SER A 27 0.218 -13.409 -20.837 1.00 0.00 H new ATOM 407 N ARG A 28 -3.242 -14.304 -18.870 1.00 0.00 N ATOM 408 CA ARG A 28 -3.580 -13.741 -17.572 1.00 0.00 C ATOM 409 C ARG A 28 -4.337 -14.757 -16.725 1.00 0.00 C ATOM 410 O ARG A 28 -4.123 -14.833 -15.515 1.00 0.00 O ATOM 411 CB ARG A 28 -4.433 -12.492 -17.790 1.00 0.00 C ATOM 412 CG ARG A 28 -3.651 -11.377 -18.496 1.00 0.00 C ATOM 413 CD ARG A 28 -2.465 -10.859 -17.680 1.00 0.00 C ATOM 414 NE ARG A 28 -1.564 -10.089 -18.539 1.00 0.00 N ATOM 415 CZ ARG A 28 -1.466 -8.757 -18.567 1.00 0.00 C ATOM 416 NH1 ARG A 28 -2.226 -7.986 -17.787 1.00 0.00 N1+ ATOM 417 NH2 ARG A 28 -0.590 -8.182 -19.391 1.00 0.00 N ATOM 0 H ARG A 28 -3.740 -13.878 -19.651 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.666 -13.478 -17.039 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -5.310 -12.751 -18.383 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.795 -12.128 -16.828 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.289 -11.748 -19.455 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -4.326 -10.548 -18.709 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -2.822 -10.235 -16.861 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.928 -11.695 -17.233 1.00 0.00 H new ATOM 0 HE ARG A 28 -0.959 -10.614 -19.170 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.900 -8.412 -17.151 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -2.132 -6.971 -17.827 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -0.002 -8.758 -19.993 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -0.508 -7.166 -19.420 1.00 0.00 H new ATOM 431 N ILE A 29 -5.215 -15.538 -17.353 1.00 0.00 N ATOM 432 CA ILE A 29 -5.927 -16.591 -16.663 1.00 0.00 C ATOM 433 C ILE A 29 -4.908 -17.575 -16.091 1.00 0.00 C ATOM 434 O ILE A 29 -5.056 -17.996 -14.946 1.00 0.00 O ATOM 435 CB ILE A 29 -6.903 -17.272 -17.637 1.00 0.00 C ATOM 436 CG1 ILE A 29 -8.039 -16.302 -17.982 1.00 0.00 C ATOM 437 CG2 ILE A 29 -7.518 -18.541 -17.034 1.00 0.00 C ATOM 438 CD1 ILE A 29 -8.981 -16.865 -19.049 1.00 0.00 C ATOM 0 H ILE A 29 -5.445 -15.454 -18.343 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.515 -16.189 -15.838 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.339 -17.548 -18.528 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.608 -16.078 -17.080 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.616 -15.361 -18.334 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.201 -18.992 -17.754 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.726 -19.250 -16.793 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.064 -18.285 -16.126 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.768 -16.141 -19.258 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.419 -17.064 -19.962 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.427 -17.792 -18.688 1.00 0.00 H new ATOM 450 N LYS A 30 -3.879 -17.939 -16.869 1.00 0.00 N ATOM 451 CA LYS A 30 -2.839 -18.841 -16.390 1.00 0.00 C ATOM 452 C LYS A 30 -2.007 -18.197 -15.283 1.00 0.00 C ATOM 453 O LYS A 30 -1.468 -18.921 -14.445 1.00 0.00 O ATOM 454 CB LYS A 30 -1.924 -19.257 -17.549 1.00 0.00 C ATOM 455 CG LYS A 30 -2.544 -20.365 -18.409 1.00 0.00 C ATOM 456 CD LYS A 30 -1.590 -20.805 -19.527 1.00 0.00 C ATOM 457 CE LYS A 30 -1.486 -19.793 -20.672 1.00 0.00 C ATOM 458 NZ LYS A 30 -2.715 -19.773 -21.484 1.00 0.00 N1+ ATOM 0 H LYS A 30 -3.751 -17.620 -17.829 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.329 -19.723 -15.978 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -1.715 -18.389 -18.174 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.969 -19.600 -17.150 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -2.790 -21.221 -17.781 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -3.478 -20.010 -18.844 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -0.598 -20.968 -19.105 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.927 -21.761 -19.927 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.300 -18.799 -20.265 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -0.634 -20.043 -21.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.600 -19.103 -22.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -2.896 -20.724 -21.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.517 -19.478 -20.892 1.00 0.00 H new ATOM 472 N LYS A 31 -1.886 -16.860 -15.258 1.00 0.00 N ATOM 473 CA LYS A 31 -1.098 -16.202 -14.216 1.00 0.00 C ATOM 474 C LYS A 31 -1.751 -16.413 -12.857 1.00 0.00 C ATOM 475 O LYS A 31 -1.128 -16.965 -11.952 1.00 0.00 O ATOM 476 CB LYS A 31 -0.949 -14.694 -14.460 1.00 0.00 C ATOM 477 CG LYS A 31 -0.123 -14.305 -15.693 1.00 0.00 C ATOM 478 CD LYS A 31 1.258 -14.954 -15.742 1.00 0.00 C ATOM 479 CE LYS A 31 1.194 -16.251 -16.554 1.00 0.00 C ATOM 480 NZ LYS A 31 0.957 -15.988 -17.988 1.00 0.00 N1+ ATOM 0 H LYS A 31 -2.316 -16.229 -15.934 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.105 -16.651 -14.240 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.944 -14.259 -14.558 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.490 -14.244 -13.580 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.676 -14.582 -16.591 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -0.005 -13.222 -15.712 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.976 -14.268 -16.191 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.607 -15.164 -14.731 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.127 -16.801 -16.435 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.398 -16.885 -16.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.416 -16.728 -18.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -0.066 -15.990 -18.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.354 -15.061 -18.241 1.00 0.00 H new ATOM 494 N LEU A 32 -3.005 -15.977 -12.705 1.00 0.00 N ATOM 495 CA LEU A 32 -3.653 -16.070 -11.404 1.00 0.00 C ATOM 496 C LEU A 32 -4.079 -17.504 -11.089 1.00 0.00 C ATOM 497 O LEU A 32 -4.305 -17.832 -9.924 1.00 0.00 O ATOM 498 CB LEU A 32 -4.804 -15.063 -11.294 1.00 0.00 C ATOM 499 CG LEU A 32 -5.994 -15.274 -12.241 1.00 0.00 C ATOM 500 CD1 LEU A 32 -6.791 -16.545 -11.942 1.00 0.00 C ATOM 501 CD2 LEU A 32 -6.952 -14.106 -12.039 1.00 0.00 C ATOM 0 H LEU A 32 -3.574 -15.568 -13.446 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.926 -15.800 -10.638 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.176 -15.081 -10.270 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.402 -14.065 -11.469 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.593 -15.352 -13.252 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.617 -16.631 -12.648 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.140 -17.414 -12.037 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.186 -16.497 -10.927 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.812 -14.223 -12.698 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.289 -14.087 -11.003 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -6.441 -13.172 -12.272 1.00 0.00 H new ATOM 513 N THR A 33 -4.187 -18.361 -12.110 1.00 0.00 N ATOM 514 CA THR A 33 -4.514 -19.762 -11.887 1.00 0.00 C ATOM 515 C THR A 33 -3.299 -20.429 -11.259 1.00 0.00 C ATOM 516 O THR A 33 -3.437 -21.243 -10.350 1.00 0.00 O ATOM 517 CB THR A 33 -4.864 -20.442 -13.214 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.064 -19.918 -13.729 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.059 -21.946 -13.060 1.00 0.00 C ATOM 0 H THR A 33 -4.053 -18.106 -13.089 1.00 0.00 H new ATOM 0 HA THR A 33 -5.377 -19.849 -11.227 1.00 0.00 H new ATOM 0 HB THR A 33 -4.026 -20.252 -13.884 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.864 -19.314 -14.474 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.305 -22.382 -14.028 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.140 -22.395 -12.683 1.00 0.00 H new ATOM 0 HG23 THR A 33 -5.871 -22.138 -12.359 1.00 0.00 H new ATOM 527 N THR A 34 -2.104 -20.085 -11.748 1.00 0.00 N ATOM 528 CA THR A 34 -0.884 -20.687 -11.239 1.00 0.00 C ATOM 529 C THR A 34 -0.628 -20.237 -9.804 1.00 0.00 C ATOM 530 O THR A 34 -0.161 -21.027 -8.987 1.00 0.00 O ATOM 531 CB THR A 34 0.278 -20.320 -12.162 1.00 0.00 C ATOM 532 OG1 THR A 34 0.055 -20.835 -13.455 1.00 0.00 O ATOM 533 CG2 THR A 34 1.573 -20.907 -11.606 1.00 0.00 C ATOM 0 H THR A 34 -1.963 -19.398 -12.489 1.00 0.00 H new ATOM 0 HA THR A 34 -0.985 -21.772 -11.224 1.00 0.00 H new ATOM 0 HB THR A 34 0.355 -19.234 -12.218 1.00 0.00 H new ATOM 0 HG1 THR A 34 -0.287 -20.124 -14.036 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.402 -20.646 -12.263 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.758 -20.503 -10.611 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.485 -21.992 -11.547 1.00 0.00 H new ATOM 541 N TYR A 35 -0.936 -18.973 -9.496 1.00 0.00 N ATOM 542 CA TYR A 35 -0.820 -18.460 -8.138 1.00 0.00 C ATOM 543 C TYR A 35 -1.775 -19.208 -7.215 1.00 0.00 C ATOM 544 O TYR A 35 -1.436 -19.480 -6.065 1.00 0.00 O ATOM 545 CB TYR A 35 -1.150 -16.966 -8.133 1.00 0.00 C ATOM 546 CG TYR A 35 -1.441 -16.403 -6.754 1.00 0.00 C ATOM 547 CD1 TYR A 35 -2.764 -16.375 -6.291 1.00 0.00 C ATOM 548 CD2 TYR A 35 -0.407 -15.908 -5.942 1.00 0.00 C ATOM 549 CE1 TYR A 35 -3.061 -15.840 -5.029 1.00 0.00 C ATOM 550 CE2 TYR A 35 -0.695 -15.386 -4.669 1.00 0.00 C ATOM 551 CZ TYR A 35 -2.027 -15.346 -4.209 1.00 0.00 C ATOM 552 OH TYR A 35 -2.324 -14.834 -2.980 1.00 0.00 O ATOM 0 H TYR A 35 -1.268 -18.289 -10.175 1.00 0.00 H new ATOM 0 HA TYR A 35 0.199 -18.608 -7.780 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -0.314 -16.418 -8.569 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -2.014 -16.793 -8.775 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -3.558 -16.767 -6.909 1.00 0.00 H new ATOM 0 HD2 TYR A 35 0.613 -15.929 -6.297 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -4.084 -15.807 -4.685 1.00 0.00 H new ATOM 0 HE2 TYR A 35 0.104 -15.016 -4.044 1.00 0.00 H new ATOM 0 HH TYR A 35 -1.562 -14.965 -2.378 1.00 0.00 H new ATOM 562 N ALA A 36 -2.968 -19.537 -7.719 1.00 0.00 N ATOM 563 CA ALA A 36 -3.977 -20.231 -6.942 1.00 0.00 C ATOM 564 C ALA A 36 -3.597 -21.698 -6.748 1.00 0.00 C ATOM 565 O ALA A 36 -3.856 -22.258 -5.687 1.00 0.00 O ATOM 566 CB ALA A 36 -5.306 -20.113 -7.687 1.00 0.00 C ATOM 0 H ALA A 36 -3.253 -19.327 -8.676 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.060 -19.784 -5.951 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.085 -20.627 -7.124 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.570 -19.061 -7.795 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.212 -20.567 -8.674 1.00 0.00 H new ATOM 572 N LEU A 37 -2.986 -22.318 -7.764 1.00 0.00 N ATOM 573 CA LEU A 37 -2.564 -23.709 -7.693 1.00 0.00 C ATOM 574 C LEU A 37 -1.371 -23.859 -6.756 1.00 0.00 C ATOM 575 O LEU A 37 -1.252 -24.872 -6.068 1.00 0.00 O ATOM 576 CB LEU A 37 -2.182 -24.180 -9.101 1.00 0.00 C ATOM 577 CG LEU A 37 -3.307 -24.949 -9.809 1.00 0.00 C ATOM 578 CD1 LEU A 37 -3.548 -26.292 -9.119 1.00 0.00 C ATOM 579 CD2 LEU A 37 -4.627 -24.177 -9.834 1.00 0.00 C ATOM 0 H LEU A 37 -2.774 -21.866 -8.653 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.382 -24.316 -7.304 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.907 -23.315 -9.704 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.300 -24.817 -9.037 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.976 -25.095 -10.837 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.348 -26.826 -9.632 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.635 -26.887 -9.152 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.833 -26.122 -8.081 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.385 -24.769 -10.347 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.951 -23.978 -8.813 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.487 -23.233 -10.361 1.00 0.00 H new ATOM 591 N ASP A 38 -0.494 -22.855 -6.728 1.00 0.00 N ATOM 592 CA ASP A 38 0.645 -22.837 -5.826 1.00 0.00 C ATOM 593 C ASP A 38 0.186 -22.645 -4.375 1.00 0.00 C ATOM 594 O ASP A 38 0.906 -23.011 -3.449 1.00 0.00 O ATOM 595 CB ASP A 38 1.578 -21.699 -6.268 1.00 0.00 C ATOM 596 CG ASP A 38 2.922 -21.698 -5.543 1.00 0.00 C ATOM 597 OD1 ASP A 38 3.312 -22.781 -5.054 1.00 0.00 O ATOM 598 OD2 ASP A 38 3.536 -20.608 -5.492 1.00 0.00 O1- ATOM 0 H ASP A 38 -0.558 -22.035 -7.331 1.00 0.00 H new ATOM 0 HA ASP A 38 1.175 -23.788 -5.868 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.753 -21.779 -7.341 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.081 -20.744 -6.096 1.00 0.00 H new ATOM 603 N HIS A 39 -1.006 -22.075 -4.168 1.00 0.00 N ATOM 604 CA HIS A 39 -1.500 -21.756 -2.838 1.00 0.00 C ATOM 605 C HIS A 39 -3.026 -21.783 -2.775 1.00 0.00 C ATOM 606 O HIS A 39 -3.685 -20.836 -3.202 1.00 0.00 O ATOM 607 CB HIS A 39 -1.000 -20.366 -2.454 1.00 0.00 C ATOM 608 CG HIS A 39 0.496 -20.253 -2.359 1.00 0.00 C ATOM 609 ND1 HIS A 39 1.270 -20.601 -1.251 1.00 0.00 N ATOM 610 CD2 HIS A 39 1.309 -19.793 -3.356 1.00 0.00 C ATOM 611 CE1 HIS A 39 2.539 -20.364 -1.622 1.00 0.00 C ATOM 612 NE2 HIS A 39 2.593 -19.888 -2.880 1.00 0.00 N ATOM 0 H HIS A 39 -1.648 -21.825 -4.920 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.129 -22.509 -2.143 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -1.361 -19.647 -3.189 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -1.436 -20.088 -1.494 1.00 0.00 H new ATOM 0 HD2 HIS A 39 1.003 -19.428 -4.325 1.00 0.00 H new ATOM 0 HE1 HIS A 39 3.402 -20.533 -0.994 1.00 0.00 H new ATOM 0 HE2 HIS A 39 3.441 -19.641 -3.391 1.00 0.00 H new ATOM 620 N ILE A 40 -3.589 -22.874 -2.240 1.00 0.00 N ATOM 621 CA ILE A 40 -5.019 -22.981 -2.005 1.00 0.00 C ATOM 622 C ILE A 40 -5.391 -22.217 -0.740 1.00 0.00 C ATOM 623 O ILE A 40 -6.569 -21.984 -0.494 1.00 0.00 O ATOM 624 CB ILE A 40 -5.448 -24.448 -1.859 1.00 0.00 C ATOM 625 CG1 ILE A 40 -4.443 -25.323 -1.091 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.782 -25.029 -3.229 1.00 0.00 C ATOM 627 CD1 ILE A 40 -3.360 -25.958 -1.975 1.00 0.00 C ATOM 0 H ILE A 40 -3.060 -23.701 -1.961 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.537 -22.553 -2.863 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.344 -24.455 -1.239 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.961 -24.716 -0.324 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.987 -26.115 -0.576 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.086 -26.070 -3.119 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.596 -24.459 -3.677 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.903 -24.974 -3.872 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.692 -26.559 -1.357 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.830 -26.594 -2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.788 -25.173 -2.470 1.00 0.00 H new ATOM 639 N ASP A 41 -4.396 -21.826 0.060 1.00 0.00 N ATOM 640 CA ASP A 41 -4.599 -21.149 1.331 1.00 0.00 C ATOM 641 C ASP A 41 -5.391 -19.849 1.186 1.00 0.00 C ATOM 642 O ASP A 41 -5.947 -19.353 2.165 1.00 0.00 O ATOM 643 CB ASP A 41 -3.239 -20.843 1.956 1.00 0.00 C ATOM 644 CG ASP A 41 -2.349 -22.071 2.156 1.00 0.00 C ATOM 645 OD1 ASP A 41 -1.211 -21.854 2.626 1.00 0.00 O ATOM 646 OD2 ASP A 41 -2.802 -23.193 1.844 1.00 0.00 O1- ATOM 0 H ASP A 41 -3.413 -21.976 -0.166 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.182 -21.815 1.968 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.714 -20.127 1.323 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.396 -20.361 2.921 1.00 0.00 H new ATOM 651 N ILE A 42 -5.443 -19.297 -0.032 1.00 0.00 N ATOM 652 CA ILE A 42 -6.192 -18.083 -0.329 1.00 0.00 C ATOM 653 C ILE A 42 -7.386 -18.373 -1.243 1.00 0.00 C ATOM 654 O ILE A 42 -7.905 -17.462 -1.884 1.00 0.00 O ATOM 655 CB ILE A 42 -5.279 -16.994 -0.901 1.00 0.00 C ATOM 656 CG1 ILE A 42 -4.420 -17.500 -2.067 1.00 0.00 C ATOM 657 CG2 ILE A 42 -4.449 -16.349 0.209 1.00 0.00 C ATOM 658 CD1 ILE A 42 -2.987 -17.838 -1.669 1.00 0.00 C ATOM 0 H ILE A 42 -4.961 -19.688 -0.841 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.596 -17.702 0.609 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.915 -16.218 -1.327 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -4.888 -18.387 -2.494 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.401 -16.741 -2.849 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.807 -15.578 -0.218 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -5.114 -15.900 0.947 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.833 -17.108 0.691 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.440 -18.189 -2.544 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.501 -16.948 -1.270 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -2.995 -18.619 -0.909 1.00 0.00 H new ATOM 670 N GLU A 43 -7.834 -19.631 -1.315 1.00 0.00 N ATOM 671 CA GLU A 43 -8.992 -19.984 -2.129 1.00 0.00 C ATOM 672 C GLU A 43 -10.205 -19.109 -1.799 1.00 0.00 C ATOM 673 O GLU A 43 -11.053 -18.883 -2.657 1.00 0.00 O ATOM 674 CB GLU A 43 -9.316 -21.466 -1.926 1.00 0.00 C ATOM 675 CG GLU A 43 -9.618 -21.854 -0.473 1.00 0.00 C ATOM 676 CD GLU A 43 -11.003 -21.441 0.020 1.00 0.00 C ATOM 677 OE1 GLU A 43 -11.920 -21.304 -0.819 1.00 0.00 O ATOM 678 OE2 GLU A 43 -11.114 -21.268 1.253 1.00 0.00 O1- ATOM 0 H GLU A 43 -7.411 -20.416 -0.820 1.00 0.00 H new ATOM 0 HA GLU A 43 -8.749 -19.805 -3.176 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -10.175 -21.726 -2.545 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.475 -22.062 -2.281 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -9.518 -22.935 -0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -8.866 -21.401 0.174 1.00 0.00 H new ATOM 685 N SER A 44 -10.286 -18.617 -0.560 1.00 0.00 N ATOM 686 CA SER A 44 -11.421 -17.823 -0.117 1.00 0.00 C ATOM 687 C SER A 44 -11.513 -16.496 -0.877 1.00 0.00 C ATOM 688 O SER A 44 -12.589 -16.141 -1.361 1.00 0.00 O ATOM 689 CB SER A 44 -11.317 -17.589 1.394 1.00 0.00 C ATOM 690 OG SER A 44 -12.361 -16.741 1.823 1.00 0.00 O ATOM 0 H SER A 44 -9.571 -18.759 0.154 1.00 0.00 H new ATOM 0 HA SER A 44 -12.337 -18.373 -0.332 1.00 0.00 H new ATOM 0 HB2 SER A 44 -11.370 -18.541 1.922 1.00 0.00 H new ATOM 0 HB3 SER A 44 -10.352 -17.143 1.636 1.00 0.00 H new ATOM 0 HG SER A 44 -12.289 -16.597 2.790 1.00 0.00 H new ATOM 696 N LYS A 45 -10.400 -15.757 -0.988 1.00 0.00 N ATOM 697 CA LYS A 45 -10.401 -14.488 -1.710 1.00 0.00 C ATOM 698 C LYS A 45 -10.478 -14.732 -3.214 1.00 0.00 C ATOM 699 O LYS A 45 -10.915 -13.861 -3.963 1.00 0.00 O ATOM 700 CB LYS A 45 -9.150 -13.664 -1.358 1.00 0.00 C ATOM 701 CG LYS A 45 -7.869 -14.414 -1.726 1.00 0.00 C ATOM 702 CD LYS A 45 -6.600 -13.571 -1.584 1.00 0.00 C ATOM 703 CE LYS A 45 -6.451 -13.032 -0.167 1.00 0.00 C ATOM 704 NZ LYS A 45 -5.098 -12.503 0.087 1.00 0.00 N1+ ATOM 0 H LYS A 45 -9.498 -16.017 -0.589 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.280 -13.919 -1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.180 -12.710 -1.885 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -9.148 -13.439 -0.292 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.781 -15.297 -1.093 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.947 -14.766 -2.755 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.729 -14.175 -1.840 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.631 -12.741 -2.290 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -7.185 -12.243 -0.001 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.669 -13.826 0.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.741 -12.882 0.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.463 -12.789 -0.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.135 -11.465 0.138 1.00 0.00 H new ATOM 718 N ILE A 46 -10.051 -15.920 -3.655 1.00 0.00 N ATOM 719 CA ILE A 46 -10.041 -16.285 -5.061 1.00 0.00 C ATOM 720 C ILE A 46 -11.461 -16.533 -5.552 1.00 0.00 C ATOM 721 O ILE A 46 -11.870 -15.970 -6.566 1.00 0.00 O ATOM 722 CB ILE A 46 -9.154 -17.523 -5.238 1.00 0.00 C ATOM 723 CG1 ILE A 46 -7.691 -17.098 -5.064 1.00 0.00 C ATOM 724 CG2 ILE A 46 -9.378 -18.173 -6.605 1.00 0.00 C ATOM 725 CD1 ILE A 46 -6.768 -18.302 -4.890 1.00 0.00 C ATOM 0 H ILE A 46 -9.703 -16.653 -3.038 1.00 0.00 H new ATOM 0 HA ILE A 46 -9.633 -15.471 -5.661 1.00 0.00 H new ATOM 0 HB ILE A 46 -9.413 -18.269 -4.487 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.375 -16.520 -5.932 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.603 -16.444 -4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.735 -19.048 -6.701 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.421 -18.477 -6.697 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.138 -17.458 -7.392 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.741 -17.958 -4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.068 -18.866 -4.007 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.836 -18.943 -5.769 1.00 0.00 H new ATOM 737 N ILE A 47 -12.216 -17.371 -4.836 1.00 0.00 N ATOM 738 CA ILE A 47 -13.582 -17.685 -5.215 1.00 0.00 C ATOM 739 C ILE A 47 -14.459 -16.448 -5.074 1.00 0.00 C ATOM 740 O ILE A 47 -15.340 -16.214 -5.901 1.00 0.00 O ATOM 741 CB ILE A 47 -14.117 -18.831 -4.343 1.00 0.00 C ATOM 742 CG1 ILE A 47 -13.361 -20.137 -4.613 1.00 0.00 C ATOM 743 CG2 ILE A 47 -15.616 -19.039 -4.580 1.00 0.00 C ATOM 744 CD1 ILE A 47 -13.502 -20.647 -6.051 1.00 0.00 C ATOM 0 H ILE A 47 -11.896 -17.842 -3.989 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.601 -18.005 -6.257 1.00 0.00 H new ATOM 0 HB ILE A 47 -13.958 -18.551 -3.302 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -12.304 -19.986 -4.393 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -13.723 -20.904 -3.928 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.974 -19.855 -3.952 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.154 -18.125 -4.329 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.788 -19.285 -5.628 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -12.940 -21.574 -6.165 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.554 -20.831 -6.270 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -13.113 -19.899 -6.742 1.00 0.00 H new ATOM 756 N SER A 48 -14.229 -15.645 -4.033 1.00 0.00 N ATOM 757 CA SER A 48 -15.037 -14.456 -3.818 1.00 0.00 C ATOM 758 C SER A 48 -14.790 -13.412 -4.903 1.00 0.00 C ATOM 759 O SER A 48 -15.708 -12.702 -5.298 1.00 0.00 O ATOM 760 CB SER A 48 -14.724 -13.862 -2.448 1.00 0.00 C ATOM 761 OG SER A 48 -15.569 -12.756 -2.206 1.00 0.00 O ATOM 0 H SER A 48 -13.499 -15.798 -3.337 1.00 0.00 H new ATOM 0 HA SER A 48 -16.087 -14.747 -3.862 1.00 0.00 H new ATOM 0 HB2 SER A 48 -14.864 -14.616 -1.673 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.680 -13.551 -2.405 1.00 0.00 H new ATOM 0 HG SER A 48 -15.367 -12.377 -1.325 1.00 0.00 H new ATOM 767 N LEU A 49 -13.553 -13.302 -5.401 1.00 0.00 N ATOM 768 CA LEU A 49 -13.239 -12.277 -6.379 1.00 0.00 C ATOM 769 C LEU A 49 -13.729 -12.640 -7.782 1.00 0.00 C ATOM 770 O LEU A 49 -14.116 -11.751 -8.538 1.00 0.00 O ATOM 771 CB LEU A 49 -11.738 -11.995 -6.333 1.00 0.00 C ATOM 772 CG LEU A 49 -11.335 -10.862 -7.274 1.00 0.00 C ATOM 773 CD1 LEU A 49 -12.108 -9.568 -6.999 1.00 0.00 C ATOM 774 CD2 LEU A 49 -9.848 -10.569 -7.111 1.00 0.00 C ATOM 0 H LEU A 49 -12.771 -13.904 -5.143 1.00 0.00 H new ATOM 0 HA LEU A 49 -13.775 -11.363 -6.123 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -11.449 -11.739 -5.314 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -11.192 -12.899 -6.601 1.00 0.00 H new ATOM 0 HG LEU A 49 -11.567 -11.193 -8.286 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.783 -8.795 -7.696 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -13.175 -9.747 -7.128 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -11.916 -9.240 -5.977 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -9.561 -9.760 -7.783 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.646 -10.274 -6.081 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.272 -11.463 -7.352 1.00 0.00 H new ATOM 786 N ILE A 50 -13.725 -13.927 -8.155 1.00 0.00 N ATOM 787 CA ILE A 50 -14.236 -14.316 -9.468 1.00 0.00 C ATOM 788 C ILE A 50 -15.748 -14.152 -9.518 1.00 0.00 C ATOM 789 O ILE A 50 -16.269 -13.651 -10.516 1.00 0.00 O ATOM 790 CB ILE A 50 -13.868 -15.762 -9.838 1.00 0.00 C ATOM 791 CG1 ILE A 50 -14.263 -16.736 -8.721 1.00 0.00 C ATOM 792 CG2 ILE A 50 -12.390 -15.866 -10.207 1.00 0.00 C ATOM 793 CD1 ILE A 50 -13.665 -18.126 -8.902 1.00 0.00 C ATOM 0 H ILE A 50 -13.382 -14.696 -7.580 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.765 -13.656 -10.196 1.00 0.00 H new ATOM 0 HB ILE A 50 -14.439 -16.050 -10.720 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.941 -16.330 -7.762 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -15.349 -16.816 -8.684 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.151 -16.898 -10.465 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.182 -15.221 -11.060 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.780 -15.554 -9.359 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.981 -18.768 -8.080 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.008 -18.550 -9.846 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -12.577 -18.056 -8.910 1.00 0.00 H new ATOM 805 N ILE A 51 -16.466 -14.561 -8.466 1.00 0.00 N ATOM 806 CA ILE A 51 -17.915 -14.374 -8.469 1.00 0.00 C ATOM 807 C ILE A 51 -18.269 -12.890 -8.510 1.00 0.00 C ATOM 808 O ILE A 51 -19.234 -12.504 -9.165 1.00 0.00 O ATOM 809 CB ILE A 51 -18.578 -15.061 -7.269 1.00 0.00 C ATOM 810 CG1 ILE A 51 -18.092 -14.432 -5.957 1.00 0.00 C ATOM 811 CG2 ILE A 51 -18.309 -16.567 -7.336 1.00 0.00 C ATOM 812 CD1 ILE A 51 -18.740 -15.059 -4.726 1.00 0.00 C ATOM 0 H ILE A 51 -16.083 -15.007 -7.632 1.00 0.00 H new ATOM 0 HA ILE A 51 -18.305 -14.846 -9.371 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.658 -14.915 -7.303 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -17.010 -14.539 -5.887 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -18.306 -13.363 -5.970 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.779 -17.059 -6.484 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.722 -16.970 -8.261 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -17.234 -16.746 -7.311 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.358 -14.574 -3.827 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -19.821 -14.928 -4.777 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.504 -16.123 -4.693 1.00 0.00 H new ATOM 824 N ASP A 52 -17.500 -12.044 -7.819 1.00 0.00 N ATOM 825 CA ASP A 52 -17.757 -10.615 -7.840 1.00 0.00 C ATOM 826 C ASP A 52 -17.462 -10.011 -9.213 1.00 0.00 C ATOM 827 O ASP A 52 -18.231 -9.172 -9.682 1.00 0.00 O ATOM 828 CB ASP A 52 -16.955 -9.938 -6.729 1.00 0.00 C ATOM 829 CG ASP A 52 -17.487 -10.324 -5.350 1.00 0.00 C ATOM 830 OD1 ASP A 52 -18.586 -10.923 -5.300 1.00 0.00 O ATOM 831 OD2 ASP A 52 -16.786 -10.015 -4.363 1.00 0.00 O1- ATOM 0 H ASP A 52 -16.705 -12.327 -7.246 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.817 -10.442 -7.654 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.906 -10.222 -6.809 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -17.003 -8.856 -6.850 1.00 0.00 H new ATOM 836 N TYR A 53 -16.373 -10.411 -9.873 1.00 0.00 N ATOM 837 CA TYR A 53 -16.087 -9.910 -11.212 1.00 0.00 C ATOM 838 C TYR A 53 -17.181 -10.373 -12.165 1.00 0.00 C ATOM 839 O TYR A 53 -17.645 -9.598 -12.999 1.00 0.00 O ATOM 840 CB TYR A 53 -14.719 -10.420 -11.673 1.00 0.00 C ATOM 841 CG TYR A 53 -14.375 -10.207 -13.139 1.00 0.00 C ATOM 842 CD1 TYR A 53 -14.564 -8.961 -13.763 1.00 0.00 C ATOM 843 CD2 TYR A 53 -13.856 -11.278 -13.880 1.00 0.00 C ATOM 844 CE1 TYR A 53 -14.206 -8.781 -15.109 1.00 0.00 C ATOM 845 CE2 TYR A 53 -13.498 -11.105 -15.225 1.00 0.00 C ATOM 846 CZ TYR A 53 -13.673 -9.855 -15.845 1.00 0.00 C ATOM 847 OH TYR A 53 -13.331 -9.686 -17.153 1.00 0.00 O ATOM 0 H TYR A 53 -15.686 -11.070 -9.506 1.00 0.00 H new ATOM 0 HA TYR A 53 -16.064 -8.820 -11.203 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -13.953 -9.935 -11.069 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -14.664 -11.488 -11.461 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -14.986 -8.139 -13.205 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -13.731 -12.243 -13.412 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -14.340 -7.818 -15.579 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -13.088 -11.932 -15.785 1.00 0.00 H new ATOM 0 HH TYR A 53 -13.057 -8.757 -17.302 1.00 0.00 H new ATOM 857 N SER A 54 -17.595 -11.640 -12.045 1.00 0.00 N ATOM 858 CA SER A 54 -18.581 -12.214 -12.944 1.00 0.00 C ATOM 859 C SER A 54 -19.967 -11.603 -12.743 1.00 0.00 C ATOM 860 O SER A 54 -20.773 -11.618 -13.669 1.00 0.00 O ATOM 861 CB SER A 54 -18.643 -13.724 -12.724 1.00 0.00 C ATOM 862 OG SER A 54 -19.495 -14.301 -13.692 1.00 0.00 O ATOM 0 H SER A 54 -17.256 -12.282 -11.329 1.00 0.00 H new ATOM 0 HA SER A 54 -18.274 -11.993 -13.966 1.00 0.00 H new ATOM 0 HB2 SER A 54 -17.645 -14.155 -12.798 1.00 0.00 H new ATOM 0 HB3 SER A 54 -19.011 -13.942 -11.722 1.00 0.00 H new ATOM 0 HG SER A 54 -19.110 -15.146 -14.005 1.00 0.00 H new ATOM 868 N ARG A 55 -20.265 -11.063 -11.556 1.00 0.00 N ATOM 869 CA ARG A 55 -21.569 -10.464 -11.303 1.00 0.00 C ATOM 870 C ARG A 55 -21.616 -9.001 -11.739 1.00 0.00 C ATOM 871 O ARG A 55 -22.671 -8.528 -12.151 1.00 0.00 O ATOM 872 CB ARG A 55 -21.921 -10.637 -9.828 1.00 0.00 C ATOM 873 CG ARG A 55 -22.326 -12.100 -9.629 1.00 0.00 C ATOM 874 CD ARG A 55 -22.820 -12.341 -8.208 1.00 0.00 C ATOM 875 NE ARG A 55 -21.759 -12.139 -7.216 1.00 0.00 N ATOM 876 CZ ARG A 55 -21.860 -12.507 -5.934 1.00 0.00 C ATOM 877 NH1 ARG A 55 -22.943 -13.148 -5.487 1.00 0.00 N1+ ATOM 878 NH2 ARG A 55 -20.874 -12.238 -5.078 1.00 0.00 N ATOM 0 H ARG A 55 -19.623 -11.031 -10.764 1.00 0.00 H new ATOM 0 HA ARG A 55 -22.319 -10.977 -11.904 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.069 -10.384 -9.197 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -22.736 -9.970 -9.546 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -23.109 -12.364 -10.340 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -21.475 -12.748 -9.837 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -23.650 -11.668 -7.994 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.205 -13.357 -8.125 1.00 0.00 H new ATOM 0 HE ARG A 55 -20.894 -11.692 -7.521 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -23.708 -13.364 -6.126 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -23.005 -13.422 -4.506 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -20.038 -11.750 -5.400 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -20.955 -12.520 -4.101 1.00 0.00 H new ATOM 892 N LEU A 56 -20.494 -8.285 -11.657 1.00 0.00 N ATOM 893 CA LEU A 56 -20.436 -6.877 -12.032 1.00 0.00 C ATOM 894 C LEU A 56 -20.207 -6.666 -13.528 1.00 0.00 C ATOM 895 O LEU A 56 -20.848 -5.820 -14.148 1.00 0.00 O ATOM 896 CB LEU A 56 -19.275 -6.222 -11.289 1.00 0.00 C ATOM 897 CG LEU A 56 -19.441 -6.291 -9.773 1.00 0.00 C ATOM 898 CD1 LEU A 56 -18.090 -5.956 -9.148 1.00 0.00 C ATOM 899 CD2 LEU A 56 -20.500 -5.296 -9.311 1.00 0.00 C ATOM 0 H LEU A 56 -19.606 -8.665 -11.330 1.00 0.00 H new ATOM 0 HA LEU A 56 -21.399 -6.437 -11.772 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.343 -6.712 -11.572 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -19.193 -5.179 -11.596 1.00 0.00 H new ATOM 0 HG LEU A 56 -19.766 -7.286 -9.469 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -18.172 -5.996 -8.062 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -17.345 -6.678 -9.483 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.787 -4.954 -9.452 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -20.608 -5.356 -8.228 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -20.197 -4.287 -9.590 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -21.453 -5.533 -9.784 1.00 0.00 H new ATOM 911 N CYS A 57 -19.286 -7.442 -14.100 1.00 0.00 N ATOM 912 CA CYS A 57 -18.844 -7.277 -15.480 1.00 0.00 C ATOM 913 C CYS A 57 -19.970 -7.444 -16.514 1.00 0.00 C ATOM 914 O CYS A 57 -20.970 -8.112 -16.250 1.00 0.00 O ATOM 915 CB CYS A 57 -17.706 -8.262 -15.746 1.00 0.00 C ATOM 916 SG CYS A 57 -18.371 -9.943 -15.855 1.00 0.00 S ATOM 0 H CYS A 57 -18.823 -8.209 -13.612 1.00 0.00 H new ATOM 0 HA CYS A 57 -18.499 -6.250 -15.598 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -17.195 -8.001 -16.673 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -16.967 -8.204 -14.947 1.00 0.00 H new ATOM 0 HG CYS A 57 -17.408 -10.802 -15.696 1.00 0.00 H new ATOM 922 N PRO A 58 -19.804 -6.833 -17.699 1.00 0.00 N ATOM 923 CA PRO A 58 -20.731 -6.924 -18.820 1.00 0.00 C ATOM 924 C PRO A 58 -20.617 -8.273 -19.536 1.00 0.00 C ATOM 925 O PRO A 58 -19.846 -9.134 -19.128 1.00 0.00 O ATOM 926 CB PRO A 58 -20.334 -5.771 -19.742 1.00 0.00 C ATOM 927 CG PRO A 58 -18.826 -5.696 -19.538 1.00 0.00 C ATOM 928 CD PRO A 58 -18.674 -5.989 -18.046 1.00 0.00 C ATOM 0 HA PRO A 58 -21.770 -6.855 -18.497 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -20.594 -5.973 -20.781 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -20.829 -4.840 -19.465 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -18.298 -6.427 -20.150 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.430 -4.715 -19.800 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.730 -6.493 -17.839 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.678 -5.068 -17.463 1.00 0.00 H new ATOM 936 N ASP A 59 -21.391 -8.451 -20.613 1.00 0.00 N ATOM 937 CA ASP A 59 -21.557 -9.712 -21.333 1.00 0.00 C ATOM 938 C ASP A 59 -20.255 -10.354 -21.817 1.00 0.00 C ATOM 939 O ASP A 59 -20.023 -11.536 -21.565 1.00 0.00 O ATOM 940 CB ASP A 59 -22.450 -9.449 -22.550 1.00 0.00 C ATOM 941 CG ASP A 59 -22.207 -8.060 -23.134 1.00 0.00 C ATOM 942 OD1 ASP A 59 -21.100 -7.852 -23.679 1.00 0.00 O ATOM 943 OD2 ASP A 59 -23.139 -7.235 -23.025 1.00 0.00 O1- ATOM 0 H ASP A 59 -21.937 -7.691 -21.019 1.00 0.00 H new ATOM 0 HA ASP A 59 -21.994 -10.416 -20.625 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -22.259 -10.204 -23.313 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -23.497 -9.545 -22.262 1.00 0.00 H new ATOM 948 N SER A 60 -19.399 -9.604 -22.508 1.00 0.00 N ATOM 949 CA SER A 60 -18.178 -10.177 -23.058 1.00 0.00 C ATOM 950 C SER A 60 -17.239 -10.586 -21.927 1.00 0.00 C ATOM 951 O SER A 60 -16.584 -11.626 -21.991 1.00 0.00 O ATOM 952 CB SER A 60 -17.525 -9.150 -23.981 1.00 0.00 C ATOM 953 OG SER A 60 -18.436 -8.782 -24.999 1.00 0.00 O ATOM 0 H SER A 60 -19.528 -8.610 -22.698 1.00 0.00 H new ATOM 0 HA SER A 60 -18.408 -11.072 -23.636 1.00 0.00 H new ATOM 0 HB2 SER A 60 -17.227 -8.271 -23.410 1.00 0.00 H new ATOM 0 HB3 SER A 60 -16.619 -9.566 -24.422 1.00 0.00 H new ATOM 0 HG SER A 60 -18.017 -8.122 -25.590 1.00 0.00 H new ATOM 959 N HIS A 61 -17.177 -9.757 -20.881 1.00 0.00 N ATOM 960 CA HIS A 61 -16.371 -10.044 -19.710 1.00 0.00 C ATOM 961 C HIS A 61 -17.042 -11.112 -18.846 1.00 0.00 C ATOM 962 O HIS A 61 -16.386 -11.715 -18.002 1.00 0.00 O ATOM 963 CB HIS A 61 -16.147 -8.735 -18.959 1.00 0.00 C ATOM 964 CG HIS A 61 -15.422 -7.734 -19.814 1.00 0.00 C ATOM 965 ND1 HIS A 61 -16.002 -6.937 -20.808 1.00 0.00 N ATOM 966 CD2 HIS A 61 -14.086 -7.464 -19.749 1.00 0.00 C ATOM 967 CE1 HIS A 61 -14.994 -6.208 -21.310 1.00 0.00 C ATOM 968 NE2 HIS A 61 -13.834 -6.499 -20.696 1.00 0.00 N ATOM 0 H HIS A 61 -17.685 -8.874 -20.830 1.00 0.00 H new ATOM 0 HA HIS A 61 -15.402 -10.453 -19.996 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -17.107 -8.323 -18.647 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -15.573 -8.927 -18.053 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -13.367 -7.919 -19.084 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -15.100 -5.483 -22.103 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -12.927 -6.078 -20.897 1.00 0.00 H new ATOM 976 N LYS A 62 -18.341 -11.348 -19.050 1.00 0.00 N ATOM 977 CA LYS A 62 -19.070 -12.421 -18.386 1.00 0.00 C ATOM 978 C LYS A 62 -18.543 -13.762 -18.882 1.00 0.00 C ATOM 979 O LYS A 62 -18.305 -14.672 -18.092 1.00 0.00 O ATOM 980 CB LYS A 62 -20.557 -12.303 -18.739 1.00 0.00 C ATOM 981 CG LYS A 62 -21.463 -13.071 -17.777 1.00 0.00 C ATOM 982 CD LYS A 62 -21.602 -12.379 -16.422 1.00 0.00 C ATOM 983 CE LYS A 62 -22.109 -10.948 -16.607 1.00 0.00 C ATOM 984 NZ LYS A 62 -22.411 -10.308 -15.316 1.00 0.00 N1+ ATOM 0 H LYS A 62 -18.916 -10.794 -19.685 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.938 -12.350 -17.306 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -20.843 -11.251 -18.737 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.715 -12.674 -19.752 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -22.450 -13.185 -18.226 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -21.063 -14.074 -17.629 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -22.292 -12.938 -15.790 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -20.639 -12.368 -15.911 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -21.359 -10.362 -17.138 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -23.005 -10.956 -17.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -22.097 -9.317 -15.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -23.436 -10.343 -15.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -21.914 -10.812 -14.554 1.00 0.00 H new ATOM 998 N LEU A 63 -18.364 -13.877 -20.203 1.00 0.00 N ATOM 999 CA LEU A 63 -17.823 -15.082 -20.810 1.00 0.00 C ATOM 1000 C LEU A 63 -16.389 -15.269 -20.312 1.00 0.00 C ATOM 1001 O LEU A 63 -15.977 -16.378 -19.976 1.00 0.00 O ATOM 1002 CB LEU A 63 -17.866 -14.920 -22.336 1.00 0.00 C ATOM 1003 CG LEU A 63 -18.146 -16.235 -23.073 1.00 0.00 C ATOM 1004 CD1 LEU A 63 -17.933 -16.014 -24.566 1.00 0.00 C ATOM 1005 CD2 LEU A 63 -17.224 -17.365 -22.622 1.00 0.00 C ATOM 0 H LEU A 63 -18.590 -13.139 -20.870 1.00 0.00 H new ATOM 0 HA LEU A 63 -18.405 -15.962 -20.538 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -18.636 -14.193 -22.597 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -16.915 -14.514 -22.679 1.00 0.00 H new ATOM 0 HG LEU A 63 -19.172 -16.526 -22.848 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -18.129 -16.942 -25.103 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -18.614 -15.240 -24.920 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -16.904 -15.702 -24.744 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -17.464 -18.273 -23.175 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -16.188 -17.087 -22.813 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -17.361 -17.543 -21.555 1.00 0.00 H new ATOM 1017 N GLY A 64 -15.622 -14.173 -20.261 1.00 0.00 N ATOM 1018 CA GLY A 64 -14.253 -14.214 -19.772 1.00 0.00 C ATOM 1019 C GLY A 64 -14.188 -14.554 -18.282 1.00 0.00 C ATOM 1020 O GLY A 64 -13.248 -15.213 -17.843 1.00 0.00 O ATOM 0 H GLY A 64 -15.935 -13.248 -20.555 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.688 -14.954 -20.338 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.777 -13.249 -19.945 1.00 0.00 H new ATOM 1024 N SER A 65 -15.174 -14.111 -17.495 1.00 0.00 N ATOM 1025 CA SER A 65 -15.231 -14.424 -16.074 1.00 0.00 C ATOM 1026 C SER A 65 -15.422 -15.920 -15.869 1.00 0.00 C ATOM 1027 O SER A 65 -14.788 -16.508 -14.995 1.00 0.00 O ATOM 1028 CB SER A 65 -16.384 -13.675 -15.421 1.00 0.00 C ATOM 1029 OG SER A 65 -16.203 -12.284 -15.546 1.00 0.00 O ATOM 0 H SER A 65 -15.945 -13.531 -17.826 1.00 0.00 H new ATOM 0 HA SER A 65 -14.291 -14.117 -15.615 1.00 0.00 H new ATOM 0 HB2 SER A 65 -17.325 -13.968 -15.886 1.00 0.00 H new ATOM 0 HB3 SER A 65 -16.451 -13.946 -14.367 1.00 0.00 H new ATOM 0 HG SER A 65 -15.423 -12.007 -15.021 1.00 0.00 H new ATOM 1035 N LEU A 66 -16.295 -16.533 -16.672 1.00 0.00 N ATOM 1036 CA LEU A 66 -16.548 -17.962 -16.574 1.00 0.00 C ATOM 1037 C LEU A 66 -15.322 -18.749 -17.031 1.00 0.00 C ATOM 1038 O LEU A 66 -15.117 -19.875 -16.587 1.00 0.00 O ATOM 1039 CB LEU A 66 -17.782 -18.313 -17.410 1.00 0.00 C ATOM 1040 CG LEU A 66 -19.047 -17.658 -16.840 1.00 0.00 C ATOM 1041 CD1 LEU A 66 -20.178 -17.790 -17.856 1.00 0.00 C ATOM 1042 CD2 LEU A 66 -19.490 -18.326 -15.539 1.00 0.00 C ATOM 0 H LEU A 66 -16.835 -16.058 -17.395 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.743 -18.232 -15.536 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.632 -17.985 -18.439 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.910 -19.395 -17.436 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.820 -16.612 -16.635 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -21.081 -17.327 -17.458 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.894 -17.293 -18.783 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -20.368 -18.845 -18.053 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -20.389 -17.835 -15.166 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.702 -19.379 -15.725 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.696 -18.241 -14.798 1.00 0.00 H new ATOM 1054 N TYR A 67 -14.506 -18.170 -17.915 1.00 0.00 N ATOM 1055 CA TYR A 67 -13.265 -18.796 -18.345 1.00 0.00 C ATOM 1056 C TYR A 67 -12.244 -18.845 -17.212 1.00 0.00 C ATOM 1057 O TYR A 67 -11.521 -19.832 -17.068 1.00 0.00 O ATOM 1058 CB TYR A 67 -12.698 -18.004 -19.514 1.00 0.00 C ATOM 1059 CG TYR A 67 -12.888 -18.685 -20.843 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -11.796 -18.765 -21.718 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -14.130 -19.235 -21.201 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -11.946 -19.401 -22.958 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -14.281 -19.883 -22.433 1.00 0.00 C ATOM 1064 CZ TYR A 67 -13.183 -19.972 -23.315 1.00 0.00 C ATOM 1065 OH TYR A 67 -13.318 -20.610 -24.513 1.00 0.00 O ATOM 0 H TYR A 67 -14.689 -17.264 -18.346 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.476 -19.822 -18.646 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -13.174 -17.024 -19.545 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.634 -17.837 -19.348 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -10.844 -18.339 -21.438 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.969 -19.158 -20.525 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -11.111 -19.453 -23.641 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -15.233 -20.313 -22.707 1.00 0.00 H new ATOM 0 HH TYR A 67 -14.234 -20.947 -24.603 1.00 0.00 H new ATOM 1075 N ILE A 68 -12.173 -17.789 -16.399 1.00 0.00 N ATOM 1076 CA ILE A 68 -11.286 -17.769 -15.252 1.00 0.00 C ATOM 1077 C ILE A 68 -11.756 -18.806 -14.237 1.00 0.00 C ATOM 1078 O ILE A 68 -10.973 -19.656 -13.818 1.00 0.00 O ATOM 1079 CB ILE A 68 -11.276 -16.359 -14.654 1.00 0.00 C ATOM 1080 CG1 ILE A 68 -10.575 -15.400 -15.623 1.00 0.00 C ATOM 1081 CG2 ILE A 68 -10.546 -16.345 -13.310 1.00 0.00 C ATOM 1082 CD1 ILE A 68 -11.178 -14.004 -15.533 1.00 0.00 C ATOM 0 H ILE A 68 -12.723 -16.939 -16.521 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.268 -18.022 -15.547 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.306 -16.042 -14.494 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.510 -15.357 -15.393 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.666 -15.775 -16.642 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -10.551 -15.334 -12.904 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.049 -17.018 -12.616 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.516 -16.674 -13.452 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -10.665 -13.341 -16.229 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.237 -14.048 -15.787 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -11.064 -13.623 -14.518 1.00 0.00 H new ATOM 1094 N ILE A 69 -13.031 -18.728 -13.849 1.00 0.00 N ATOM 1095 CA ILE A 69 -13.684 -19.698 -12.981 1.00 0.00 C ATOM 1096 C ILE A 69 -13.467 -21.131 -13.471 1.00 0.00 C ATOM 1097 O ILE A 69 -13.307 -22.031 -12.649 1.00 0.00 O ATOM 1098 CB ILE A 69 -15.186 -19.375 -12.940 1.00 0.00 C ATOM 1099 CG1 ILE A 69 -15.427 -18.023 -12.256 1.00 0.00 C ATOM 1100 CG2 ILE A 69 -15.965 -20.468 -12.200 1.00 0.00 C ATOM 1101 CD1 ILE A 69 -16.829 -17.486 -12.533 1.00 0.00 C ATOM 0 H ILE A 69 -13.648 -17.969 -14.139 1.00 0.00 H new ATOM 0 HA ILE A 69 -13.250 -19.630 -11.983 1.00 0.00 H new ATOM 0 HB ILE A 69 -15.542 -19.327 -13.969 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -15.285 -18.130 -11.181 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -14.687 -17.303 -12.605 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -17.025 -20.214 -12.186 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -15.827 -21.422 -12.710 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -15.598 -20.547 -11.177 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -16.957 -16.527 -12.030 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -16.962 -17.353 -13.607 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -17.570 -18.193 -12.160 1.00 0.00 H new ATOM 1113 N ASP A 70 -13.461 -21.356 -14.789 1.00 0.00 N ATOM 1114 CA ASP A 70 -13.260 -22.686 -15.344 1.00 0.00 C ATOM 1115 C ASP A 70 -11.835 -23.166 -15.114 1.00 0.00 C ATOM 1116 O ASP A 70 -11.622 -24.300 -14.693 1.00 0.00 O ATOM 1117 CB ASP A 70 -13.537 -22.637 -16.849 1.00 0.00 C ATOM 1118 CG ASP A 70 -13.077 -23.911 -17.546 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -12.098 -23.823 -18.321 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -13.705 -24.961 -17.295 1.00 0.00 O1- ATOM 0 H ASP A 70 -13.594 -20.626 -15.489 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.939 -23.380 -14.849 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.604 -22.494 -17.019 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.027 -21.778 -17.286 1.00 0.00 H new ATOM 1125 N SER A 71 -10.861 -22.297 -15.388 1.00 0.00 N ATOM 1126 CA SER A 71 -9.459 -22.654 -15.295 1.00 0.00 C ATOM 1127 C SER A 71 -9.085 -22.991 -13.858 1.00 0.00 C ATOM 1128 O SER A 71 -8.569 -24.075 -13.586 1.00 0.00 O ATOM 1129 CB SER A 71 -8.623 -21.493 -15.843 1.00 0.00 C ATOM 1130 OG SER A 71 -7.243 -21.720 -15.650 1.00 0.00 O ATOM 0 H SER A 71 -11.028 -21.334 -15.678 1.00 0.00 H new ATOM 0 HA SER A 71 -9.259 -23.545 -15.889 1.00 0.00 H new ATOM 0 HB2 SER A 71 -8.828 -21.364 -16.906 1.00 0.00 H new ATOM 0 HB3 SER A 71 -8.914 -20.567 -15.348 1.00 0.00 H new ATOM 0 HG SER A 71 -6.895 -21.082 -14.992 1.00 0.00 H new ATOM 1136 N ILE A 72 -9.340 -22.067 -12.931 1.00 0.00 N ATOM 1137 CA ILE A 72 -8.966 -22.266 -11.540 1.00 0.00 C ATOM 1138 C ILE A 72 -9.906 -23.266 -10.881 1.00 0.00 C ATOM 1139 O ILE A 72 -9.486 -24.015 -10.005 1.00 0.00 O ATOM 1140 CB ILE A 72 -8.937 -20.899 -10.836 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -8.145 -20.922 -9.523 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -10.339 -20.325 -10.613 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -8.958 -21.338 -8.297 1.00 0.00 C ATOM 0 H ILE A 72 -9.802 -21.178 -13.122 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.968 -22.696 -11.463 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.411 -20.233 -11.520 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.303 -21.606 -9.634 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.729 -19.930 -9.347 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -10.262 -19.360 -10.113 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -10.837 -20.197 -11.574 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -10.918 -21.009 -9.993 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -8.318 -21.326 -7.415 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -9.785 -20.642 -8.155 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -9.352 -22.343 -8.446 1.00 0.00 H new ATOM 1155 N GLY A 73 -11.179 -23.283 -11.299 1.00 0.00 N ATOM 1156 CA GLY A 73 -12.180 -24.112 -10.660 1.00 0.00 C ATOM 1157 C GLY A 73 -11.899 -25.596 -10.873 1.00 0.00 C ATOM 1158 O GLY A 73 -11.803 -26.356 -9.905 1.00 0.00 O ATOM 0 H GLY A 73 -11.529 -22.727 -12.079 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.205 -23.895 -9.592 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.165 -23.867 -11.058 1.00 0.00 H new ATOM 1162 N ARG A 74 -11.768 -26.022 -12.131 1.00 0.00 N ATOM 1163 CA ARG A 74 -11.481 -27.423 -12.401 1.00 0.00 C ATOM 1164 C ARG A 74 -10.073 -27.766 -11.940 1.00 0.00 C ATOM 1165 O ARG A 74 -9.863 -28.862 -11.430 1.00 0.00 O ATOM 1166 CB ARG A 74 -11.631 -27.733 -13.887 1.00 0.00 C ATOM 1167 CG ARG A 74 -13.108 -27.802 -14.276 1.00 0.00 C ATOM 1168 CD ARG A 74 -13.265 -28.328 -15.702 1.00 0.00 C ATOM 1169 NE ARG A 74 -12.751 -27.369 -16.684 1.00 0.00 N ATOM 1170 CZ ARG A 74 -11.498 -27.336 -17.147 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -10.606 -28.268 -16.810 1.00 0.00 N1+ ATOM 1172 NH2 ARG A 74 -11.136 -26.350 -17.964 1.00 0.00 N ATOM 0 H ARG A 74 -11.854 -25.430 -12.957 1.00 0.00 H new ATOM 0 HA ARG A 74 -12.198 -28.030 -11.849 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.130 -26.965 -14.477 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -11.144 -28.681 -14.117 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.642 -28.451 -13.582 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.557 -26.812 -14.196 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.734 -29.275 -15.803 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -14.317 -28.529 -15.904 1.00 0.00 H new ATOM 0 HE ARG A 74 -13.402 -26.671 -17.043 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.874 -29.028 -16.185 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.655 -28.221 -17.177 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -11.811 -25.633 -18.229 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.183 -26.311 -18.326 1.00 0.00 H new ATOM 1186 N ALA A 75 -9.112 -26.851 -12.107 1.00 0.00 N ATOM 1187 CA ALA A 75 -7.752 -27.139 -11.689 1.00 0.00 C ATOM 1188 C ALA A 75 -7.681 -27.315 -10.176 1.00 0.00 C ATOM 1189 O ALA A 75 -6.836 -28.063 -9.692 1.00 0.00 O ATOM 1190 CB ALA A 75 -6.824 -26.019 -12.149 1.00 0.00 C ATOM 0 H ALA A 75 -9.253 -25.929 -12.519 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.430 -28.073 -12.149 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.804 -26.239 -11.833 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.859 -25.941 -13.236 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.145 -25.076 -11.707 1.00 0.00 H new ATOM 1196 N TYR A 76 -8.552 -26.641 -9.415 1.00 0.00 N ATOM 1197 CA TYR A 76 -8.595 -26.834 -7.975 1.00 0.00 C ATOM 1198 C TYR A 76 -9.140 -28.212 -7.639 1.00 0.00 C ATOM 1199 O TYR A 76 -8.567 -28.901 -6.799 1.00 0.00 O ATOM 1200 CB TYR A 76 -9.465 -25.767 -7.312 1.00 0.00 C ATOM 1201 CG TYR A 76 -8.685 -24.626 -6.702 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -9.272 -23.853 -5.690 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -7.384 -24.343 -7.135 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -8.545 -22.824 -5.077 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -6.643 -23.326 -6.520 1.00 0.00 C ATOM 1206 CZ TYR A 76 -7.215 -22.572 -5.474 1.00 0.00 C ATOM 1207 OH TYR A 76 -6.488 -21.602 -4.851 1.00 0.00 O ATOM 0 H TYR A 76 -9.227 -25.966 -9.775 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.577 -26.748 -7.595 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -10.156 -25.365 -8.053 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -10.068 -26.237 -6.535 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -10.288 -24.051 -5.382 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.951 -24.910 -7.945 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.002 -22.225 -4.303 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -5.634 -23.119 -6.846 1.00 0.00 H new ATOM 0 HH TYR A 76 -5.538 -21.722 -5.057 1.00 0.00 H new ATOM 1217 N LEU A 77 -10.234 -28.640 -8.271 1.00 0.00 N ATOM 1218 CA LEU A 77 -10.760 -29.951 -7.946 1.00 0.00 C ATOM 1219 C LEU A 77 -9.728 -30.994 -8.372 1.00 0.00 C ATOM 1220 O LEU A 77 -9.383 -31.879 -7.593 1.00 0.00 O ATOM 1221 CB LEU A 77 -12.095 -30.171 -8.662 1.00 0.00 C ATOM 1222 CG LEU A 77 -13.011 -31.165 -7.935 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -14.148 -31.550 -8.876 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -12.308 -32.454 -7.510 1.00 0.00 C ATOM 0 H LEU A 77 -10.749 -28.119 -8.980 1.00 0.00 H new ATOM 0 HA LEU A 77 -10.943 -30.037 -6.875 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -12.610 -29.215 -8.759 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -11.903 -30.534 -9.672 1.00 0.00 H new ATOM 0 HG LEU A 77 -13.358 -30.666 -7.030 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -14.810 -32.257 -8.376 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -14.711 -30.658 -9.151 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.737 -32.011 -9.774 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -13.019 -33.106 -7.003 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -11.915 -32.961 -8.391 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.488 -32.215 -6.833 1.00 0.00 H new ATOM 1236 N ASP A 78 -9.231 -30.889 -9.609 1.00 0.00 N ATOM 1237 CA ASP A 78 -8.245 -31.818 -10.150 1.00 0.00 C ATOM 1238 C ASP A 78 -6.988 -31.916 -9.284 1.00 0.00 C ATOM 1239 O ASP A 78 -6.506 -33.019 -9.041 1.00 0.00 O ATOM 1240 CB ASP A 78 -7.809 -31.353 -11.540 1.00 0.00 C ATOM 1241 CG ASP A 78 -8.930 -31.408 -12.574 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -8.750 -30.779 -13.640 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -9.946 -32.075 -12.282 1.00 0.00 O1- ATOM 0 H ASP A 78 -9.505 -30.154 -10.261 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.726 -32.796 -10.181 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.436 -30.331 -11.473 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.980 -31.974 -11.880 1.00 0.00 H new ATOM 1248 N GLU A 79 -6.448 -30.789 -8.813 1.00 0.00 N ATOM 1249 CA GLU A 79 -5.242 -30.816 -8.008 1.00 0.00 C ATOM 1250 C GLU A 79 -5.467 -31.562 -6.697 1.00 0.00 C ATOM 1251 O GLU A 79 -4.701 -32.466 -6.373 1.00 0.00 O ATOM 1252 CB GLU A 79 -4.779 -29.383 -7.764 1.00 0.00 C ATOM 1253 CG GLU A 79 -3.315 -29.354 -7.341 1.00 0.00 C ATOM 1254 CD GLU A 79 -3.064 -29.971 -5.967 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -2.064 -30.713 -5.863 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -3.870 -29.695 -5.051 1.00 0.00 O1- ATOM 0 H GLU A 79 -6.829 -29.857 -8.978 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.462 -31.357 -8.544 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.912 -28.793 -8.671 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.395 -28.923 -6.991 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -2.720 -29.886 -8.083 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.967 -28.321 -7.335 1.00 0.00 H new ATOM 1263 N THR A 80 -6.508 -31.197 -5.942 1.00 0.00 N ATOM 1264 CA THR A 80 -6.789 -31.859 -4.678 1.00 0.00 C ATOM 1265 C THR A 80 -7.174 -33.321 -4.911 1.00 0.00 C ATOM 1266 O THR A 80 -6.989 -34.164 -4.034 1.00 0.00 O ATOM 1267 CB THR A 80 -7.920 -31.126 -3.959 1.00 0.00 C ATOM 1268 OG1 THR A 80 -9.111 -31.239 -4.707 1.00 0.00 O ATOM 1269 CG2 THR A 80 -7.557 -29.653 -3.787 1.00 0.00 C ATOM 0 H THR A 80 -7.161 -30.453 -6.187 1.00 0.00 H new ATOM 0 HA THR A 80 -5.892 -31.836 -4.059 1.00 0.00 H new ATOM 0 HB THR A 80 -8.068 -31.574 -2.976 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.820 -30.718 -4.275 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.368 -29.136 -3.274 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.643 -29.570 -3.198 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.400 -29.200 -4.766 1.00 0.00 H new ATOM 1277 N ARG A 81 -7.713 -33.617 -6.099 1.00 0.00 N ATOM 1278 CA ARG A 81 -8.026 -34.963 -6.532 1.00 0.00 C ATOM 1279 C ARG A 81 -6.757 -35.721 -6.933 1.00 0.00 C ATOM 1280 O ARG A 81 -6.765 -36.949 -6.971 1.00 0.00 O ATOM 1281 CB ARG A 81 -9.014 -34.814 -7.685 1.00 0.00 C ATOM 1282 CG ARG A 81 -9.439 -36.132 -8.319 1.00 0.00 C ATOM 1283 CD ARG A 81 -10.812 -35.924 -8.956 1.00 0.00 C ATOM 1284 NE ARG A 81 -10.819 -34.927 -10.029 1.00 0.00 N ATOM 1285 CZ ARG A 81 -11.955 -34.488 -10.590 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -13.137 -34.987 -10.225 1.00 0.00 N1+ ATOM 1287 NH2 ARG A 81 -11.937 -33.544 -11.528 1.00 0.00 N ATOM 0 H ARG A 81 -7.944 -32.906 -6.793 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.468 -35.556 -5.731 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.902 -34.295 -7.323 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.567 -34.182 -8.452 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.714 -36.446 -9.070 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -9.482 -36.921 -7.568 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.166 -36.875 -9.354 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.518 -35.619 -8.184 1.00 0.00 H new ATOM 0 HE ARG A 81 -9.930 -34.554 -10.361 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -13.185 -35.713 -9.510 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -13.992 -34.643 -10.661 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -11.049 -33.143 -11.831 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -12.811 -33.222 -11.944 1.00 0.00 H new ATOM 1301 N SER A 82 -5.672 -34.998 -7.233 1.00 0.00 N ATOM 1302 CA SER A 82 -4.401 -35.599 -7.618 1.00 0.00 C ATOM 1303 C SER A 82 -3.451 -35.733 -6.426 1.00 0.00 C ATOM 1304 O SER A 82 -2.704 -36.704 -6.352 1.00 0.00 O ATOM 1305 CB SER A 82 -3.750 -34.742 -8.706 1.00 0.00 C ATOM 1306 OG SER A 82 -4.638 -34.592 -9.789 1.00 0.00 O ATOM 0 H SER A 82 -5.656 -33.978 -7.214 1.00 0.00 H new ATOM 0 HA SER A 82 -4.599 -36.603 -7.995 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.485 -33.765 -8.302 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.825 -35.208 -9.044 1.00 0.00 H new ATOM 0 HG SER A 82 -5.182 -33.788 -9.657 1.00 0.00 H new ATOM 1420 N PRO A 91 -11.581 -24.172 4.676 1.00 0.00 N ATOM 1421 CA PRO A 91 -11.014 -23.132 3.835 1.00 0.00 C ATOM 1422 C PRO A 91 -9.529 -23.404 3.635 1.00 0.00 C ATOM 1423 O PRO A 91 -8.896 -24.061 4.461 1.00 0.00 O ATOM 1424 CB PRO A 91 -11.257 -21.817 4.570 1.00 0.00 C ATOM 1425 CG PRO A 91 -11.293 -22.249 6.033 1.00 0.00 C ATOM 1426 CD PRO A 91 -11.978 -23.613 5.957 1.00 0.00 C ATOM 0 HA PRO A 91 -11.468 -23.097 2.844 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -10.462 -21.095 4.381 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -12.192 -21.349 4.263 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -10.293 -22.320 6.460 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -11.854 -21.547 6.650 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -11.666 -24.256 6.780 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -13.061 -23.513 6.024 1.00 0.00 H new ATOM 1434 N GLY A 92 -8.972 -22.899 2.534 1.00 0.00 N ATOM 1435 CA GLY A 92 -7.584 -23.154 2.187 1.00 0.00 C ATOM 1436 C GLY A 92 -7.450 -24.465 1.420 1.00 0.00 C ATOM 1437 O GLY A 92 -6.354 -25.005 1.297 1.00 0.00 O ATOM 0 H GLY A 92 -9.469 -22.308 1.867 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -7.199 -22.333 1.583 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.979 -23.194 3.093 1.00 0.00 H new ATOM 1441 N THR A 93 -8.573 -24.974 0.905 1.00 0.00 N ATOM 1442 CA THR A 93 -8.626 -26.222 0.161 1.00 0.00 C ATOM 1443 C THR A 93 -9.842 -26.210 -0.759 1.00 0.00 C ATOM 1444 O THR A 93 -10.720 -25.359 -0.620 1.00 0.00 O ATOM 1445 CB THR A 93 -8.712 -27.414 1.122 1.00 0.00 C ATOM 1446 OG1 THR A 93 -8.773 -27.008 2.477 1.00 0.00 O ATOM 1447 CG2 THR A 93 -7.483 -28.293 0.931 1.00 0.00 C ATOM 0 H THR A 93 -9.481 -24.519 0.998 1.00 0.00 H new ATOM 0 HA THR A 93 -7.718 -26.321 -0.434 1.00 0.00 H new ATOM 0 HB THR A 93 -9.628 -27.958 0.893 1.00 0.00 H new ATOM 0 HG1 THR A 93 -8.828 -27.799 3.053 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.535 -29.144 1.610 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.449 -28.652 -0.098 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.585 -27.713 1.143 1.00 0.00 H new ATOM 1455 N CYS A 94 -9.893 -27.159 -1.699 1.00 0.00 N ATOM 1456 CA CYS A 94 -11.000 -27.281 -2.632 1.00 0.00 C ATOM 1457 C CYS A 94 -12.317 -27.468 -1.888 1.00 0.00 C ATOM 1458 O CYS A 94 -13.378 -27.225 -2.451 1.00 0.00 O ATOM 1459 CB CYS A 94 -10.756 -28.506 -3.512 1.00 0.00 C ATOM 1460 SG CYS A 94 -10.751 -29.982 -2.455 1.00 0.00 S ATOM 0 H CYS A 94 -9.164 -27.861 -1.828 1.00 0.00 H new ATOM 0 HA CYS A 94 -11.062 -26.373 -3.231 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -11.533 -28.587 -4.272 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -9.805 -28.412 -4.037 1.00 0.00 H new ATOM 0 HG CYS A 94 -11.158 -31.008 -3.141 1.00 0.00 H new ATOM 1466 N ALA A 95 -12.259 -27.897 -0.626 1.00 0.00 N ATOM 1467 CA ALA A 95 -13.447 -28.180 0.151 1.00 0.00 C ATOM 1468 C ALA A 95 -14.333 -26.942 0.252 1.00 0.00 C ATOM 1469 O ALA A 95 -15.480 -26.971 -0.191 1.00 0.00 O ATOM 1470 CB ALA A 95 -13.012 -28.686 1.522 1.00 0.00 C ATOM 0 H ALA A 95 -11.386 -28.055 -0.123 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.045 -28.949 -0.337 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.893 -28.906 2.125 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.418 -29.592 1.404 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.414 -27.922 2.019 1.00 0.00 H new ATOM 1476 N HIS A 96 -13.812 -25.856 0.832 1.00 0.00 N ATOM 1477 CA HIS A 96 -14.588 -24.638 0.971 1.00 0.00 C ATOM 1478 C HIS A 96 -14.720 -23.934 -0.372 1.00 0.00 C ATOM 1479 O HIS A 96 -15.738 -23.293 -0.638 1.00 0.00 O ATOM 1480 CB HIS A 96 -13.889 -23.705 1.954 1.00 0.00 C ATOM 1481 CG HIS A 96 -14.697 -22.469 2.242 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -15.782 -22.403 3.115 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -14.484 -21.241 1.685 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -16.201 -21.130 3.060 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -15.441 -20.408 2.215 1.00 0.00 N ATOM 0 H HIS A 96 -12.865 -25.803 1.207 1.00 0.00 H new ATOM 0 HA HIS A 96 -15.582 -24.896 1.337 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -13.700 -24.238 2.886 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -12.919 -23.416 1.550 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -13.718 -20.977 0.971 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -17.037 -20.736 3.619 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -15.555 -19.416 2.005 1.00 0.00 H new ATOM 1493 N ALA A 97 -13.692 -24.053 -1.215 1.00 0.00 N ATOM 1494 CA ALA A 97 -13.652 -23.369 -2.494 1.00 0.00 C ATOM 1495 C ALA A 97 -14.757 -23.867 -3.418 1.00 0.00 C ATOM 1496 O ALA A 97 -15.533 -23.066 -3.935 1.00 0.00 O ATOM 1497 CB ALA A 97 -12.281 -23.596 -3.126 1.00 0.00 C ATOM 0 H ALA A 97 -12.870 -24.626 -1.024 1.00 0.00 H new ATOM 0 HA ALA A 97 -13.816 -22.303 -2.338 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -12.236 -23.087 -4.089 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -11.507 -23.199 -2.469 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -12.120 -24.664 -3.272 1.00 0.00 H new ATOM 1503 N ILE A 98 -14.836 -25.184 -3.629 1.00 0.00 N ATOM 1504 CA ILE A 98 -15.840 -25.747 -4.516 1.00 0.00 C ATOM 1505 C ILE A 98 -17.219 -25.669 -3.863 1.00 0.00 C ATOM 1506 O ILE A 98 -18.216 -25.497 -4.565 1.00 0.00 O ATOM 1507 CB ILE A 98 -15.454 -27.185 -4.895 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -14.438 -27.219 -6.047 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -16.677 -27.966 -5.372 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -13.103 -26.554 -5.718 1.00 0.00 C ATOM 0 H ILE A 98 -14.218 -25.871 -3.197 1.00 0.00 H new ATOM 0 HA ILE A 98 -15.886 -25.167 -5.438 1.00 0.00 H new ATOM 0 HB ILE A 98 -15.024 -27.628 -3.997 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -14.256 -28.257 -6.327 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -14.873 -26.726 -6.916 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -16.380 -28.981 -5.635 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -17.420 -28.000 -4.576 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -17.104 -27.475 -6.246 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.441 -26.620 -6.582 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.270 -25.506 -5.468 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -12.643 -27.061 -4.869 1.00 0.00 H new ATOM 1522 N ASN A 99 -17.298 -25.791 -2.536 1.00 0.00 N ATOM 1523 CA ASN A 99 -18.577 -25.682 -1.850 1.00 0.00 C ATOM 1524 C ASN A 99 -19.140 -24.272 -1.961 1.00 0.00 C ATOM 1525 O ASN A 99 -20.337 -24.115 -2.170 1.00 0.00 O ATOM 1526 CB ASN A 99 -18.391 -26.020 -0.376 1.00 0.00 C ATOM 1527 CG ASN A 99 -18.331 -27.520 -0.102 1.00 0.00 C ATOM 1528 OD1 ASN A 99 -18.109 -28.335 -1.132 1.00 0.00 O flip ATOM 1529 ND2 ASN A 99 -18.483 -27.940 1.040 1.00 0.00 N flip ATOM 0 H ASN A 99 -16.499 -25.963 -1.926 1.00 0.00 H new ATOM 0 HA ASN A 99 -19.274 -26.377 -2.317 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -17.473 -25.555 -0.017 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -19.212 -25.586 0.195 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -18.651 -27.287 1.805 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -18.441 -28.942 1.225 1.00 0.00 H new ATOM 1536 N THR A 100 -18.299 -23.243 -1.825 1.00 0.00 N ATOM 1537 CA THR A 100 -18.766 -21.864 -1.868 1.00 0.00 C ATOM 1538 C THR A 100 -19.128 -21.457 -3.291 1.00 0.00 C ATOM 1539 O THR A 100 -20.038 -20.656 -3.496 1.00 0.00 O ATOM 1540 CB THR A 100 -17.669 -20.951 -1.318 1.00 0.00 C ATOM 1541 OG1 THR A 100 -17.385 -21.304 0.016 1.00 0.00 O ATOM 1542 CG2 THR A 100 -18.091 -19.483 -1.351 1.00 0.00 C ATOM 0 H THR A 100 -17.294 -23.344 -1.685 1.00 0.00 H new ATOM 0 HA THR A 100 -19.664 -21.771 -1.257 1.00 0.00 H new ATOM 0 HB THR A 100 -16.788 -21.077 -1.947 1.00 0.00 H new ATOM 0 HG1 THR A 100 -16.636 -21.936 0.035 1.00 0.00 H new ATOM 0 HG21 THR A 100 -17.287 -18.864 -0.953 1.00 0.00 H new ATOM 0 HG22 THR A 100 -18.301 -19.188 -2.379 1.00 0.00 H new ATOM 0 HG23 THR A 100 -18.987 -19.348 -0.745 1.00 0.00 H new ATOM 1550 N LEU A 101 -18.420 -22.006 -4.282 1.00 0.00 N ATOM 1551 CA LEU A 101 -18.643 -21.644 -5.668 1.00 0.00 C ATOM 1552 C LEU A 101 -19.949 -22.235 -6.199 1.00 0.00 C ATOM 1553 O LEU A 101 -20.666 -21.569 -6.944 1.00 0.00 O ATOM 1554 CB LEU A 101 -17.441 -22.127 -6.484 1.00 0.00 C ATOM 1555 CG LEU A 101 -17.545 -21.789 -7.974 1.00 0.00 C ATOM 1556 CD1 LEU A 101 -17.612 -20.280 -8.213 1.00 0.00 C ATOM 1557 CD2 LEU A 101 -16.325 -22.362 -8.694 1.00 0.00 C ATOM 0 H LEU A 101 -17.689 -22.703 -4.141 1.00 0.00 H new ATOM 0 HA LEU A 101 -18.739 -20.562 -5.754 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -16.533 -21.680 -6.080 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -17.343 -23.207 -6.369 1.00 0.00 H new ATOM 0 HG LEU A 101 -18.465 -22.227 -8.361 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -17.685 -20.084 -9.283 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -18.487 -19.870 -7.708 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -16.712 -19.809 -7.818 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -16.387 -22.128 -9.757 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -15.418 -21.924 -8.278 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -16.299 -23.444 -8.561 1.00 0.00 H new ATOM 1569 N GLY A 102 -20.268 -23.478 -5.825 1.00 0.00 N ATOM 1570 CA GLY A 102 -21.420 -24.180 -6.378 1.00 0.00 C ATOM 1571 C GLY A 102 -22.768 -23.607 -5.939 1.00 0.00 C ATOM 1572 O GLY A 102 -23.788 -23.899 -6.564 1.00 0.00 O ATOM 0 H GLY A 102 -19.739 -24.017 -5.139 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -21.362 -24.151 -7.466 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -21.369 -25.228 -6.084 1.00 0.00 H new ATOM 1576 N GLU A 103 -22.797 -22.799 -4.877 1.00 0.00 N ATOM 1577 CA GLU A 103 -24.031 -22.189 -4.401 1.00 0.00 C ATOM 1578 C GLU A 103 -24.306 -20.867 -5.100 1.00 0.00 C ATOM 1579 O GLU A 103 -25.461 -20.502 -5.305 1.00 0.00 O ATOM 1580 CB GLU A 103 -23.893 -21.925 -2.904 1.00 0.00 C ATOM 1581 CG GLU A 103 -23.382 -23.155 -2.156 1.00 0.00 C ATOM 1582 CD GLU A 103 -24.465 -24.213 -1.942 1.00 0.00 C ATOM 1583 OE1 GLU A 103 -24.461 -24.819 -0.850 1.00 0.00 O ATOM 1584 OE2 GLU A 103 -25.281 -24.404 -2.871 1.00 0.00 O1- ATOM 0 H GLU A 103 -21.972 -22.553 -4.330 1.00 0.00 H new ATOM 0 HA GLU A 103 -24.856 -22.869 -4.613 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.209 -21.092 -2.743 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -24.859 -21.627 -2.497 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.556 -23.596 -2.713 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.986 -22.847 -1.188 1.00 0.00 H new ATOM 1591 N VAL A 104 -23.237 -20.154 -5.461 1.00 0.00 N ATOM 1592 CA VAL A 104 -23.339 -18.844 -6.091 1.00 0.00 C ATOM 1593 C VAL A 104 -23.309 -18.935 -7.615 1.00 0.00 C ATOM 1594 O VAL A 104 -23.753 -18.015 -8.297 1.00 0.00 O ATOM 1595 CB VAL A 104 -22.199 -17.959 -5.563 1.00 0.00 C ATOM 1596 CG1 VAL A 104 -22.230 -16.570 -6.201 1.00 0.00 C ATOM 1597 CG2 VAL A 104 -22.322 -17.798 -4.043 1.00 0.00 C ATOM 0 H VAL A 104 -22.278 -20.472 -5.323 1.00 0.00 H new ATOM 0 HA VAL A 104 -24.301 -18.401 -5.834 1.00 0.00 H new ATOM 0 HB VAL A 104 -21.259 -18.447 -5.820 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -21.411 -15.970 -5.806 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -22.123 -16.664 -7.282 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -23.179 -16.085 -5.971 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -21.510 -17.169 -3.677 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -23.278 -17.333 -3.803 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -22.265 -18.777 -3.568 1.00 0.00 H new ATOM 1607 N ILE A 105 -22.790 -20.034 -8.174 1.00 0.00 N ATOM 1608 CA ILE A 105 -22.627 -20.160 -9.618 1.00 0.00 C ATOM 1609 C ILE A 105 -23.963 -20.063 -10.359 1.00 0.00 C ATOM 1610 O ILE A 105 -23.986 -19.734 -11.542 1.00 0.00 O ATOM 1611 CB ILE A 105 -21.902 -21.478 -9.922 1.00 0.00 C ATOM 1612 CG1 ILE A 105 -21.375 -21.553 -11.358 1.00 0.00 C ATOM 1613 CG2 ILE A 105 -22.839 -22.660 -9.677 1.00 0.00 C ATOM 1614 CD1 ILE A 105 -20.358 -20.442 -11.626 1.00 0.00 C ATOM 0 H ILE A 105 -22.477 -20.847 -7.644 1.00 0.00 H new ATOM 0 HA ILE A 105 -22.025 -19.326 -9.980 1.00 0.00 H new ATOM 0 HB ILE A 105 -21.044 -21.520 -9.251 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -20.911 -22.525 -11.529 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -22.205 -21.468 -12.059 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -22.315 -23.591 -9.895 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -23.160 -22.660 -8.635 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -23.711 -22.573 -10.325 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -19.999 -20.517 -12.652 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -20.832 -19.472 -11.477 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -19.518 -20.544 -10.939 1.00 0.00 H new ATOM 1626 N GLN A 106 -25.081 -20.341 -9.679 1.00 0.00 N ATOM 1627 CA GLN A 106 -26.395 -20.215 -10.293 1.00 0.00 C ATOM 1628 C GLN A 106 -26.715 -18.746 -10.578 1.00 0.00 C ATOM 1629 O GLN A 106 -27.504 -18.461 -11.480 1.00 0.00 O ATOM 1630 CB GLN A 106 -27.449 -20.859 -9.384 1.00 0.00 C ATOM 1631 CG GLN A 106 -27.430 -20.266 -7.973 1.00 0.00 C ATOM 1632 CD GLN A 106 -28.439 -20.958 -7.062 1.00 0.00 C ATOM 1633 OE1 GLN A 106 -29.480 -21.431 -7.513 1.00 0.00 O ATOM 1634 NE2 GLN A 106 -28.134 -21.022 -5.767 1.00 0.00 N ATOM 0 H GLN A 106 -25.096 -20.653 -8.708 1.00 0.00 H new ATOM 0 HA GLN A 106 -26.402 -20.738 -11.249 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -28.438 -20.721 -9.822 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -27.272 -21.933 -9.328 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -26.430 -20.363 -7.550 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -27.654 -19.200 -8.022 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -27.261 -20.618 -5.428 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -28.774 -21.475 -5.114 1.00 0.00 H new ATOM 1643 N GLU A 107 -26.115 -17.816 -9.825 1.00 0.00 N ATOM 1644 CA GLU A 107 -26.305 -16.395 -10.067 1.00 0.00 C ATOM 1645 C GLU A 107 -25.526 -15.983 -11.308 1.00 0.00 C ATOM 1646 O GLU A 107 -26.030 -15.231 -12.140 1.00 0.00 O ATOM 1647 CB GLU A 107 -25.786 -15.576 -8.882 1.00 0.00 C ATOM 1648 CG GLU A 107 -26.424 -15.961 -7.548 1.00 0.00 C ATOM 1649 CD GLU A 107 -25.778 -15.197 -6.389 1.00 0.00 C ATOM 1650 OE1 GLU A 107 -25.076 -14.195 -6.664 1.00 0.00 O ATOM 1651 OE2 GLU A 107 -25.994 -15.629 -5.238 1.00 0.00 O1- ATOM 0 H GLU A 107 -25.495 -18.030 -9.044 1.00 0.00 H new ATOM 0 HA GLU A 107 -27.370 -16.209 -10.203 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -24.706 -15.702 -8.809 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -25.971 -14.519 -9.072 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -27.493 -15.748 -7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -26.317 -17.033 -7.386 1.00 0.00 H new ATOM 1658 N LEU A 108 -24.289 -16.482 -11.423 1.00 0.00 N ATOM 1659 CA LEU A 108 -23.411 -16.142 -12.528 1.00 0.00 C ATOM 1660 C LEU A 108 -23.955 -16.710 -13.824 1.00 0.00 C ATOM 1661 O LEU A 108 -23.977 -16.010 -14.833 1.00 0.00 O ATOM 1662 CB LEU A 108 -22.024 -16.738 -12.294 1.00 0.00 C ATOM 1663 CG LEU A 108 -21.160 -15.935 -11.324 1.00 0.00 C ATOM 1664 CD1 LEU A 108 -21.716 -15.908 -9.907 1.00 0.00 C ATOM 1665 CD2 LEU A 108 -19.785 -16.596 -11.301 1.00 0.00 C ATOM 0 H LEU A 108 -23.878 -17.130 -10.751 1.00 0.00 H new ATOM 0 HA LEU A 108 -23.350 -15.056 -12.593 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -22.135 -17.753 -11.911 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -21.506 -16.813 -13.250 1.00 0.00 H new ATOM 0 HG LEU A 108 -21.127 -14.900 -11.665 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -21.056 -15.322 -9.268 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.708 -15.457 -9.914 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -21.783 -16.926 -9.523 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -19.132 -16.053 -10.618 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -19.883 -17.628 -10.966 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -19.356 -16.579 -12.303 1.00 0.00 H new ATOM 1677 N LEU A 109 -24.391 -17.972 -13.807 1.00 0.00 N ATOM 1678 CA LEU A 109 -24.894 -18.617 -15.006 1.00 0.00 C ATOM 1679 C LEU A 109 -26.182 -17.950 -15.473 1.00 0.00 C ATOM 1680 O LEU A 109 -26.264 -17.554 -16.632 1.00 0.00 O ATOM 1681 CB LEU A 109 -25.112 -20.105 -14.726 1.00 0.00 C ATOM 1682 CG LEU A 109 -23.852 -20.942 -14.945 1.00 0.00 C ATOM 1683 CD1 LEU A 109 -22.563 -20.256 -14.488 1.00 0.00 C ATOM 1684 CD2 LEU A 109 -24.020 -22.256 -14.183 1.00 0.00 C ATOM 0 H LEU A 109 -24.403 -18.560 -12.974 1.00 0.00 H new ATOM 0 HA LEU A 109 -24.163 -18.514 -15.808 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -25.451 -20.230 -13.698 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -25.907 -20.478 -15.372 1.00 0.00 H new ATOM 0 HG LEU A 109 -23.747 -21.097 -16.019 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -21.714 -20.913 -14.677 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -22.431 -19.325 -15.040 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -22.624 -20.040 -13.421 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -23.133 -22.874 -14.323 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -24.153 -22.047 -13.122 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -24.894 -22.786 -14.560 1.00 0.00 H new ATOM 1696 N SER A 110 -27.181 -17.822 -14.593 1.00 0.00 N ATOM 1697 CA SER A 110 -28.459 -17.229 -14.972 1.00 0.00 C ATOM 1698 C SER A 110 -28.246 -15.846 -15.587 1.00 0.00 C ATOM 1699 O SER A 110 -28.811 -15.533 -16.637 1.00 0.00 O ATOM 1700 CB SER A 110 -29.372 -17.116 -13.748 1.00 0.00 C ATOM 1701 OG SER A 110 -29.458 -18.358 -13.083 1.00 0.00 O ATOM 0 H SER A 110 -27.126 -18.121 -13.619 1.00 0.00 H new ATOM 0 HA SER A 110 -28.932 -17.874 -15.713 1.00 0.00 H new ATOM 0 HB2 SER A 110 -28.986 -16.357 -13.067 1.00 0.00 H new ATOM 0 HB3 SER A 110 -30.366 -16.792 -14.056 1.00 0.00 H new ATOM 0 HG SER A 110 -28.706 -18.449 -12.461 1.00 0.00 H new ATOM 1707 N ASP A 111 -27.426 -15.017 -14.927 1.00 0.00 N ATOM 1708 CA ASP A 111 -27.108 -13.691 -15.425 1.00 0.00 C ATOM 1709 C ASP A 111 -26.396 -13.814 -16.767 1.00 0.00 C ATOM 1710 O ASP A 111 -26.692 -13.072 -17.700 1.00 0.00 O ATOM 1711 CB ASP A 111 -26.183 -13.002 -14.422 1.00 0.00 C ATOM 1712 CG ASP A 111 -25.778 -11.597 -14.857 1.00 0.00 C ATOM 1713 OD1 ASP A 111 -24.748 -11.122 -14.324 1.00 0.00 O ATOM 1714 OD2 ASP A 111 -26.488 -11.017 -15.706 1.00 0.00 O1- ATOM 0 H ASP A 111 -26.974 -15.252 -14.043 1.00 0.00 H new ATOM 0 HA ASP A 111 -28.021 -13.110 -15.552 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -26.681 -12.948 -13.454 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -25.287 -13.607 -14.286 1.00 0.00 H new ATOM 1719 N ALA A 112 -25.452 -14.754 -16.865 1.00 0.00 N ATOM 1720 CA ALA A 112 -24.647 -14.883 -18.060 1.00 0.00 C ATOM 1721 C ALA A 112 -25.478 -15.354 -19.241 1.00 0.00 C ATOM 1722 O ALA A 112 -25.237 -14.905 -20.359 1.00 0.00 O ATOM 1723 CB ALA A 112 -23.493 -15.853 -17.802 1.00 0.00 C ATOM 0 H ALA A 112 -25.235 -15.428 -16.131 1.00 0.00 H new ATOM 0 HA ALA A 112 -24.246 -13.901 -18.310 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -22.889 -15.948 -18.704 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -22.874 -15.474 -16.989 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -23.893 -16.830 -17.529 1.00 0.00 H new ATOM 1729 N ILE A 113 -26.453 -16.246 -19.040 1.00 0.00 N ATOM 1730 CA ILE A 113 -27.232 -16.698 -20.177 1.00 0.00 C ATOM 1731 C ILE A 113 -28.103 -15.562 -20.700 1.00 0.00 C ATOM 1732 O ILE A 113 -28.231 -15.401 -21.911 1.00 0.00 O ATOM 1733 CB ILE A 113 -28.110 -17.906 -19.831 1.00 0.00 C ATOM 1734 CG1 ILE A 113 -27.361 -19.100 -19.228 1.00 0.00 C ATOM 1735 CG2 ILE A 113 -28.794 -18.327 -21.131 1.00 0.00 C ATOM 1736 CD1 ILE A 113 -26.083 -19.482 -19.969 1.00 0.00 C ATOM 0 H ILE A 113 -26.708 -16.650 -18.139 1.00 0.00 H new ATOM 0 HA ILE A 113 -26.529 -17.010 -20.949 1.00 0.00 H new ATOM 0 HB ILE A 113 -28.810 -17.602 -19.052 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -27.111 -18.871 -18.192 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -28.029 -19.962 -19.212 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -29.435 -19.188 -20.942 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -29.397 -17.501 -21.509 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -28.038 -18.592 -21.870 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -25.617 -20.335 -19.475 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -26.324 -19.746 -20.999 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -25.393 -18.638 -19.963 1.00 0.00 H new ATOM 1748 N ALA A 114 -28.704 -14.774 -19.806 1.00 0.00 N ATOM 1749 CA ALA A 114 -29.545 -13.671 -20.243 1.00 0.00 C ATOM 1750 C ALA A 114 -28.738 -12.476 -20.757 1.00 0.00 C ATOM 1751 O ALA A 114 -29.140 -11.854 -21.739 1.00 0.00 O ATOM 1752 CB ALA A 114 -30.461 -13.260 -19.090 1.00 0.00 C ATOM 0 H ALA A 114 -28.623 -14.880 -18.795 1.00 0.00 H new ATOM 0 HA ALA A 114 -30.141 -14.013 -21.089 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -31.096 -12.433 -19.407 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -31.084 -14.106 -18.801 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -29.856 -12.947 -18.239 1.00 0.00 H new ATOM 1758 N LYS A 115 -27.611 -12.146 -20.118 1.00 0.00 N ATOM 1759 CA LYS A 115 -26.802 -10.998 -20.501 1.00 0.00 C ATOM 1760 C LYS A 115 -25.920 -11.259 -21.720 1.00 0.00 C ATOM 1761 O LYS A 115 -25.761 -10.368 -22.554 1.00 0.00 O ATOM 1762 CB LYS A 115 -25.929 -10.625 -19.303 1.00 0.00 C ATOM 1763 CG LYS A 115 -25.099 -9.355 -19.502 1.00 0.00 C ATOM 1764 CD LYS A 115 -25.946 -8.078 -19.544 1.00 0.00 C ATOM 1765 CE LYS A 115 -26.591 -7.764 -20.898 1.00 0.00 C ATOM 1766 NZ LYS A 115 -25.621 -7.764 -22.008 1.00 0.00 N1+ ATOM 0 H LYS A 115 -27.240 -12.669 -19.325 1.00 0.00 H new ATOM 0 HA LYS A 115 -27.474 -10.187 -20.783 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -26.567 -10.495 -18.429 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -25.256 -11.455 -19.086 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -24.372 -9.274 -18.694 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.535 -9.440 -20.431 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -26.734 -8.160 -18.795 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.318 -7.235 -19.255 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -27.370 -8.498 -21.103 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -27.077 -6.790 -20.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -25.967 -7.149 -22.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -24.704 -7.410 -21.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.506 -8.733 -22.369 1.00 0.00 H new ATOM 1780 N SER A 116 -25.350 -12.460 -21.833 1.00 0.00 N ATOM 1781 CA SER A 116 -24.371 -12.739 -22.877 1.00 0.00 C ATOM 1782 C SER A 116 -25.032 -12.892 -24.247 1.00 0.00 C ATOM 1783 O SER A 116 -26.222 -13.193 -24.341 1.00 0.00 O ATOM 1784 CB SER A 116 -23.543 -13.971 -22.504 1.00 0.00 C ATOM 1785 OG SER A 116 -24.298 -15.147 -22.682 1.00 0.00 O ATOM 0 H SER A 116 -25.550 -13.248 -21.217 1.00 0.00 H new ATOM 0 HA SER A 116 -23.698 -11.885 -22.953 1.00 0.00 H new ATOM 0 HB2 SER A 116 -22.645 -14.012 -23.120 1.00 0.00 H new ATOM 0 HB3 SER A 116 -23.216 -13.896 -21.467 1.00 0.00 H new ATOM 0 HG SER A 116 -24.815 -15.330 -21.870 1.00 0.00 H new ATOM 1791 N ASN A 117 -24.250 -12.680 -25.313 1.00 0.00 N ATOM 1792 CA ASN A 117 -24.739 -12.767 -26.682 1.00 0.00 C ATOM 1793 C ASN A 117 -24.827 -14.228 -27.131 1.00 0.00 C ATOM 1794 O ASN A 117 -24.281 -15.115 -26.484 1.00 0.00 O ATOM 1795 CB ASN A 117 -23.813 -11.954 -27.591 1.00 0.00 C ATOM 1796 CG ASN A 117 -24.356 -11.866 -29.010 1.00 0.00 C ATOM 1797 OD1 ASN A 117 -25.500 -11.471 -29.218 1.00 0.00 O ATOM 1798 ND2 ASN A 117 -23.537 -12.231 -29.992 1.00 0.00 N ATOM 0 H ASN A 117 -23.260 -12.443 -25.243 1.00 0.00 H new ATOM 0 HA ASN A 117 -25.745 -12.353 -26.743 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -23.693 -10.950 -27.184 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -22.824 -12.412 -27.607 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -23.852 -12.188 -30.961 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -22.594 -12.553 -29.776 1.00 0.00 H new ATOM 1805 N GLN A 118 -25.518 -14.480 -28.246 1.00 0.00 N ATOM 1806 CA GLN A 118 -25.791 -15.828 -28.733 1.00 0.00 C ATOM 1807 C GLN A 118 -24.539 -16.709 -28.776 1.00 0.00 C ATOM 1808 O GLN A 118 -24.570 -17.857 -28.330 1.00 0.00 O ATOM 1809 CB GLN A 118 -26.410 -15.715 -30.127 1.00 0.00 C ATOM 1810 CG GLN A 118 -25.467 -15.093 -31.163 1.00 0.00 C ATOM 1811 CD GLN A 118 -26.215 -14.565 -32.383 1.00 0.00 C ATOM 1812 OE1 GLN A 118 -25.756 -13.636 -33.037 1.00 0.00 O ATOM 1813 NE2 GLN A 118 -27.370 -15.149 -32.702 1.00 0.00 N ATOM 0 H GLN A 118 -25.905 -13.746 -28.838 1.00 0.00 H new ATOM 0 HA GLN A 118 -26.478 -16.312 -28.039 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -26.707 -16.707 -30.466 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -27.318 -15.114 -30.066 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -24.909 -14.278 -30.701 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -24.738 -15.838 -31.481 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -27.725 -15.920 -32.137 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -27.899 -14.825 -33.511 1.00 0.00 H new ATOM 1822 N ASP A 119 -23.446 -16.164 -29.311 1.00 0.00 N ATOM 1823 CA ASP A 119 -22.174 -16.866 -29.407 1.00 0.00 C ATOM 1824 C ASP A 119 -21.592 -17.150 -28.029 1.00 0.00 C ATOM 1825 O ASP A 119 -20.975 -18.192 -27.811 1.00 0.00 O ATOM 1826 CB ASP A 119 -21.163 -16.042 -30.214 1.00 0.00 C ATOM 1827 CG ASP A 119 -21.124 -14.550 -29.893 1.00 0.00 C ATOM 1828 OD1 ASP A 119 -21.889 -14.102 -29.010 1.00 0.00 O ATOM 1829 OD2 ASP A 119 -20.310 -13.862 -30.546 1.00 0.00 O1- ATOM 0 H ASP A 119 -23.422 -15.218 -29.691 1.00 0.00 H new ATOM 0 HA ASP A 119 -22.365 -17.813 -29.913 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -20.169 -16.457 -30.049 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -21.387 -16.162 -31.274 1.00 0.00 H new ATOM 1834 N HIS A 120 -21.786 -16.225 -27.092 1.00 0.00 N ATOM 1835 CA HIS A 120 -21.346 -16.404 -25.724 1.00 0.00 C ATOM 1836 C HIS A 120 -22.163 -17.505 -25.048 1.00 0.00 C ATOM 1837 O HIS A 120 -21.597 -18.346 -24.356 1.00 0.00 O ATOM 1838 CB HIS A 120 -21.526 -15.098 -24.954 1.00 0.00 C ATOM 1839 CG HIS A 120 -20.877 -13.869 -25.539 1.00 0.00 C ATOM 1840 ND1 HIS A 120 -21.074 -12.573 -25.057 1.00 0.00 N ATOM 1841 CD2 HIS A 120 -20.017 -13.829 -26.599 1.00 0.00 C ATOM 1842 CE1 HIS A 120 -20.320 -11.786 -25.842 1.00 0.00 C ATOM 1843 NE2 HIS A 120 -19.675 -12.509 -26.775 1.00 0.00 N ATOM 0 H HIS A 120 -22.252 -15.335 -27.266 1.00 0.00 H new ATOM 0 HA HIS A 120 -20.294 -16.689 -25.726 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -22.594 -14.905 -24.858 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -21.136 -15.241 -23.946 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -19.673 -14.669 -27.184 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -20.242 -10.714 -25.738 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -19.044 -12.143 -27.487 1.00 0.00 H new ATOM 1851 N LYS A 121 -23.490 -17.503 -25.247 1.00 0.00 N ATOM 1852 CA LYS A 121 -24.366 -18.504 -24.655 1.00 0.00 C ATOM 1853 C LYS A 121 -23.910 -19.895 -25.080 1.00 0.00 C ATOM 1854 O LYS A 121 -23.938 -20.827 -24.279 1.00 0.00 O ATOM 1855 CB LYS A 121 -25.813 -18.271 -25.093 1.00 0.00 C ATOM 1856 CG LYS A 121 -26.325 -16.905 -24.642 1.00 0.00 C ATOM 1857 CD LYS A 121 -27.789 -16.735 -25.037 1.00 0.00 C ATOM 1858 CE LYS A 121 -28.200 -15.282 -24.803 1.00 0.00 C ATOM 1859 NZ LYS A 121 -29.659 -15.150 -24.693 1.00 0.00 N1+ ATOM 0 H LYS A 121 -23.974 -16.811 -25.819 1.00 0.00 H new ATOM 0 HA LYS A 121 -24.316 -18.423 -23.569 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -25.881 -18.345 -26.178 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -26.449 -19.053 -24.679 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -26.218 -16.807 -23.562 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -25.725 -16.116 -25.094 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -27.930 -17.003 -26.084 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -28.418 -17.404 -24.449 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -27.730 -14.911 -23.892 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -27.838 -14.663 -25.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -29.906 -14.152 -24.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -30.105 -15.482 -25.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -30.000 -15.722 -23.894 1.00 0.00 H new ATOM 1873 N GLU A 122 -23.487 -20.037 -26.339 1.00 0.00 N ATOM 1874 CA GLU A 122 -23.004 -21.307 -26.861 1.00 0.00 C ATOM 1875 C GLU A 122 -21.715 -21.724 -26.154 1.00 0.00 C ATOM 1876 O GLU A 122 -21.591 -22.870 -25.724 1.00 0.00 O ATOM 1877 CB GLU A 122 -22.812 -21.159 -28.375 1.00 0.00 C ATOM 1878 CG GLU A 122 -21.915 -22.255 -28.955 1.00 0.00 C ATOM 1879 CD GLU A 122 -20.474 -21.789 -29.156 1.00 0.00 C ATOM 1880 OE1 GLU A 122 -19.567 -22.538 -28.736 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -20.297 -20.688 -29.725 1.00 0.00 O1- ATOM 0 H GLU A 122 -23.472 -19.276 -27.018 1.00 0.00 H new ATOM 0 HA GLU A 122 -23.729 -22.099 -26.672 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -23.784 -21.189 -28.867 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -22.376 -20.183 -28.590 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -21.924 -23.118 -28.289 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -22.323 -22.586 -29.910 1.00 0.00 H new ATOM 1888 N LYS A 123 -20.759 -20.799 -26.030 1.00 0.00 N ATOM 1889 CA LYS A 123 -19.488 -21.086 -25.384 1.00 0.00 C ATOM 1890 C LYS A 123 -19.681 -21.377 -23.897 1.00 0.00 C ATOM 1891 O LYS A 123 -18.898 -22.125 -23.313 1.00 0.00 O ATOM 1892 CB LYS A 123 -18.553 -19.901 -25.610 1.00 0.00 C ATOM 1893 CG LYS A 123 -18.256 -19.910 -27.107 1.00 0.00 C ATOM 1894 CD LYS A 123 -17.427 -18.722 -27.569 1.00 0.00 C ATOM 1895 CE LYS A 123 -17.226 -18.921 -29.068 1.00 0.00 C ATOM 1896 NZ LYS A 123 -18.490 -18.765 -29.808 1.00 0.00 N1+ ATOM 0 H LYS A 123 -20.848 -19.842 -26.372 1.00 0.00 H new ATOM 0 HA LYS A 123 -19.045 -21.981 -25.820 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -19.022 -18.965 -25.307 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -17.638 -20.003 -25.026 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -17.729 -20.830 -27.359 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -19.198 -19.921 -27.656 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -17.940 -17.782 -27.364 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -16.471 -18.684 -27.047 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -16.496 -18.201 -29.437 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -16.815 -19.914 -29.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -18.316 -18.234 -30.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -18.874 -19.703 -30.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -19.175 -18.247 -29.221 1.00 0.00 H new ATOM 1910 N ILE A 124 -20.714 -20.796 -23.280 1.00 0.00 N ATOM 1911 CA ILE A 124 -21.018 -21.086 -21.889 1.00 0.00 C ATOM 1912 C ILE A 124 -21.561 -22.504 -21.774 1.00 0.00 C ATOM 1913 O ILE A 124 -21.178 -23.234 -20.864 1.00 0.00 O ATOM 1914 CB ILE A 124 -22.034 -20.074 -21.351 1.00 0.00 C ATOM 1915 CG1 ILE A 124 -21.379 -18.688 -21.278 1.00 0.00 C ATOM 1916 CG2 ILE A 124 -22.522 -20.481 -19.958 1.00 0.00 C ATOM 1917 CD1 ILE A 124 -22.428 -17.581 -21.258 1.00 0.00 C ATOM 0 H ILE A 124 -21.345 -20.128 -23.723 1.00 0.00 H new ATOM 0 HA ILE A 124 -20.108 -21.006 -21.294 1.00 0.00 H new ATOM 0 HB ILE A 124 -22.891 -20.048 -22.024 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -20.760 -18.622 -20.383 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.718 -18.550 -22.133 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -23.243 -19.748 -19.596 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -22.997 -21.461 -20.011 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -21.674 -20.525 -19.274 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -21.933 -16.611 -21.206 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -23.029 -17.633 -22.166 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -23.073 -17.706 -20.388 1.00 0.00 H new ATOM 1929 N ARG A 125 -22.449 -22.910 -22.686 1.00 0.00 N ATOM 1930 CA ARG A 125 -23.010 -24.247 -22.622 1.00 0.00 C ATOM 1931 C ARG A 125 -21.919 -25.308 -22.705 1.00 0.00 C ATOM 1932 O ARG A 125 -21.938 -26.243 -21.912 1.00 0.00 O ATOM 1933 CB ARG A 125 -24.053 -24.441 -23.722 1.00 0.00 C ATOM 1934 CG ARG A 125 -25.348 -23.688 -23.395 1.00 0.00 C ATOM 1935 CD ARG A 125 -26.002 -24.211 -22.112 1.00 0.00 C ATOM 1936 NE ARG A 125 -26.453 -25.604 -22.266 1.00 0.00 N ATOM 1937 CZ ARG A 125 -25.794 -26.692 -21.841 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -24.662 -26.599 -21.147 1.00 0.00 N1+ ATOM 1939 NH2 ARG A 125 -26.273 -27.905 -22.115 1.00 0.00 N ATOM 0 H ARG A 125 -22.785 -22.338 -23.461 1.00 0.00 H new ATOM 0 HA ARG A 125 -23.505 -24.363 -21.658 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -23.653 -24.087 -24.672 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -24.267 -25.503 -23.841 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -25.133 -22.625 -23.286 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -26.046 -23.788 -24.226 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -25.292 -24.146 -21.288 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -26.851 -23.579 -21.851 1.00 0.00 H new ATOM 0 HE ARG A 125 -27.345 -25.755 -22.737 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -24.274 -25.682 -20.925 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -24.183 -27.444 -20.837 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -27.138 -28.004 -22.646 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -25.775 -28.735 -21.793 1.00 0.00 H new ATOM 1953 N MET A 126 -20.977 -25.183 -23.638 1.00 0.00 N ATOM 1954 CA MET A 126 -19.917 -26.171 -23.713 1.00 0.00 C ATOM 1955 C MET A 126 -19.057 -26.100 -22.450 1.00 0.00 C ATOM 1956 O MET A 126 -18.554 -27.123 -21.997 1.00 0.00 O ATOM 1957 CB MET A 126 -19.079 -25.974 -24.982 1.00 0.00 C ATOM 1958 CG MET A 126 -18.354 -24.631 -24.999 1.00 0.00 C ATOM 1959 SD MET A 126 -17.261 -24.380 -26.423 1.00 0.00 S ATOM 1960 CE MET A 126 -16.007 -25.639 -26.068 1.00 0.00 C ATOM 0 H MET A 126 -20.929 -24.433 -24.328 1.00 0.00 H new ATOM 0 HA MET A 126 -20.357 -27.167 -23.771 1.00 0.00 H new ATOM 0 HB2 MET A 126 -18.348 -26.779 -25.060 1.00 0.00 H new ATOM 0 HB3 MET A 126 -19.726 -26.045 -25.856 1.00 0.00 H new ATOM 0 HG2 MET A 126 -19.096 -23.833 -24.982 1.00 0.00 H new ATOM 0 HG3 MET A 126 -17.766 -24.539 -24.086 1.00 0.00 H new ATOM 0 HE1 MET A 126 -15.111 -25.436 -26.655 1.00 0.00 H new ATOM 0 HE2 MET A 126 -15.758 -25.616 -25.007 1.00 0.00 H new ATOM 0 HE3 MET A 126 -16.396 -26.623 -26.328 1.00 0.00 H new ATOM 1970 N LEU A 127 -18.883 -24.906 -21.875 1.00 0.00 N ATOM 1971 CA LEU A 127 -18.089 -24.742 -20.669 1.00 0.00 C ATOM 1972 C LEU A 127 -18.778 -25.366 -19.450 1.00 0.00 C ATOM 1973 O LEU A 127 -18.106 -25.849 -18.542 1.00 0.00 O ATOM 1974 CB LEU A 127 -17.847 -23.244 -20.467 1.00 0.00 C ATOM 1975 CG LEU A 127 -16.735 -22.946 -19.462 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -15.391 -23.418 -20.011 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -16.675 -21.437 -19.247 1.00 0.00 C ATOM 0 H LEU A 127 -19.286 -24.040 -22.233 1.00 0.00 H new ATOM 0 HA LEU A 127 -17.138 -25.263 -20.779 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -17.593 -22.791 -21.425 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -18.771 -22.775 -20.127 1.00 0.00 H new ATOM 0 HG LEU A 127 -16.940 -23.464 -18.525 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -14.606 -23.201 -19.287 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -15.429 -24.492 -20.193 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.177 -22.899 -20.945 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -15.887 -21.202 -18.532 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -16.464 -20.943 -20.195 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -17.632 -21.086 -18.860 1.00 0.00 H new ATOM 1989 N LEU A 128 -20.114 -25.366 -19.417 1.00 0.00 N ATOM 1990 CA LEU A 128 -20.857 -25.985 -18.329 1.00 0.00 C ATOM 1991 C LEU A 128 -20.845 -27.502 -18.469 1.00 0.00 C ATOM 1992 O LEU A 128 -20.748 -28.209 -17.467 1.00 0.00 O ATOM 1993 CB LEU A 128 -22.302 -25.474 -18.321 1.00 0.00 C ATOM 1994 CG LEU A 128 -22.396 -23.987 -17.963 1.00 0.00 C ATOM 1995 CD1 LEU A 128 -23.852 -23.536 -18.063 1.00 0.00 C ATOM 1996 CD2 LEU A 128 -21.883 -23.729 -16.547 1.00 0.00 C ATOM 0 H LEU A 128 -20.699 -24.941 -20.136 1.00 0.00 H new ATOM 0 HA LEU A 128 -20.378 -25.717 -17.387 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -22.747 -25.637 -19.303 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -22.885 -26.054 -17.606 1.00 0.00 H new ATOM 0 HG LEU A 128 -21.777 -23.424 -18.661 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -23.924 -22.478 -17.809 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -24.212 -23.690 -19.080 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -24.461 -24.117 -17.371 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -21.961 -22.666 -16.320 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -22.481 -24.297 -15.834 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -20.841 -24.039 -16.475 1.00 0.00 H new ATOM 2008 N ASP A 129 -20.940 -28.007 -19.702 1.00 0.00 N ATOM 2009 CA ASP A 129 -20.852 -29.438 -19.947 1.00 0.00 C ATOM 2010 C ASP A 129 -19.499 -29.943 -19.469 1.00 0.00 C ATOM 2011 O ASP A 129 -19.414 -31.039 -18.919 1.00 0.00 O ATOM 2012 CB ASP A 129 -21.087 -29.701 -21.438 1.00 0.00 C ATOM 2013 CG ASP A 129 -22.456 -29.222 -21.926 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -22.642 -29.213 -23.160 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -23.298 -28.872 -21.068 1.00 0.00 O1- ATOM 0 H ASP A 129 -21.078 -27.443 -20.540 1.00 0.00 H new ATOM 0 HA ASP A 129 -21.617 -29.982 -19.392 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -20.308 -29.203 -22.015 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -20.993 -30.770 -21.631 1.00 0.00 H new ATOM 2020 N ILE A 130 -18.451 -29.141 -19.680 1.00 0.00 N ATOM 2021 CA ILE A 130 -17.102 -29.419 -19.221 1.00 0.00 C ATOM 2022 C ILE A 130 -17.047 -29.467 -17.699 1.00 0.00 C ATOM 2023 O ILE A 130 -16.370 -30.323 -17.132 1.00 0.00 O ATOM 2024 CB ILE A 130 -16.203 -28.325 -19.794 1.00 0.00 C ATOM 2025 CG1 ILE A 130 -15.991 -28.659 -21.275 1.00 0.00 C ATOM 2026 CG2 ILE A 130 -14.899 -28.189 -19.004 1.00 0.00 C ATOM 2027 CD1 ILE A 130 -15.194 -27.560 -21.956 1.00 0.00 C ATOM 0 H ILE A 130 -18.528 -28.260 -20.188 1.00 0.00 H new ATOM 0 HA ILE A 130 -16.762 -30.396 -19.564 1.00 0.00 H new ATOM 0 HB ILE A 130 -16.669 -27.344 -19.707 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -15.466 -29.609 -21.369 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -16.955 -28.778 -21.769 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -14.288 -27.401 -19.443 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -15.126 -27.937 -17.968 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -14.353 -29.132 -19.037 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -15.052 -27.812 -23.007 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -15.735 -26.617 -21.879 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -14.222 -27.462 -21.472 1.00 0.00 H new ATOM 2039 N TRP A 131 -17.752 -28.560 -17.027 1.00 0.00 N ATOM 2040 CA TRP A 131 -17.790 -28.599 -15.576 1.00 0.00 C ATOM 2041 C TRP A 131 -18.548 -29.823 -15.078 1.00 0.00 C ATOM 2042 O TRP A 131 -18.129 -30.432 -14.093 1.00 0.00 O ATOM 2043 CB TRP A 131 -18.413 -27.319 -15.030 1.00 0.00 C ATOM 2044 CG TRP A 131 -17.653 -26.068 -15.314 1.00 0.00 C ATOM 2045 CD1 TRP A 131 -16.443 -25.992 -15.905 1.00 0.00 C ATOM 2046 CD2 TRP A 131 -18.033 -24.689 -15.020 1.00 0.00 C ATOM 2047 NE1 TRP A 131 -16.055 -24.675 -16.008 1.00 0.00 N ATOM 2048 CE2 TRP A 131 -16.997 -23.825 -15.473 1.00 0.00 C ATOM 2049 CE3 TRP A 131 -19.147 -24.084 -14.418 1.00 0.00 C ATOM 2050 CZ2 TRP A 131 -17.062 -22.437 -15.324 1.00 0.00 C ATOM 2051 CZ3 TRP A 131 -19.229 -22.692 -14.277 1.00 0.00 C ATOM 2052 CH2 TRP A 131 -18.190 -21.864 -14.723 1.00 0.00 C ATOM 0 H TRP A 131 -18.291 -27.808 -17.455 1.00 0.00 H new ATOM 0 HA TRP A 131 -16.766 -28.672 -15.210 1.00 0.00 H new ATOM 0 HB2 TRP A 131 -19.416 -27.217 -15.445 1.00 0.00 H new ATOM 0 HB3 TRP A 131 -18.523 -27.420 -13.950 1.00 0.00 H new ATOM 0 HD1 TRP A 131 -15.865 -26.838 -16.246 1.00 0.00 H new ATOM 0 HE1 TRP A 131 -15.178 -24.367 -16.429 1.00 0.00 H new ATOM 0 HE3 TRP A 131 -19.956 -24.702 -14.057 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 -16.251 -21.813 -15.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 -20.103 -22.252 -13.819 1.00 0.00 H new ATOM 0 HH2 TRP A 131 -18.259 -20.793 -14.604 1.00 0.00 H new