USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=33 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 118 GLN : amide:sc= -0.109 K(o=1,f=-5.6!) USER MOD Set 1.2: A 121 LYS NZ :NH3+ -119:sc= 1.15 (180deg=0) USER MOD Set 2.1: A 60 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 117 ASN : amide:sc= 1.14 K(o=0.0084,f=-0.59) USER MOD Set 2.3: A 120 HIS : no HD1:sc= -1.14 K(o=0.0084,f=-0.59) USER MOD Set 3.1: A 96 HIS : no HD1:sc= 0 X(o=1.2,f=1.2) USER MOD Set 3.2: A 100 THR OG1 : rot 83:sc= 1.18 USER MOD Set 4.1: A 80 THR OG1 : rot 178:sc= 1.13 USER MOD Set 4.2: A 94 CYS SG : rot 147:sc= -0.883 USER MOD Single : A 8 GLN : amide:sc= -0.0764 K(o=-0.076,f=-0.73) USER MOD Single : A 9 ASN : amide:sc= 0.765 K(o=0.76,f=-0.032) USER MOD Single : A 13 THR OG1 : rot 93:sc= 1.3 USER MOD Single : A 16 SER OG : rot 25:sc= 0.967 USER MOD Single : A 18 LYS NZ :NH3+ -142:sc= -0.159 (180deg=-1.33!) USER MOD Single : A 21 LYS NZ :NH3+ -174:sc= 1.2 (180deg=1.1) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 80:sc= 0.0408 USER MOD Single : A 27 SER OG : rot 180:sc= -0.0292 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 105:sc= 1.17 USER MOD Single : A 34 THR OG1 : rot 106:sc= 1.28 USER MOD Single : A 35 TYR OH : rot 159:sc= 1.09 USER MOD Single : A 39 HIS : no HD1:sc= -0.926 X(o=-0.93,f=-1.2) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -109:sc= -0.216 (180deg=-2.26!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot -129:sc= -0.0159 USER MOD Single : A 54 SER OG : rot -58:sc= 1.16 USER MOD Single : A 57 CYS SG : rot -80:sc= -1.64 USER MOD Single : A 61 HIS : no HD1:sc= -0.999 K(o=-1,f=-4.5!) USER MOD Single : A 62 LYS NZ :NH3+ -175:sc= 2.53 (180deg=2.18) USER MOD Single : A 65 SER OG : rot -100:sc= -0.536 USER MOD Single : A 67 TYR OH : rot 110:sc= -0.147 USER MOD Single : A 71 SER OG : rot 77:sc= 1.19 USER MOD Single : A 76 TYR OH : rot 166:sc= 0.825 USER MOD Single : A 82 SER OG : rot 74:sc= 1.14 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0134 USER MOD Single : A 99 ASN :FLIP amide:sc= -0.42 F(o=-1.6,f=-0.42) USER MOD Single : A 106 GLN : amide:sc= 1.2 K(o=1.2,f=-0.59) USER MOD Single : A 110 SER OG : rot 109:sc= 1.14 USER MOD Single : A 115 LYS NZ :NH3+ 138:sc= -1.54 (180deg=-3.87!) USER MOD Single : A 116 SER OG : rot -83:sc= 0.966 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl -167:sc= -0.0057 (180deg=-0.243) USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 0.329 -9.879 -2.187 1.00 0.00 N ATOM 79 CA ASP A 6 0.495 -10.805 -3.292 1.00 0.00 C ATOM 80 C ASP A 6 -0.755 -10.722 -4.161 1.00 0.00 C ATOM 81 O ASP A 6 -0.701 -10.918 -5.373 1.00 0.00 O ATOM 82 CB ASP A 6 0.664 -12.235 -2.762 1.00 0.00 C ATOM 83 CG ASP A 6 -0.524 -12.765 -1.956 1.00 0.00 C ATOM 84 OD1 ASP A 6 -1.290 -11.948 -1.397 1.00 0.00 O ATOM 85 OD2 ASP A 6 -0.651 -14.008 -1.911 1.00 0.00 O1- ATOM 0 HA ASP A 6 1.382 -10.547 -3.870 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.839 -12.902 -3.606 1.00 0.00 H new ATOM 0 HB3 ASP A 6 1.556 -12.273 -2.136 1.00 0.00 H new ATOM 90 N PHE A 7 -1.876 -10.428 -3.501 1.00 0.00 N ATOM 91 CA PHE A 7 -3.187 -10.293 -4.095 1.00 0.00 C ATOM 92 C PHE A 7 -3.169 -9.197 -5.152 1.00 0.00 C ATOM 93 O PHE A 7 -3.867 -9.286 -6.156 1.00 0.00 O ATOM 94 CB PHE A 7 -4.178 -9.935 -2.988 1.00 0.00 C ATOM 95 CG PHE A 7 -5.638 -10.107 -3.343 1.00 0.00 C ATOM 96 CD1 PHE A 7 -6.025 -10.837 -4.477 1.00 0.00 C ATOM 97 CD2 PHE A 7 -6.612 -9.532 -2.517 1.00 0.00 C ATOM 98 CE1 PHE A 7 -7.381 -11.007 -4.778 1.00 0.00 C ATOM 99 CE2 PHE A 7 -7.970 -9.697 -2.819 1.00 0.00 C ATOM 100 CZ PHE A 7 -8.350 -10.442 -3.944 1.00 0.00 C ATOM 0 H PHE A 7 -1.885 -10.272 -2.493 1.00 0.00 H new ATOM 0 HA PHE A 7 -3.480 -11.227 -4.574 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -3.959 -10.550 -2.115 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -4.012 -8.898 -2.697 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -5.273 -11.270 -5.120 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -6.317 -8.962 -1.648 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -7.677 -11.572 -5.650 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -8.723 -9.251 -2.186 1.00 0.00 H new ATOM 0 HZ PHE A 7 -9.398 -10.580 -4.168 1.00 0.00 H new ATOM 110 N GLN A 8 -2.365 -8.156 -4.917 1.00 0.00 N ATOM 111 CA GLN A 8 -2.231 -7.010 -5.797 1.00 0.00 C ATOM 112 C GLN A 8 -1.987 -7.437 -7.244 1.00 0.00 C ATOM 113 O GLN A 8 -2.495 -6.808 -8.171 1.00 0.00 O ATOM 114 CB GLN A 8 -1.065 -6.156 -5.284 1.00 0.00 C ATOM 115 CG GLN A 8 -0.744 -5.022 -6.261 1.00 0.00 C ATOM 116 CD GLN A 8 -1.950 -4.121 -6.483 1.00 0.00 C ATOM 117 OE1 GLN A 8 -2.772 -3.930 -5.590 1.00 0.00 O ATOM 118 NE2 GLN A 8 -2.065 -3.557 -7.682 1.00 0.00 N ATOM 0 H GLN A 8 -1.777 -8.093 -4.086 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.158 -6.436 -5.790 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.316 -5.740 -4.308 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.184 -6.783 -5.146 1.00 0.00 H new ATOM 0 HG2 GLN A 8 0.087 -4.431 -5.875 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.421 -5.441 -7.214 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -1.364 -3.738 -8.400 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -2.855 -2.944 -7.883 1.00 0.00 H new ATOM 127 N ASN A 9 -1.215 -8.508 -7.449 1.00 0.00 N ATOM 128 CA ASN A 9 -0.911 -8.991 -8.784 1.00 0.00 C ATOM 129 C ASN A 9 -2.129 -9.685 -9.389 1.00 0.00 C ATOM 130 O ASN A 9 -2.345 -9.628 -10.600 1.00 0.00 O ATOM 131 CB ASN A 9 0.275 -9.953 -8.691 1.00 0.00 C ATOM 132 CG ASN A 9 1.429 -9.345 -7.908 1.00 0.00 C ATOM 133 OD1 ASN A 9 2.207 -8.562 -8.441 1.00 0.00 O ATOM 134 ND2 ASN A 9 1.542 -9.704 -6.631 1.00 0.00 N ATOM 0 H ASN A 9 -0.791 -9.054 -6.699 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.653 -8.155 -9.434 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -0.043 -10.879 -8.211 1.00 0.00 H new ATOM 0 HB3 ASN A 9 0.612 -10.214 -9.694 1.00 0.00 H new ATOM 0 HD21 ASN A 9 2.297 -9.324 -6.059 1.00 0.00 H new ATOM 0 HD22 ASN A 9 0.874 -10.359 -6.224 1.00 0.00 H new ATOM 141 N PHE A 10 -2.925 -10.342 -8.540 1.00 0.00 N ATOM 142 CA PHE A 10 -4.146 -11.007 -8.947 1.00 0.00 C ATOM 143 C PHE A 10 -5.203 -9.962 -9.298 1.00 0.00 C ATOM 144 O PHE A 10 -5.938 -10.123 -10.268 1.00 0.00 O ATOM 145 CB PHE A 10 -4.643 -11.853 -7.777 1.00 0.00 C ATOM 146 CG PHE A 10 -5.603 -12.952 -8.158 1.00 0.00 C ATOM 147 CD1 PHE A 10 -6.912 -12.650 -8.553 1.00 0.00 C ATOM 148 CD2 PHE A 10 -5.174 -14.285 -8.109 1.00 0.00 C ATOM 149 CE1 PHE A 10 -7.796 -13.685 -8.885 1.00 0.00 C ATOM 150 CE2 PHE A 10 -6.052 -15.321 -8.448 1.00 0.00 C ATOM 151 CZ PHE A 10 -7.365 -15.018 -8.836 1.00 0.00 C ATOM 0 H PHE A 10 -2.729 -10.422 -7.542 1.00 0.00 H new ATOM 0 HA PHE A 10 -3.960 -11.635 -9.818 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -3.783 -12.298 -7.276 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.129 -11.199 -7.054 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.239 -11.622 -8.602 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -4.162 -14.514 -7.809 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -8.810 -13.456 -9.179 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -5.720 -16.348 -8.411 1.00 0.00 H new ATOM 0 HZ PHE A 10 -8.046 -15.814 -9.098 1.00 0.00 H new ATOM 161 N VAL A 11 -5.268 -8.888 -8.500 1.00 0.00 N ATOM 162 CA VAL A 11 -6.212 -7.811 -8.731 1.00 0.00 C ATOM 163 C VAL A 11 -5.880 -7.159 -10.065 1.00 0.00 C ATOM 164 O VAL A 11 -6.744 -7.035 -10.926 1.00 0.00 O ATOM 165 CB VAL A 11 -6.147 -6.770 -7.604 1.00 0.00 C ATOM 166 CG1 VAL A 11 -7.108 -5.615 -7.888 1.00 0.00 C ATOM 167 CG2 VAL A 11 -6.530 -7.388 -6.257 1.00 0.00 C ATOM 0 H VAL A 11 -4.669 -8.751 -7.686 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.224 -8.215 -8.749 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.120 -6.406 -7.560 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.050 -4.886 -7.080 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -6.834 -5.137 -8.828 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.126 -5.998 -7.959 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.475 -6.627 -5.479 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -7.546 -7.778 -6.311 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -5.842 -8.200 -6.020 1.00 0.00 H new ATOM 177 N ALA A 12 -4.623 -6.743 -10.239 1.00 0.00 N ATOM 178 CA ALA A 12 -4.170 -6.097 -11.461 1.00 0.00 C ATOM 179 C ALA A 12 -4.358 -6.997 -12.681 1.00 0.00 C ATOM 180 O ALA A 12 -4.555 -6.489 -13.785 1.00 0.00 O ATOM 181 CB ALA A 12 -2.701 -5.717 -11.294 1.00 0.00 C ATOM 0 H ALA A 12 -3.895 -6.847 -9.533 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.771 -5.204 -11.633 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.345 -5.231 -12.203 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.596 -5.033 -10.452 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.112 -6.615 -11.108 1.00 0.00 H new ATOM 187 N THR A 13 -4.303 -8.322 -12.507 1.00 0.00 N ATOM 188 CA THR A 13 -4.556 -9.237 -13.616 1.00 0.00 C ATOM 189 C THR A 13 -6.049 -9.208 -13.952 1.00 0.00 C ATOM 190 O THR A 13 -6.434 -9.284 -15.117 1.00 0.00 O ATOM 191 CB THR A 13 -4.086 -10.647 -13.239 1.00 0.00 C ATOM 192 OG1 THR A 13 -2.705 -10.625 -12.948 1.00 0.00 O ATOM 193 CG2 THR A 13 -4.317 -11.629 -14.386 1.00 0.00 C ATOM 0 H THR A 13 -4.088 -8.777 -11.620 1.00 0.00 H new ATOM 0 HA THR A 13 -3.998 -8.929 -14.500 1.00 0.00 H new ATOM 0 HB THR A 13 -4.659 -10.969 -12.369 1.00 0.00 H new ATOM 0 HG1 THR A 13 -2.576 -10.492 -11.986 1.00 0.00 H new ATOM 0 HG21 THR A 13 -3.974 -12.621 -14.091 1.00 0.00 H new ATOM 0 HG22 THR A 13 -5.380 -11.668 -14.623 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.761 -11.300 -15.264 1.00 0.00 H new ATOM 201 N LEU A 14 -6.898 -9.095 -12.924 1.00 0.00 N ATOM 202 CA LEU A 14 -8.337 -9.029 -13.106 1.00 0.00 C ATOM 203 C LEU A 14 -8.729 -7.711 -13.766 1.00 0.00 C ATOM 204 O LEU A 14 -9.587 -7.674 -14.641 1.00 0.00 O ATOM 205 CB LEU A 14 -8.994 -9.121 -11.729 1.00 0.00 C ATOM 206 CG LEU A 14 -10.429 -9.633 -11.839 1.00 0.00 C ATOM 207 CD1 LEU A 14 -10.441 -11.163 -11.912 1.00 0.00 C ATOM 208 CD2 LEU A 14 -11.173 -9.173 -10.590 1.00 0.00 C ATOM 0 H LEU A 14 -6.600 -9.048 -11.950 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.665 -9.848 -13.747 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.415 -9.787 -11.090 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.990 -8.140 -11.254 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.903 -9.246 -12.741 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.469 -11.515 -11.990 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.878 -11.490 -12.786 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.984 -11.574 -11.012 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.205 -9.521 -10.632 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -10.688 -9.584 -9.705 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.159 -8.084 -10.538 1.00 0.00 H new ATOM 220 N GLU A 15 -8.085 -6.625 -13.335 1.00 0.00 N ATOM 221 CA GLU A 15 -8.280 -5.303 -13.898 1.00 0.00 C ATOM 222 C GLU A 15 -7.795 -5.320 -15.346 1.00 0.00 C ATOM 223 O GLU A 15 -8.309 -4.600 -16.203 1.00 0.00 O ATOM 224 CB GLU A 15 -7.484 -4.313 -13.044 1.00 0.00 C ATOM 225 CG GLU A 15 -8.009 -4.291 -11.602 1.00 0.00 C ATOM 226 CD GLU A 15 -9.327 -3.537 -11.454 1.00 0.00 C ATOM 227 OE1 GLU A 15 -9.886 -3.577 -10.337 1.00 0.00 O ATOM 228 OE2 GLU A 15 -9.778 -2.925 -12.448 1.00 0.00 O1- ATOM 0 H GLU A 15 -7.406 -6.647 -12.574 1.00 0.00 H new ATOM 0 HA GLU A 15 -9.329 -5.005 -13.896 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.429 -4.589 -13.048 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -7.554 -3.315 -13.476 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.143 -5.316 -11.255 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -7.260 -3.831 -10.957 1.00 0.00 H new ATOM 235 N SER A 16 -6.790 -6.156 -15.613 1.00 0.00 N ATOM 236 CA SER A 16 -6.242 -6.311 -16.950 1.00 0.00 C ATOM 237 C SER A 16 -7.219 -7.099 -17.825 1.00 0.00 C ATOM 238 O SER A 16 -7.141 -7.024 -19.049 1.00 0.00 O ATOM 239 CB SER A 16 -4.872 -6.978 -16.867 1.00 0.00 C ATOM 240 OG SER A 16 -4.260 -6.986 -18.138 1.00 0.00 O ATOM 0 H SER A 16 -6.339 -6.739 -14.908 1.00 0.00 H new ATOM 0 HA SER A 16 -6.106 -5.335 -17.415 1.00 0.00 H new ATOM 0 HB2 SER A 16 -4.242 -6.445 -16.155 1.00 0.00 H new ATOM 0 HB3 SER A 16 -4.977 -7.999 -16.499 1.00 0.00 H new ATOM 0 HG SER A 16 -4.623 -6.255 -18.680 1.00 0.00 H new ATOM 246 N PHE A 17 -8.140 -7.857 -17.214 1.00 0.00 N ATOM 247 CA PHE A 17 -9.241 -8.427 -17.976 1.00 0.00 C ATOM 248 C PHE A 17 -10.274 -7.359 -18.300 1.00 0.00 C ATOM 249 O PHE A 17 -10.867 -7.392 -19.374 1.00 0.00 O ATOM 250 CB PHE A 17 -9.942 -9.541 -17.209 1.00 0.00 C ATOM 251 CG PHE A 17 -9.090 -10.730 -16.852 1.00 0.00 C ATOM 252 CD1 PHE A 17 -9.266 -11.335 -15.605 1.00 0.00 C ATOM 253 CD2 PHE A 17 -8.144 -11.232 -17.752 1.00 0.00 C ATOM 254 CE1 PHE A 17 -8.487 -12.445 -15.247 1.00 0.00 C ATOM 255 CE2 PHE A 17 -7.377 -12.349 -17.402 1.00 0.00 C ATOM 256 CZ PHE A 17 -7.541 -12.948 -16.147 1.00 0.00 C ATOM 0 H PHE A 17 -8.140 -8.081 -16.219 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.811 -8.835 -18.891 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -10.350 -9.122 -16.289 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.787 -9.889 -17.803 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.002 -10.948 -14.916 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -8.006 -10.759 -18.713 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.617 -12.910 -14.281 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.658 -12.750 -18.101 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.936 -13.800 -15.873 1.00 0.00 H new ATOM 266 N LYS A 18 -10.507 -6.403 -17.392 1.00 0.00 N ATOM 267 CA LYS A 18 -11.473 -5.339 -17.655 1.00 0.00 C ATOM 268 C LYS A 18 -11.026 -4.524 -18.860 1.00 0.00 C ATOM 269 O LYS A 18 -11.850 -3.960 -19.576 1.00 0.00 O ATOM 270 CB LYS A 18 -11.611 -4.414 -16.449 1.00 0.00 C ATOM 271 CG LYS A 18 -11.874 -5.194 -15.163 1.00 0.00 C ATOM 272 CD LYS A 18 -12.283 -4.209 -14.077 1.00 0.00 C ATOM 273 CE LYS A 18 -12.231 -4.880 -12.707 1.00 0.00 C ATOM 274 NZ LYS A 18 -12.290 -3.872 -11.635 1.00 0.00 N1+ ATOM 0 H LYS A 18 -10.046 -6.347 -16.484 1.00 0.00 H new ATOM 0 HA LYS A 18 -12.440 -5.801 -17.855 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -10.701 -3.825 -16.337 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.426 -3.711 -16.621 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.661 -5.932 -15.321 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.980 -5.741 -14.862 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -11.619 -3.345 -14.092 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.290 -3.841 -14.271 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -13.063 -5.577 -12.605 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.314 -5.463 -12.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -11.662 -4.156 -10.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.984 -2.950 -12.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.266 -3.797 -11.283 1.00 0.00 H new ATOM 288 N ASP A 19 -9.710 -4.472 -19.067 1.00 0.00 N ATOM 289 CA ASP A 19 -9.108 -3.791 -20.214 1.00 0.00 C ATOM 290 C ASP A 19 -9.498 -4.453 -21.541 1.00 0.00 C ATOM 291 O ASP A 19 -9.418 -3.825 -22.595 1.00 0.00 O ATOM 292 CB ASP A 19 -7.584 -3.823 -20.049 1.00 0.00 C ATOM 293 CG ASP A 19 -6.833 -3.171 -21.206 1.00 0.00 C ATOM 294 OD1 ASP A 19 -7.353 -2.173 -21.747 1.00 0.00 O ATOM 295 OD2 ASP A 19 -5.739 -3.686 -21.539 1.00 0.00 O1- ATOM 0 H ASP A 19 -9.029 -4.903 -18.442 1.00 0.00 H new ATOM 0 HA ASP A 19 -9.475 -2.765 -20.243 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -7.316 -3.317 -19.121 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.259 -4.859 -19.953 1.00 0.00 H new ATOM 300 N LEU A 20 -9.923 -5.718 -21.514 1.00 0.00 N ATOM 301 CA LEU A 20 -10.219 -6.468 -22.728 1.00 0.00 C ATOM 302 C LEU A 20 -11.484 -5.964 -23.413 1.00 0.00 C ATOM 303 O LEU A 20 -12.362 -5.386 -22.776 1.00 0.00 O ATOM 304 CB LEU A 20 -10.395 -7.948 -22.394 1.00 0.00 C ATOM 305 CG LEU A 20 -9.162 -8.544 -21.715 1.00 0.00 C ATOM 306 CD1 LEU A 20 -9.534 -9.904 -21.145 1.00 0.00 C ATOM 307 CD2 LEU A 20 -8.036 -8.728 -22.725 1.00 0.00 C ATOM 0 H LEU A 20 -10.070 -6.245 -20.653 1.00 0.00 H new ATOM 0 HA LEU A 20 -9.380 -6.328 -23.409 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -11.260 -8.070 -21.742 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.605 -8.501 -23.309 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.826 -7.871 -20.926 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -8.665 -10.344 -20.656 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -10.338 -9.786 -20.418 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -9.867 -10.558 -21.951 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -7.165 -9.153 -22.226 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -8.364 -9.401 -23.517 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.772 -7.762 -23.155 1.00 0.00 H new ATOM 319 N LYS A 21 -11.565 -6.196 -24.727 1.00 0.00 N ATOM 320 CA LYS A 21 -12.757 -5.917 -25.519 1.00 0.00 C ATOM 321 C LYS A 21 -13.516 -7.222 -25.755 1.00 0.00 C ATOM 322 O LYS A 21 -14.593 -7.217 -26.348 1.00 0.00 O ATOM 323 CB LYS A 21 -12.368 -5.261 -26.850 1.00 0.00 C ATOM 324 CG LYS A 21 -12.086 -3.757 -26.736 1.00 0.00 C ATOM 325 CD LYS A 21 -10.953 -3.403 -25.768 1.00 0.00 C ATOM 326 CE LYS A 21 -9.672 -4.155 -26.125 1.00 0.00 C ATOM 327 NZ LYS A 21 -8.603 -3.886 -25.148 1.00 0.00 N1+ ATOM 0 H LYS A 21 -10.796 -6.586 -25.271 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.402 -5.223 -24.981 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.483 -5.759 -27.245 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.171 -5.418 -27.571 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.839 -3.369 -27.724 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.996 -3.251 -26.413 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.768 -2.329 -25.796 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.251 -3.649 -24.749 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.874 -5.226 -26.160 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.340 -3.860 -27.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.718 -4.327 -25.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.465 -2.859 -25.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -8.870 -4.281 -24.224 1.00 0.00 H new ATOM 341 N SER A 22 -12.944 -8.337 -25.290 1.00 0.00 N ATOM 342 CA SER A 22 -13.503 -9.676 -25.438 1.00 0.00 C ATOM 343 C SER A 22 -13.719 -10.335 -24.077 1.00 0.00 C ATOM 344 O SER A 22 -14.502 -11.275 -23.955 1.00 0.00 O ATOM 345 CB SER A 22 -12.502 -10.488 -26.248 1.00 0.00 C ATOM 346 OG SER A 22 -11.284 -10.537 -25.537 1.00 0.00 O ATOM 0 H SER A 22 -12.056 -8.328 -24.788 1.00 0.00 H new ATOM 0 HA SER A 22 -14.472 -9.626 -25.934 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.882 -11.495 -26.419 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.351 -10.034 -27.227 1.00 0.00 H new ATOM 0 HG SER A 22 -10.629 -11.059 -26.046 1.00 0.00 H new ATOM 352 N GLY A 23 -13.021 -9.838 -23.052 1.00 0.00 N ATOM 353 CA GLY A 23 -13.159 -10.288 -21.675 1.00 0.00 C ATOM 354 C GLY A 23 -12.350 -11.548 -21.361 1.00 0.00 C ATOM 355 O GLY A 23 -12.132 -11.848 -20.190 1.00 0.00 O ATOM 0 H GLY A 23 -12.331 -9.096 -23.165 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.844 -9.487 -21.006 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.212 -10.481 -21.468 1.00 0.00 H new ATOM 359 N ILE A 24 -11.903 -12.289 -22.381 1.00 0.00 N ATOM 360 CA ILE A 24 -11.130 -13.510 -22.185 1.00 0.00 C ATOM 361 C ILE A 24 -9.642 -13.251 -22.416 1.00 0.00 C ATOM 362 O ILE A 24 -9.284 -12.404 -23.233 1.00 0.00 O ATOM 363 CB ILE A 24 -11.655 -14.594 -23.131 1.00 0.00 C ATOM 364 CG1 ILE A 24 -13.111 -14.950 -22.799 1.00 0.00 C ATOM 365 CG2 ILE A 24 -10.775 -15.844 -23.031 1.00 0.00 C ATOM 366 CD1 ILE A 24 -13.757 -15.731 -23.944 1.00 0.00 C ATOM 0 H ILE A 24 -12.069 -12.056 -23.360 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.245 -13.851 -21.156 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.620 -14.209 -24.150 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -13.145 -15.542 -21.885 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.678 -14.039 -22.610 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.154 -16.611 -23.706 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.751 -15.591 -23.307 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.793 -16.220 -22.008 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -14.788 -15.971 -23.684 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.743 -15.126 -24.851 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.201 -16.653 -24.114 1.00 0.00 H new ATOM 378 N SER A 25 -8.770 -13.978 -21.705 1.00 0.00 N ATOM 379 CA SER A 25 -7.331 -13.832 -21.863 1.00 0.00 C ATOM 380 C SER A 25 -6.618 -15.039 -21.278 1.00 0.00 C ATOM 381 O SER A 25 -6.205 -15.011 -20.123 1.00 0.00 O ATOM 382 CB SER A 25 -6.844 -12.564 -21.167 1.00 0.00 C ATOM 383 OG SER A 25 -5.442 -12.475 -21.287 1.00 0.00 O ATOM 0 H SER A 25 -9.046 -14.675 -21.013 1.00 0.00 H new ATOM 0 HA SER A 25 -7.106 -13.760 -22.927 1.00 0.00 H new ATOM 0 HB2 SER A 25 -7.315 -11.687 -21.612 1.00 0.00 H new ATOM 0 HB3 SER A 25 -7.130 -12.580 -20.115 1.00 0.00 H new ATOM 0 HG SER A 25 -5.211 -12.130 -22.175 1.00 0.00 H new ATOM 389 N GLY A 26 -6.470 -16.104 -22.063 1.00 0.00 N ATOM 390 CA GLY A 26 -5.888 -17.337 -21.571 1.00 0.00 C ATOM 391 C GLY A 26 -4.556 -17.106 -20.870 1.00 0.00 C ATOM 392 O GLY A 26 -4.298 -17.741 -19.849 1.00 0.00 O ATOM 0 H GLY A 26 -6.748 -16.131 -23.044 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -6.583 -17.814 -20.879 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.744 -18.026 -22.403 1.00 0.00 H new ATOM 396 N SER A 27 -3.700 -16.216 -21.382 1.00 0.00 N ATOM 397 CA SER A 27 -2.392 -16.022 -20.777 1.00 0.00 C ATOM 398 C SER A 27 -2.521 -15.429 -19.376 1.00 0.00 C ATOM 399 O SER A 27 -1.899 -15.928 -18.442 1.00 0.00 O ATOM 400 CB SER A 27 -1.519 -15.134 -21.668 1.00 0.00 C ATOM 401 OG SER A 27 -2.057 -13.832 -21.754 1.00 0.00 O ATOM 0 H SER A 27 -3.889 -15.633 -22.197 1.00 0.00 H new ATOM 0 HA SER A 27 -1.910 -16.995 -20.683 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.507 -15.089 -21.265 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.446 -15.570 -22.665 1.00 0.00 H new ATOM 0 HG SER A 27 -1.485 -13.279 -22.326 1.00 0.00 H new ATOM 407 N ARG A 28 -3.323 -14.372 -19.213 1.00 0.00 N ATOM 408 CA ARG A 28 -3.502 -13.726 -17.918 1.00 0.00 C ATOM 409 C ARG A 28 -4.354 -14.597 -16.997 1.00 0.00 C ATOM 410 O ARG A 28 -4.128 -14.617 -15.790 1.00 0.00 O ATOM 411 CB ARG A 28 -4.137 -12.353 -18.142 1.00 0.00 C ATOM 412 CG ARG A 28 -3.055 -11.304 -18.390 1.00 0.00 C ATOM 413 CD ARG A 28 -3.675 -10.018 -18.936 1.00 0.00 C ATOM 414 NE ARG A 28 -4.060 -10.186 -20.341 1.00 0.00 N ATOM 415 CZ ARG A 28 -4.478 -9.195 -21.135 1.00 0.00 C ATOM 416 NH1 ARG A 28 -4.667 -7.964 -20.667 1.00 0.00 N1+ ATOM 417 NH2 ARG A 28 -4.715 -9.419 -22.423 1.00 0.00 N ATOM 0 H ARG A 28 -3.859 -13.947 -19.969 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.537 -13.595 -17.428 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -4.816 -12.393 -18.993 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.732 -12.073 -17.273 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -2.524 -11.094 -17.462 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.321 -11.690 -19.097 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.550 -9.750 -18.343 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -2.963 -9.197 -18.844 1.00 0.00 H new ATOM 0 HE ARG A 28 -4.005 -11.123 -20.740 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -4.492 -7.760 -19.683 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.986 -7.224 -21.292 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -4.578 -10.352 -22.812 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.034 -8.658 -23.023 1.00 0.00 H new ATOM 431 N ILE A 29 -5.330 -15.317 -17.555 1.00 0.00 N ATOM 432 CA ILE A 29 -6.108 -16.278 -16.799 1.00 0.00 C ATOM 433 C ILE A 29 -5.171 -17.328 -16.216 1.00 0.00 C ATOM 434 O ILE A 29 -5.252 -17.633 -15.030 1.00 0.00 O ATOM 435 CB ILE A 29 -7.165 -16.901 -17.720 1.00 0.00 C ATOM 436 CG1 ILE A 29 -8.226 -15.843 -18.045 1.00 0.00 C ATOM 437 CG2 ILE A 29 -7.812 -18.123 -17.056 1.00 0.00 C ATOM 438 CD1 ILE A 29 -9.270 -16.367 -19.029 1.00 0.00 C ATOM 0 H ILE A 29 -5.595 -15.245 -18.537 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.626 -15.794 -15.971 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.689 -17.237 -18.641 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.719 -15.529 -17.125 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.742 -14.961 -18.464 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.558 -18.549 -17.727 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.047 -18.870 -16.844 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.291 -17.820 -16.125 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -10.003 -15.586 -19.232 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.781 -16.656 -19.959 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.773 -17.233 -18.599 1.00 0.00 H new ATOM 450 N LYS A 30 -4.274 -17.886 -17.039 1.00 0.00 N ATOM 451 CA LYS A 30 -3.341 -18.905 -16.581 1.00 0.00 C ATOM 452 C LYS A 30 -2.307 -18.325 -15.616 1.00 0.00 C ATOM 453 O LYS A 30 -1.743 -19.077 -14.824 1.00 0.00 O ATOM 454 CB LYS A 30 -2.664 -19.568 -17.782 1.00 0.00 C ATOM 455 CG LYS A 30 -3.647 -20.549 -18.440 1.00 0.00 C ATOM 456 CD LYS A 30 -3.113 -21.134 -19.753 1.00 0.00 C ATOM 457 CE LYS A 30 -3.128 -20.064 -20.849 1.00 0.00 C ATOM 458 NZ LYS A 30 -2.791 -20.615 -22.174 1.00 0.00 N1+ ATOM 0 H LYS A 30 -4.180 -17.644 -18.025 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.901 -19.662 -16.032 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.351 -18.811 -18.501 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.765 -20.095 -17.462 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.861 -21.362 -17.746 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.590 -20.037 -18.632 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.098 -21.504 -19.609 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.723 -21.985 -20.056 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.115 -19.603 -20.890 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.419 -19.276 -20.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.814 -19.854 -22.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.839 -21.032 -22.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.482 -21.348 -22.431 1.00 0.00 H new ATOM 472 N LYS A 31 -2.049 -17.010 -15.663 1.00 0.00 N ATOM 473 CA LYS A 31 -1.134 -16.387 -14.715 1.00 0.00 C ATOM 474 C LYS A 31 -1.709 -16.443 -13.305 1.00 0.00 C ATOM 475 O LYS A 31 -1.066 -16.985 -12.406 1.00 0.00 O ATOM 476 CB LYS A 31 -0.840 -14.932 -15.114 1.00 0.00 C ATOM 477 CG LYS A 31 0.123 -14.846 -16.307 1.00 0.00 C ATOM 478 CD LYS A 31 1.588 -14.772 -15.863 1.00 0.00 C ATOM 479 CE LYS A 31 2.013 -16.022 -15.097 1.00 0.00 C ATOM 480 NZ LYS A 31 3.442 -15.968 -14.746 1.00 0.00 N1+ ATOM 0 H LYS A 31 -2.459 -16.369 -16.342 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.196 -16.943 -14.733 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.774 -14.429 -15.365 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.411 -14.402 -14.263 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.017 -15.716 -16.949 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -0.119 -13.967 -16.905 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.227 -14.647 -16.737 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.733 -13.894 -15.234 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.416 -16.117 -14.190 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.817 -16.907 -15.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.705 -16.830 -14.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.010 -15.901 -15.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.622 -15.135 -14.149 1.00 0.00 H new ATOM 494 N LEU A 32 -2.909 -15.893 -13.092 1.00 0.00 N ATOM 495 CA LEU A 32 -3.471 -15.891 -11.750 1.00 0.00 C ATOM 496 C LEU A 32 -3.998 -17.275 -11.360 1.00 0.00 C ATOM 497 O LEU A 32 -4.181 -17.553 -10.176 1.00 0.00 O ATOM 498 CB LEU A 32 -4.500 -14.762 -11.593 1.00 0.00 C ATOM 499 CG LEU A 32 -5.710 -14.789 -12.533 1.00 0.00 C ATOM 500 CD1 LEU A 32 -6.643 -15.981 -12.308 1.00 0.00 C ATOM 501 CD2 LEU A 32 -6.521 -13.527 -12.249 1.00 0.00 C ATOM 0 H LEU A 32 -3.489 -15.458 -13.810 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.677 -15.676 -11.035 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.867 -14.779 -10.567 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -3.984 -13.812 -11.732 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.332 -14.859 -13.553 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.475 -15.930 -13.011 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.092 -16.909 -12.464 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.027 -15.955 -11.288 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.396 -13.503 -12.898 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.842 -13.527 -11.207 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.905 -12.648 -12.439 1.00 0.00 H new ATOM 513 N THR A 33 -4.244 -18.153 -12.339 1.00 0.00 N ATOM 514 CA THR A 33 -4.657 -19.517 -12.048 1.00 0.00 C ATOM 515 C THR A 33 -3.461 -20.296 -11.510 1.00 0.00 C ATOM 516 O THR A 33 -3.603 -21.111 -10.602 1.00 0.00 O ATOM 517 CB THR A 33 -5.181 -20.173 -13.329 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.336 -19.505 -13.776 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.547 -21.641 -13.114 1.00 0.00 C ATOM 0 H THR A 33 -4.163 -17.938 -13.333 1.00 0.00 H new ATOM 0 HA THR A 33 -5.450 -19.516 -11.301 1.00 0.00 H new ATOM 0 HB THR A 33 -4.379 -20.109 -14.065 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.112 -18.944 -14.548 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.914 -22.065 -14.049 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.665 -22.192 -12.787 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.324 -21.715 -12.353 1.00 0.00 H new ATOM 527 N THR A 34 -2.275 -20.042 -12.073 1.00 0.00 N ATOM 528 CA THR A 34 -1.067 -20.723 -11.640 1.00 0.00 C ATOM 529 C THR A 34 -0.683 -20.263 -10.235 1.00 0.00 C ATOM 530 O THR A 34 -0.186 -21.060 -9.442 1.00 0.00 O ATOM 531 CB THR A 34 0.053 -20.458 -12.649 1.00 0.00 C ATOM 532 OG1 THR A 34 -0.284 -21.020 -13.896 1.00 0.00 O ATOM 533 CG2 THR A 34 1.353 -21.086 -12.156 1.00 0.00 C ATOM 0 H THR A 34 -2.134 -19.370 -12.827 1.00 0.00 H new ATOM 0 HA THR A 34 -1.240 -21.798 -11.597 1.00 0.00 H new ATOM 0 HB THR A 34 0.183 -19.381 -12.755 1.00 0.00 H new ATOM 0 HG1 THR A 34 -0.537 -20.307 -14.519 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.147 -20.894 -12.878 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.625 -20.652 -11.194 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.218 -22.162 -12.043 1.00 0.00 H new ATOM 541 N TYR A 35 -0.912 -18.983 -9.925 1.00 0.00 N ATOM 542 CA TYR A 35 -0.696 -18.466 -8.580 1.00 0.00 C ATOM 543 C TYR A 35 -1.623 -19.181 -7.601 1.00 0.00 C ATOM 544 O TYR A 35 -1.223 -19.500 -6.481 1.00 0.00 O ATOM 545 CB TYR A 35 -0.995 -16.964 -8.566 1.00 0.00 C ATOM 546 CG TYR A 35 -1.334 -16.409 -7.196 1.00 0.00 C ATOM 547 CD1 TYR A 35 -2.679 -16.265 -6.833 1.00 0.00 C ATOM 548 CD2 TYR A 35 -0.323 -16.046 -6.292 1.00 0.00 C ATOM 549 CE1 TYR A 35 -3.026 -15.736 -5.582 1.00 0.00 C ATOM 550 CE2 TYR A 35 -0.662 -15.522 -5.032 1.00 0.00 C ATOM 551 CZ TYR A 35 -2.016 -15.356 -4.678 1.00 0.00 C ATOM 552 OH TYR A 35 -2.363 -14.828 -3.469 1.00 0.00 O ATOM 0 H TYR A 35 -1.248 -18.289 -10.593 1.00 0.00 H new ATOM 0 HA TYR A 35 0.339 -18.637 -8.283 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -0.130 -16.429 -8.958 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -1.826 -16.764 -9.242 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -3.455 -16.564 -7.522 1.00 0.00 H new ATOM 0 HD2 TYR A 35 0.715 -16.169 -6.564 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -4.065 -15.620 -5.312 1.00 0.00 H new ATOM 0 HE2 TYR A 35 0.116 -15.247 -4.335 1.00 0.00 H new ATOM 0 HH TYR A 35 -1.615 -14.925 -2.843 1.00 0.00 H new ATOM 562 N ALA A 36 -2.864 -19.434 -8.026 1.00 0.00 N ATOM 563 CA ALA A 36 -3.839 -20.100 -7.187 1.00 0.00 C ATOM 564 C ALA A 36 -3.510 -21.583 -7.006 1.00 0.00 C ATOM 565 O ALA A 36 -3.724 -22.124 -5.923 1.00 0.00 O ATOM 566 CB ALA A 36 -5.209 -19.934 -7.839 1.00 0.00 C ATOM 0 H ALA A 36 -3.209 -19.183 -8.952 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.828 -19.652 -6.194 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.965 -20.427 -7.228 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.446 -18.873 -7.924 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.196 -20.383 -8.832 1.00 0.00 H new ATOM 572 N LEU A 37 -2.996 -22.241 -8.048 1.00 0.00 N ATOM 573 CA LEU A 37 -2.654 -23.654 -7.975 1.00 0.00 C ATOM 574 C LEU A 37 -1.443 -23.878 -7.079 1.00 0.00 C ATOM 575 O LEU A 37 -1.362 -24.899 -6.400 1.00 0.00 O ATOM 576 CB LEU A 37 -2.354 -24.171 -9.386 1.00 0.00 C ATOM 577 CG LEU A 37 -3.546 -24.912 -10.007 1.00 0.00 C ATOM 578 CD1 LEU A 37 -3.835 -26.210 -9.244 1.00 0.00 C ATOM 579 CD2 LEU A 37 -4.807 -24.053 -10.015 1.00 0.00 C ATOM 0 H LEU A 37 -2.809 -21.811 -8.954 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.497 -24.197 -7.548 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.079 -23.332 -10.026 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.494 -24.840 -9.349 1.00 0.00 H new ATOM 0 HG LEU A 37 -3.272 -25.141 -11.037 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.684 -26.719 -9.701 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.959 -26.858 -9.283 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.068 -25.977 -8.205 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.627 -24.615 -10.463 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.069 -23.782 -8.992 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.627 -23.148 -10.596 1.00 0.00 H new ATOM 591 N ASP A 38 -0.505 -22.929 -7.078 1.00 0.00 N ATOM 592 CA ASP A 38 0.663 -22.998 -6.217 1.00 0.00 C ATOM 593 C ASP A 38 0.263 -22.815 -4.748 1.00 0.00 C ATOM 594 O ASP A 38 0.982 -23.263 -3.858 1.00 0.00 O ATOM 595 CB ASP A 38 1.647 -21.909 -6.657 1.00 0.00 C ATOM 596 CG ASP A 38 3.025 -22.045 -6.019 1.00 0.00 C ATOM 597 OD1 ASP A 38 3.731 -21.011 -5.983 1.00 0.00 O ATOM 598 OD2 ASP A 38 3.360 -23.167 -5.578 1.00 0.00 O1- ATOM 0 H ASP A 38 -0.538 -22.100 -7.671 1.00 0.00 H new ATOM 0 HA ASP A 38 1.134 -23.977 -6.304 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.752 -21.941 -7.741 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.233 -20.932 -6.406 1.00 0.00 H new ATOM 603 N HIS A 39 -0.877 -22.162 -4.487 1.00 0.00 N ATOM 604 CA HIS A 39 -1.295 -21.829 -3.133 1.00 0.00 C ATOM 605 C HIS A 39 -2.814 -21.738 -3.004 1.00 0.00 C ATOM 606 O HIS A 39 -3.425 -20.764 -3.441 1.00 0.00 O ATOM 607 CB HIS A 39 -0.652 -20.490 -2.764 1.00 0.00 C ATOM 608 CG HIS A 39 0.848 -20.542 -2.694 1.00 0.00 C ATOM 609 ND1 HIS A 39 1.592 -21.061 -1.632 1.00 0.00 N ATOM 610 CD2 HIS A 39 1.696 -20.093 -3.662 1.00 0.00 C ATOM 611 CE1 HIS A 39 2.877 -20.926 -2.003 1.00 0.00 C ATOM 612 NE2 HIS A 39 2.969 -20.357 -3.217 1.00 0.00 N ATOM 0 H HIS A 39 -1.528 -21.854 -5.210 1.00 0.00 H new ATOM 0 HA HIS A 39 -0.973 -22.620 -2.455 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -0.947 -19.740 -3.498 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -1.041 -20.163 -1.800 1.00 0.00 H new ATOM 0 HD2 HIS A 39 1.422 -19.623 -4.595 1.00 0.00 H new ATOM 0 HE1 HIS A 39 3.722 -21.234 -1.405 1.00 0.00 H new ATOM 0 HE2 HIS A 39 3.833 -20.156 -3.720 1.00 0.00 H new ATOM 620 N ILE A 40 -3.430 -22.762 -2.397 1.00 0.00 N ATOM 621 CA ILE A 40 -4.851 -22.756 -2.094 1.00 0.00 C ATOM 622 C ILE A 40 -5.118 -21.925 -0.843 1.00 0.00 C ATOM 623 O ILE A 40 -6.271 -21.621 -0.558 1.00 0.00 O ATOM 624 CB ILE A 40 -5.376 -24.183 -1.877 1.00 0.00 C ATOM 625 CG1 ILE A 40 -4.448 -25.052 -1.011 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.706 -24.845 -3.211 1.00 0.00 C ATOM 627 CD1 ILE A 40 -3.400 -25.842 -1.795 1.00 0.00 C ATOM 0 H ILE A 40 -2.949 -23.613 -2.106 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.372 -22.317 -2.945 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.299 -24.095 -1.304 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.938 -24.411 -0.292 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.057 -25.751 -0.438 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.076 -25.855 -3.034 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.470 -24.263 -3.727 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.808 -24.890 -3.827 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.792 -26.425 -1.104 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.898 -26.513 -2.495 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.762 -25.152 -2.347 1.00 0.00 H new ATOM 639 N ASP A 41 -4.072 -21.558 -0.098 1.00 0.00 N ATOM 640 CA ASP A 41 -4.197 -20.822 1.155 1.00 0.00 C ATOM 641 C ASP A 41 -4.895 -19.472 0.982 1.00 0.00 C ATOM 642 O ASP A 41 -5.268 -18.831 1.964 1.00 0.00 O ATOM 643 CB ASP A 41 -2.804 -20.598 1.744 1.00 0.00 C ATOM 644 CG ASP A 41 -2.010 -21.882 1.993 1.00 0.00 C ATOM 645 OD1 ASP A 41 -2.546 -22.973 1.699 1.00 0.00 O ATOM 646 OD2 ASP A 41 -0.868 -21.745 2.480 1.00 0.00 O1- ATOM 0 H ASP A 41 -3.107 -21.767 -0.353 1.00 0.00 H new ATOM 0 HA ASP A 41 -4.814 -21.421 1.825 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.236 -19.959 1.068 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.903 -20.058 2.686 1.00 0.00 H new ATOM 651 N ILE A 42 -5.067 -19.048 -0.270 1.00 0.00 N ATOM 652 CA ILE A 42 -5.750 -17.813 -0.626 1.00 0.00 C ATOM 653 C ILE A 42 -6.977 -18.078 -1.501 1.00 0.00 C ATOM 654 O ILE A 42 -7.472 -17.168 -2.160 1.00 0.00 O ATOM 655 CB ILE A 42 -4.777 -16.841 -1.294 1.00 0.00 C ATOM 656 CG1 ILE A 42 -4.063 -17.486 -2.489 1.00 0.00 C ATOM 657 CG2 ILE A 42 -3.827 -16.250 -0.251 1.00 0.00 C ATOM 658 CD1 ILE A 42 -2.608 -17.854 -2.207 1.00 0.00 C ATOM 0 H ILE A 42 -4.727 -19.567 -1.079 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.114 -17.350 0.291 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.337 -16.007 -1.717 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -4.605 -18.384 -2.784 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.098 -16.800 -3.336 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.138 -15.559 -0.737 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -4.403 -15.717 0.505 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.262 -17.053 0.223 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.168 -18.305 -3.096 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.050 -16.956 -1.942 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -2.566 -18.564 -1.381 1.00 0.00 H new ATOM 670 N GLU A 43 -7.486 -19.311 -1.527 1.00 0.00 N ATOM 671 CA GLU A 43 -8.679 -19.628 -2.306 1.00 0.00 C ATOM 672 C GLU A 43 -9.839 -18.696 -1.950 1.00 0.00 C ATOM 673 O GLU A 43 -10.697 -18.429 -2.791 1.00 0.00 O ATOM 674 CB GLU A 43 -9.054 -21.094 -2.073 1.00 0.00 C ATOM 675 CG GLU A 43 -9.339 -21.441 -0.609 1.00 0.00 C ATOM 676 CD GLU A 43 -10.702 -20.985 -0.107 1.00 0.00 C ATOM 677 OE1 GLU A 43 -11.620 -20.829 -0.943 1.00 0.00 O ATOM 678 OE2 GLU A 43 -10.797 -20.797 1.126 1.00 0.00 O1- ATOM 0 H GLU A 43 -7.091 -20.102 -1.019 1.00 0.00 H new ATOM 0 HA GLU A 43 -8.465 -19.477 -3.364 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -9.935 -21.332 -2.670 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.244 -21.727 -2.434 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -9.262 -22.521 -0.483 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -8.567 -20.991 0.015 1.00 0.00 H new ATOM 685 N SER A 44 -9.866 -18.201 -0.708 1.00 0.00 N ATOM 686 CA SER A 44 -10.946 -17.341 -0.245 1.00 0.00 C ATOM 687 C SER A 44 -10.976 -16.006 -0.997 1.00 0.00 C ATOM 688 O SER A 44 -12.049 -15.552 -1.392 1.00 0.00 O ATOM 689 CB SER A 44 -10.795 -17.132 1.263 1.00 0.00 C ATOM 690 OG SER A 44 -11.831 -16.305 1.749 1.00 0.00 O ATOM 0 H SER A 44 -9.147 -18.385 -0.008 1.00 0.00 H new ATOM 0 HA SER A 44 -11.900 -17.826 -0.451 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.818 -18.094 1.775 1.00 0.00 H new ATOM 0 HB3 SER A 44 -9.827 -16.679 1.479 1.00 0.00 H new ATOM 0 HG SER A 44 -11.724 -16.180 2.715 1.00 0.00 H new ATOM 696 N LYS A 45 -9.818 -15.365 -1.203 1.00 0.00 N ATOM 697 CA LYS A 45 -9.782 -14.100 -1.932 1.00 0.00 C ATOM 698 C LYS A 45 -9.971 -14.358 -3.428 1.00 0.00 C ATOM 699 O LYS A 45 -10.436 -13.481 -4.151 1.00 0.00 O ATOM 700 CB LYS A 45 -8.466 -13.345 -1.669 1.00 0.00 C ATOM 701 CG LYS A 45 -7.257 -14.171 -2.108 1.00 0.00 C ATOM 702 CD LYS A 45 -5.924 -13.413 -2.120 1.00 0.00 C ATOM 703 CE LYS A 45 -5.586 -12.828 -0.752 1.00 0.00 C ATOM 704 NZ LYS A 45 -4.134 -12.608 -0.592 1.00 0.00 N1+ ATOM 0 H LYS A 45 -8.910 -15.698 -0.879 1.00 0.00 H new ATOM 0 HA LYS A 45 -10.598 -13.471 -1.576 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.475 -12.396 -2.205 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.384 -13.111 -0.608 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.163 -15.031 -1.444 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.446 -14.560 -3.109 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.127 -14.087 -2.433 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -5.970 -12.610 -2.856 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.113 -11.883 -0.621 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.940 -13.502 0.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -3.750 -13.300 0.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -3.662 -12.723 -1.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -3.966 -11.646 -0.235 1.00 0.00 H new ATOM 718 N ILE A 46 -9.611 -15.562 -3.888 1.00 0.00 N ATOM 719 CA ILE A 46 -9.684 -15.929 -5.293 1.00 0.00 C ATOM 720 C ILE A 46 -11.135 -16.128 -5.713 1.00 0.00 C ATOM 721 O ILE A 46 -11.572 -15.546 -6.704 1.00 0.00 O ATOM 722 CB ILE A 46 -8.867 -17.207 -5.508 1.00 0.00 C ATOM 723 CG1 ILE A 46 -7.383 -16.865 -5.372 1.00 0.00 C ATOM 724 CG2 ILE A 46 -9.149 -17.819 -6.881 1.00 0.00 C ATOM 725 CD1 ILE A 46 -6.523 -18.111 -5.175 1.00 0.00 C ATOM 0 H ILE A 46 -9.260 -16.308 -3.287 1.00 0.00 H new ATOM 0 HA ILE A 46 -9.271 -15.131 -5.910 1.00 0.00 H new ATOM 0 HB ILE A 46 -9.151 -17.945 -4.758 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.051 -16.333 -6.263 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.243 -16.191 -4.527 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.555 -18.724 -7.005 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.208 -18.066 -6.959 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -8.886 -17.103 -7.660 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.477 -17.820 -5.083 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -6.836 -18.630 -4.269 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.641 -18.774 -6.032 1.00 0.00 H new ATOM 737 N ILE A 47 -11.880 -16.948 -4.962 1.00 0.00 N ATOM 738 CA ILE A 47 -13.278 -17.218 -5.270 1.00 0.00 C ATOM 739 C ILE A 47 -14.112 -15.958 -5.069 1.00 0.00 C ATOM 740 O ILE A 47 -15.009 -15.682 -5.865 1.00 0.00 O ATOM 741 CB ILE A 47 -13.791 -18.357 -4.378 1.00 0.00 C ATOM 742 CG1 ILE A 47 -13.075 -19.680 -4.685 1.00 0.00 C ATOM 743 CG2 ILE A 47 -15.302 -18.524 -4.541 1.00 0.00 C ATOM 744 CD1 ILE A 47 -13.291 -20.186 -6.112 1.00 0.00 C ATOM 0 H ILE A 47 -11.531 -17.434 -4.136 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.366 -17.522 -6.313 1.00 0.00 H new ATOM 0 HB ILE A 47 -13.572 -18.090 -3.344 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -12.006 -19.551 -4.514 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -13.421 -20.440 -3.984 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -15.649 -19.336 -3.902 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -15.803 -17.599 -4.257 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.532 -18.757 -5.581 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -12.754 -21.124 -6.251 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.355 -20.349 -6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -12.918 -19.446 -6.821 1.00 0.00 H new ATOM 756 N SER A 48 -13.823 -15.191 -4.013 1.00 0.00 N ATOM 757 CA SER A 48 -14.588 -13.987 -3.738 1.00 0.00 C ATOM 758 C SER A 48 -14.366 -12.934 -4.818 1.00 0.00 C ATOM 759 O SER A 48 -15.284 -12.179 -5.130 1.00 0.00 O ATOM 760 CB SER A 48 -14.179 -13.440 -2.373 1.00 0.00 C ATOM 761 OG SER A 48 -14.907 -12.268 -2.091 1.00 0.00 O ATOM 0 H SER A 48 -13.075 -15.384 -3.348 1.00 0.00 H new ATOM 0 HA SER A 48 -15.649 -14.236 -3.734 1.00 0.00 H new ATOM 0 HB2 SER A 48 -14.363 -14.188 -1.601 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.110 -13.227 -2.362 1.00 0.00 H new ATOM 0 HG SER A 48 -14.642 -11.922 -1.213 1.00 0.00 H new ATOM 767 N LEU A 49 -13.161 -12.866 -5.396 1.00 0.00 N ATOM 768 CA LEU A 49 -12.862 -11.854 -6.392 1.00 0.00 C ATOM 769 C LEU A 49 -13.427 -12.196 -7.770 1.00 0.00 C ATOM 770 O LEU A 49 -13.884 -11.298 -8.475 1.00 0.00 O ATOM 771 CB LEU A 49 -11.353 -11.632 -6.425 1.00 0.00 C ATOM 772 CG LEU A 49 -10.953 -10.535 -7.410 1.00 0.00 C ATOM 773 CD1 LEU A 49 -11.659 -9.211 -7.108 1.00 0.00 C ATOM 774 CD2 LEU A 49 -9.450 -10.299 -7.321 1.00 0.00 C ATOM 0 H LEU A 49 -12.389 -13.499 -5.187 1.00 0.00 H new ATOM 0 HA LEU A 49 -13.357 -10.925 -6.108 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -11.005 -11.367 -5.427 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -10.856 -12.563 -6.699 1.00 0.00 H new ATOM 0 HG LEU A 49 -11.244 -10.869 -8.406 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.346 -8.458 -7.832 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -12.738 -9.351 -7.173 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -11.396 -8.879 -6.103 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -9.162 -9.516 -8.023 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.189 -9.992 -6.308 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -8.922 -11.220 -7.568 1.00 0.00 H new ATOM 786 N ILE A 50 -13.412 -13.472 -8.178 1.00 0.00 N ATOM 787 CA ILE A 50 -13.966 -13.830 -9.479 1.00 0.00 C ATOM 788 C ILE A 50 -15.474 -13.624 -9.482 1.00 0.00 C ATOM 789 O ILE A 50 -16.001 -13.079 -10.450 1.00 0.00 O ATOM 790 CB ILE A 50 -13.651 -15.277 -9.879 1.00 0.00 C ATOM 791 CG1 ILE A 50 -14.055 -16.260 -8.777 1.00 0.00 C ATOM 792 CG2 ILE A 50 -12.188 -15.427 -10.286 1.00 0.00 C ATOM 793 CD1 ILE A 50 -13.462 -17.651 -8.982 1.00 0.00 C ATOM 0 H ILE A 50 -13.032 -14.250 -7.639 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.494 -13.175 -10.211 1.00 0.00 H new ATOM 0 HB ILE A 50 -14.251 -15.526 -10.754 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.732 -15.870 -7.812 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -15.142 -16.334 -8.743 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -11.992 -16.462 -10.565 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -11.978 -14.777 -11.135 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -11.547 -15.149 -9.449 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.782 -18.306 -8.171 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -13.806 -18.057 -9.933 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -12.374 -17.585 -8.988 1.00 0.00 H new ATOM 805 N ILE A 51 -16.177 -14.044 -8.422 1.00 0.00 N ATOM 806 CA ILE A 51 -17.620 -13.838 -8.380 1.00 0.00 C ATOM 807 C ILE A 51 -17.972 -12.350 -8.319 1.00 0.00 C ATOM 808 O ILE A 51 -18.944 -11.932 -8.947 1.00 0.00 O ATOM 809 CB ILE A 51 -18.253 -14.616 -7.218 1.00 0.00 C ATOM 810 CG1 ILE A 51 -17.811 -14.023 -5.874 1.00 0.00 C ATOM 811 CG2 ILE A 51 -17.915 -16.106 -7.351 1.00 0.00 C ATOM 812 CD1 ILE A 51 -18.344 -14.813 -4.682 1.00 0.00 C ATOM 0 H ILE A 51 -15.780 -14.514 -7.608 1.00 0.00 H new ATOM 0 HA ILE A 51 -18.039 -14.229 -9.307 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.338 -14.524 -7.256 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -16.722 -13.999 -5.832 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -18.156 -12.991 -5.805 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -18.365 -16.656 -6.525 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.306 -16.485 -8.295 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -16.833 -16.237 -7.327 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.001 -14.350 -3.756 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -19.434 -14.815 -4.705 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.978 -15.838 -4.732 1.00 0.00 H new ATOM 824 N ASP A 52 -17.201 -11.542 -7.584 1.00 0.00 N ATOM 825 CA ASP A 52 -17.456 -10.107 -7.533 1.00 0.00 C ATOM 826 C ASP A 52 -17.332 -9.499 -8.929 1.00 0.00 C ATOM 827 O ASP A 52 -18.246 -8.828 -9.404 1.00 0.00 O ATOM 828 CB ASP A 52 -16.470 -9.442 -6.571 1.00 0.00 C ATOM 829 CG ASP A 52 -16.838 -7.990 -6.282 1.00 0.00 C ATOM 830 OD1 ASP A 52 -18.004 -7.625 -6.551 1.00 0.00 O ATOM 831 OD2 ASP A 52 -15.939 -7.270 -5.795 1.00 0.00 O1- ATOM 0 H ASP A 52 -16.407 -11.855 -7.025 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.471 -9.937 -7.173 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.444 -10.002 -5.636 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -15.467 -9.483 -6.995 1.00 0.00 H new ATOM 836 N TYR A 53 -16.197 -9.733 -9.597 1.00 0.00 N ATOM 837 CA TYR A 53 -15.982 -9.216 -10.941 1.00 0.00 C ATOM 838 C TYR A 53 -17.029 -9.784 -11.886 1.00 0.00 C ATOM 839 O TYR A 53 -17.413 -9.096 -12.824 1.00 0.00 O ATOM 840 CB TYR A 53 -14.548 -9.546 -11.370 1.00 0.00 C ATOM 841 CG TYR A 53 -14.241 -9.652 -12.855 1.00 0.00 C ATOM 842 CD1 TYR A 53 -13.855 -8.531 -13.614 1.00 0.00 C ATOM 843 CD2 TYR A 53 -14.328 -10.910 -13.472 1.00 0.00 C ATOM 844 CE1 TYR A 53 -13.486 -8.677 -14.963 1.00 0.00 C ATOM 845 CE2 TYR A 53 -13.986 -11.060 -14.824 1.00 0.00 C ATOM 846 CZ TYR A 53 -13.548 -9.949 -15.569 1.00 0.00 C ATOM 847 OH TYR A 53 -13.185 -10.107 -16.874 1.00 0.00 O ATOM 0 H TYR A 53 -15.418 -10.277 -9.225 1.00 0.00 H new ATOM 0 HA TYR A 53 -16.096 -8.132 -10.966 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -13.893 -8.783 -10.950 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -14.273 -10.493 -10.906 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -13.842 -7.552 -13.157 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -14.660 -11.766 -12.903 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -13.157 -7.820 -15.532 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -14.059 -12.030 -15.294 1.00 0.00 H new ATOM 0 HH TYR A 53 -13.895 -10.581 -17.356 1.00 0.00 H new ATOM 857 N SER A 54 -17.493 -11.017 -11.663 1.00 0.00 N ATOM 858 CA SER A 54 -18.494 -11.613 -12.536 1.00 0.00 C ATOM 859 C SER A 54 -19.798 -10.826 -12.483 1.00 0.00 C ATOM 860 O SER A 54 -20.479 -10.696 -13.498 1.00 0.00 O ATOM 861 CB SER A 54 -18.766 -13.062 -12.123 1.00 0.00 C ATOM 862 OG SER A 54 -19.664 -13.108 -11.036 1.00 0.00 O ATOM 0 H SER A 54 -17.192 -11.613 -10.892 1.00 0.00 H new ATOM 0 HA SER A 54 -18.105 -11.590 -13.554 1.00 0.00 H new ATOM 0 HB2 SER A 54 -19.179 -13.615 -12.967 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.830 -13.550 -11.850 1.00 0.00 H new ATOM 0 HG SER A 54 -19.290 -12.607 -10.281 1.00 0.00 H new ATOM 868 N ARG A 55 -20.151 -10.299 -11.304 1.00 0.00 N ATOM 869 CA ARG A 55 -21.399 -9.573 -11.123 1.00 0.00 C ATOM 870 C ARG A 55 -21.286 -8.145 -11.644 1.00 0.00 C ATOM 871 O ARG A 55 -22.225 -7.629 -12.249 1.00 0.00 O ATOM 872 CB ARG A 55 -21.743 -9.584 -9.630 1.00 0.00 C ATOM 873 CG ARG A 55 -23.236 -9.344 -9.377 1.00 0.00 C ATOM 874 CD ARG A 55 -24.093 -10.519 -9.857 1.00 0.00 C ATOM 875 NE ARG A 55 -23.690 -11.770 -9.202 1.00 0.00 N ATOM 876 CZ ARG A 55 -24.507 -12.602 -8.545 1.00 0.00 C ATOM 877 NH1 ARG A 55 -25.814 -12.371 -8.443 1.00 0.00 N1+ ATOM 878 NH2 ARG A 55 -24.022 -13.699 -7.968 1.00 0.00 N ATOM 0 H ARG A 55 -19.581 -10.366 -10.461 1.00 0.00 H new ATOM 0 HA ARG A 55 -22.192 -10.056 -11.693 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.453 -10.542 -9.199 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -21.162 -8.816 -9.119 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -23.403 -9.185 -8.312 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -23.549 -8.434 -9.888 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -25.143 -10.317 -9.647 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -23.999 -10.624 -10.938 1.00 0.00 H new ATOM 0 HE ARG A 55 -22.704 -12.027 -9.252 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -26.220 -11.540 -8.873 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -26.409 -13.025 -7.935 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -23.025 -13.907 -8.026 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -24.647 -14.331 -7.468 1.00 0.00 H new ATOM 892 N LEU A 56 -20.131 -7.512 -11.403 1.00 0.00 N ATOM 893 CA LEU A 56 -19.879 -6.125 -11.762 1.00 0.00 C ATOM 894 C LEU A 56 -19.574 -5.934 -13.244 1.00 0.00 C ATOM 895 O LEU A 56 -20.107 -5.022 -13.874 1.00 0.00 O ATOM 896 CB LEU A 56 -18.659 -5.644 -10.977 1.00 0.00 C ATOM 897 CG LEU A 56 -18.883 -5.639 -9.465 1.00 0.00 C ATOM 898 CD1 LEU A 56 -17.520 -5.410 -8.823 1.00 0.00 C ATOM 899 CD2 LEU A 56 -19.851 -4.531 -9.067 1.00 0.00 C ATOM 0 H LEU A 56 -19.338 -7.962 -10.946 1.00 0.00 H new ATOM 0 HA LEU A 56 -20.783 -5.562 -11.530 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -17.809 -6.285 -11.210 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -18.398 -4.637 -11.303 1.00 0.00 H new ATOM 0 HG LEU A 56 -19.320 -6.581 -9.134 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.626 -5.398 -7.738 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -16.842 -6.213 -9.112 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.116 -4.455 -9.159 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -19.996 -4.545 -7.987 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -19.442 -3.566 -9.365 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -20.808 -4.688 -9.564 1.00 0.00 H new ATOM 911 N CYS A 57 -18.715 -6.796 -13.789 1.00 0.00 N ATOM 912 CA CYS A 57 -18.191 -6.636 -15.138 1.00 0.00 C ATOM 913 C CYS A 57 -19.258 -6.735 -16.234 1.00 0.00 C ATOM 914 O CYS A 57 -20.337 -7.286 -16.013 1.00 0.00 O ATOM 915 CB CYS A 57 -17.092 -7.672 -15.374 1.00 0.00 C ATOM 916 SG CYS A 57 -17.843 -9.295 -15.668 1.00 0.00 S ATOM 0 H CYS A 57 -18.366 -7.623 -13.305 1.00 0.00 H new ATOM 0 HA CYS A 57 -17.791 -5.624 -15.206 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -16.482 -7.382 -16.229 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -16.429 -7.718 -14.510 1.00 0.00 H new ATOM 0 HG CYS A 57 -18.175 -9.832 -14.532 1.00 0.00 H new ATOM 922 N PRO A 58 -18.948 -6.194 -17.422 1.00 0.00 N ATOM 923 CA PRO A 58 -19.764 -6.292 -18.622 1.00 0.00 C ATOM 924 C PRO A 58 -20.027 -7.733 -19.042 1.00 0.00 C ATOM 925 O PRO A 58 -19.511 -8.675 -18.447 1.00 0.00 O ATOM 926 CB PRO A 58 -18.982 -5.573 -19.721 1.00 0.00 C ATOM 927 CG PRO A 58 -18.035 -4.650 -18.964 1.00 0.00 C ATOM 928 CD PRO A 58 -17.755 -5.414 -17.674 1.00 0.00 C ATOM 0 HA PRO A 58 -20.743 -5.849 -18.438 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -18.435 -6.278 -20.347 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -19.645 -5.011 -20.379 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.121 -4.463 -19.527 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.492 -3.680 -18.766 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -16.881 -6.056 -17.780 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -17.551 -4.731 -16.849 1.00 0.00 H new ATOM 936 N ASP A 59 -20.845 -7.887 -20.084 1.00 0.00 N ATOM 937 CA ASP A 59 -21.305 -9.180 -20.572 1.00 0.00 C ATOM 938 C ASP A 59 -20.154 -10.044 -21.091 1.00 0.00 C ATOM 939 O ASP A 59 -20.104 -11.244 -20.829 1.00 0.00 O ATOM 940 CB ASP A 59 -22.326 -8.966 -21.697 1.00 0.00 C ATOM 941 CG ASP A 59 -21.784 -8.196 -22.909 1.00 0.00 C ATOM 942 OD1 ASP A 59 -20.745 -7.513 -22.771 1.00 0.00 O ATOM 943 OD2 ASP A 59 -22.428 -8.302 -23.977 1.00 0.00 O1- ATOM 0 H ASP A 59 -21.211 -7.100 -20.620 1.00 0.00 H new ATOM 0 HA ASP A 59 -21.763 -9.706 -19.734 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -22.688 -9.938 -22.032 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -23.184 -8.428 -21.294 1.00 0.00 H new ATOM 948 N SER A 60 -19.228 -9.430 -21.828 1.00 0.00 N ATOM 949 CA SER A 60 -18.102 -10.132 -22.417 1.00 0.00 C ATOM 950 C SER A 60 -17.102 -10.513 -21.335 1.00 0.00 C ATOM 951 O SER A 60 -16.477 -11.567 -21.400 1.00 0.00 O ATOM 952 CB SER A 60 -17.459 -9.225 -23.466 1.00 0.00 C ATOM 953 OG SER A 60 -18.439 -8.802 -24.392 1.00 0.00 O ATOM 0 H SER A 60 -19.243 -8.430 -22.030 1.00 0.00 H new ATOM 0 HA SER A 60 -18.438 -11.052 -22.896 1.00 0.00 H new ATOM 0 HB2 SER A 60 -17.003 -8.361 -22.983 1.00 0.00 H new ATOM 0 HB3 SER A 60 -16.662 -9.759 -23.983 1.00 0.00 H new ATOM 0 HG SER A 60 -18.025 -8.219 -25.063 1.00 0.00 H new ATOM 959 N HIS A 61 -16.952 -9.648 -20.332 1.00 0.00 N ATOM 960 CA HIS A 61 -16.070 -9.895 -19.205 1.00 0.00 C ATOM 961 C HIS A 61 -16.695 -10.917 -18.259 1.00 0.00 C ATOM 962 O HIS A 61 -15.984 -11.583 -17.513 1.00 0.00 O ATOM 963 CB HIS A 61 -15.798 -8.558 -18.515 1.00 0.00 C ATOM 964 CG HIS A 61 -15.212 -7.543 -19.460 1.00 0.00 C ATOM 965 ND1 HIS A 61 -15.921 -6.857 -20.447 1.00 0.00 N ATOM 966 CD2 HIS A 61 -13.906 -7.155 -19.488 1.00 0.00 C ATOM 967 CE1 HIS A 61 -15.016 -6.068 -21.044 1.00 0.00 C ATOM 968 NE2 HIS A 61 -13.799 -6.226 -20.495 1.00 0.00 N ATOM 0 H HIS A 61 -17.443 -8.755 -20.284 1.00 0.00 H new ATOM 0 HA HIS A 61 -15.123 -10.319 -19.538 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -16.727 -8.170 -18.097 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -15.114 -8.713 -17.681 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -13.112 -7.508 -18.846 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -15.236 -5.394 -21.859 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -12.947 -5.742 -20.776 1.00 0.00 H new ATOM 976 N LYS A 62 -18.027 -11.042 -18.291 1.00 0.00 N ATOM 977 CA LYS A 62 -18.743 -12.055 -17.530 1.00 0.00 C ATOM 978 C LYS A 62 -18.497 -13.428 -18.158 1.00 0.00 C ATOM 979 O LYS A 62 -18.401 -14.428 -17.447 1.00 0.00 O ATOM 980 CB LYS A 62 -20.228 -11.681 -17.523 1.00 0.00 C ATOM 981 CG LYS A 62 -21.039 -12.490 -16.508 1.00 0.00 C ATOM 982 CD LYS A 62 -22.522 -12.124 -16.633 1.00 0.00 C ATOM 983 CE LYS A 62 -22.793 -10.642 -16.361 1.00 0.00 C ATOM 984 NZ LYS A 62 -22.691 -10.314 -14.927 1.00 0.00 N1+ ATOM 0 H LYS A 62 -18.633 -10.440 -18.848 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.391 -12.102 -16.499 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -20.329 -10.619 -17.299 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.642 -11.837 -18.519 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -20.900 -13.557 -16.683 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -20.686 -12.284 -15.497 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -22.870 -12.374 -17.635 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -23.101 -12.729 -15.935 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -22.083 -10.035 -16.923 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -23.789 -10.384 -16.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -22.964 -9.322 -14.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -23.325 -10.933 -14.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -21.711 -10.455 -14.607 1.00 0.00 H new ATOM 998 N LEU A 63 -18.390 -13.479 -19.493 1.00 0.00 N ATOM 999 CA LEU A 63 -17.990 -14.691 -20.192 1.00 0.00 C ATOM 1000 C LEU A 63 -16.566 -15.026 -19.737 1.00 0.00 C ATOM 1001 O LEU A 63 -16.242 -16.175 -19.444 1.00 0.00 O ATOM 1002 CB LEU A 63 -18.029 -14.422 -21.700 1.00 0.00 C ATOM 1003 CG LEU A 63 -18.201 -15.691 -22.546 1.00 0.00 C ATOM 1004 CD1 LEU A 63 -17.847 -15.345 -23.991 1.00 0.00 C ATOM 1005 CD2 LEU A 63 -17.296 -16.840 -22.116 1.00 0.00 C ATOM 0 H LEU A 63 -18.578 -12.686 -20.106 1.00 0.00 H new ATOM 0 HA LEU A 63 -18.655 -15.526 -19.973 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -18.848 -13.737 -21.917 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -17.107 -13.921 -21.995 1.00 0.00 H new ATOM 0 HG LEU A 63 -19.233 -16.021 -22.422 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -17.961 -16.231 -24.616 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -18.512 -14.560 -24.350 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -16.815 -14.997 -24.040 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -17.473 -17.703 -22.759 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -16.253 -16.533 -22.200 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -17.514 -17.107 -21.082 1.00 0.00 H new ATOM 1017 N GLY A 64 -15.713 -13.998 -19.679 1.00 0.00 N ATOM 1018 CA GLY A 64 -14.329 -14.155 -19.266 1.00 0.00 C ATOM 1019 C GLY A 64 -14.227 -14.576 -17.803 1.00 0.00 C ATOM 1020 O GLY A 64 -13.277 -15.260 -17.425 1.00 0.00 O ATOM 0 H GLY A 64 -15.969 -13.040 -19.918 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.843 -14.901 -19.895 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.795 -13.216 -19.414 1.00 0.00 H new ATOM 1024 N SER A 65 -15.197 -14.174 -16.977 1.00 0.00 N ATOM 1025 CA SER A 65 -15.220 -14.583 -15.584 1.00 0.00 C ATOM 1026 C SER A 65 -15.437 -16.087 -15.501 1.00 0.00 C ATOM 1027 O SER A 65 -14.798 -16.757 -14.692 1.00 0.00 O ATOM 1028 CB SER A 65 -16.325 -13.841 -14.838 1.00 0.00 C ATOM 1029 OG SER A 65 -16.399 -14.320 -13.517 1.00 0.00 O ATOM 0 H SER A 65 -15.970 -13.569 -17.254 1.00 0.00 H new ATOM 0 HA SER A 65 -14.266 -14.336 -15.118 1.00 0.00 H new ATOM 0 HB2 SER A 65 -16.123 -12.770 -14.838 1.00 0.00 H new ATOM 0 HB3 SER A 65 -17.280 -13.985 -15.343 1.00 0.00 H new ATOM 0 HG SER A 65 -17.138 -14.959 -13.442 1.00 0.00 H new ATOM 1035 N LEU A 66 -16.334 -16.618 -16.337 1.00 0.00 N ATOM 1036 CA LEU A 66 -16.592 -18.048 -16.371 1.00 0.00 C ATOM 1037 C LEU A 66 -15.375 -18.798 -16.911 1.00 0.00 C ATOM 1038 O LEU A 66 -15.174 -19.959 -16.567 1.00 0.00 O ATOM 1039 CB LEU A 66 -17.837 -18.316 -17.220 1.00 0.00 C ATOM 1040 CG LEU A 66 -19.088 -17.680 -16.606 1.00 0.00 C ATOM 1041 CD1 LEU A 66 -20.229 -17.758 -17.614 1.00 0.00 C ATOM 1042 CD2 LEU A 66 -19.527 -18.407 -15.334 1.00 0.00 C ATOM 0 H LEU A 66 -16.890 -16.074 -16.996 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.775 -18.411 -15.360 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.684 -17.922 -18.225 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.986 -19.391 -17.318 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.848 -16.647 -16.353 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -21.124 -17.307 -17.186 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.951 -17.221 -18.521 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -20.429 -18.802 -17.857 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -20.417 -17.926 -14.929 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.752 -19.447 -15.569 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.725 -18.367 -14.597 1.00 0.00 H new ATOM 1054 N TYR A 67 -14.559 -18.149 -17.752 1.00 0.00 N ATOM 1055 CA TYR A 67 -13.318 -18.753 -18.226 1.00 0.00 C ATOM 1056 C TYR A 67 -12.298 -18.847 -17.097 1.00 0.00 C ATOM 1057 O TYR A 67 -11.562 -19.830 -17.007 1.00 0.00 O ATOM 1058 CB TYR A 67 -12.735 -17.912 -19.360 1.00 0.00 C ATOM 1059 CG TYR A 67 -13.101 -18.399 -20.737 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -12.101 -18.514 -21.708 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -14.425 -18.742 -21.040 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -12.410 -18.999 -22.986 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -14.744 -19.241 -22.312 1.00 0.00 C ATOM 1064 CZ TYR A 67 -13.737 -19.367 -23.294 1.00 0.00 C ATOM 1065 OH TYR A 67 -14.044 -19.840 -24.536 1.00 0.00 O ATOM 0 H TYR A 67 -14.739 -17.212 -18.113 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.541 -19.758 -18.585 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -13.076 -16.883 -19.247 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.649 -17.899 -19.267 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -11.087 -18.228 -21.472 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -15.199 -18.623 -20.296 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -11.635 -19.091 -23.733 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -15.760 -19.529 -22.540 1.00 0.00 H new ATOM 0 HH TYR A 67 -14.257 -20.795 -24.479 1.00 0.00 H new ATOM 1075 N ILE A 68 -12.244 -17.834 -16.231 1.00 0.00 N ATOM 1076 CA ILE A 68 -11.325 -17.869 -15.110 1.00 0.00 C ATOM 1077 C ILE A 68 -11.791 -18.920 -14.111 1.00 0.00 C ATOM 1078 O ILE A 68 -11.026 -19.808 -13.746 1.00 0.00 O ATOM 1079 CB ILE A 68 -11.243 -16.484 -14.462 1.00 0.00 C ATOM 1080 CG1 ILE A 68 -10.572 -15.493 -15.414 1.00 0.00 C ATOM 1081 CG2 ILE A 68 -10.433 -16.550 -13.167 1.00 0.00 C ATOM 1082 CD1 ILE A 68 -11.153 -14.094 -15.240 1.00 0.00 C ATOM 0 H ILE A 68 -12.820 -16.994 -16.288 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.326 -18.138 -15.455 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.258 -16.152 -14.242 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.499 -15.471 -15.226 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.709 -15.822 -16.444 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -10.383 -15.558 -12.718 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -10.913 -17.239 -12.472 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.424 -16.900 -13.386 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -10.660 -13.407 -15.928 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.222 -14.115 -15.452 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -10.993 -13.759 -14.215 1.00 0.00 H new ATOM 1094 N ILE A 69 -13.054 -18.804 -13.680 1.00 0.00 N ATOM 1095 CA ILE A 69 -13.720 -19.780 -12.828 1.00 0.00 C ATOM 1096 C ILE A 69 -13.529 -21.203 -13.352 1.00 0.00 C ATOM 1097 O ILE A 69 -13.374 -22.122 -12.555 1.00 0.00 O ATOM 1098 CB ILE A 69 -15.218 -19.443 -12.766 1.00 0.00 C ATOM 1099 CG1 ILE A 69 -15.448 -18.155 -11.969 1.00 0.00 C ATOM 1100 CG2 ILE A 69 -15.999 -20.583 -12.102 1.00 0.00 C ATOM 1101 CD1 ILE A 69 -16.836 -17.572 -12.235 1.00 0.00 C ATOM 0 H ILE A 69 -13.648 -18.011 -13.922 1.00 0.00 H new ATOM 0 HA ILE A 69 -13.279 -19.733 -11.832 1.00 0.00 H new ATOM 0 HB ILE A 69 -15.571 -19.306 -13.788 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -15.336 -18.360 -10.904 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -14.687 -17.421 -12.234 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -17.058 -20.327 -12.067 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -15.866 -21.499 -12.678 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -15.629 -20.735 -11.088 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -16.965 -16.659 -11.653 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -16.938 -17.344 -13.296 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -17.597 -18.297 -11.946 1.00 0.00 H new ATOM 1113 N ASP A 70 -13.537 -21.412 -14.672 1.00 0.00 N ATOM 1114 CA ASP A 70 -13.345 -22.751 -15.210 1.00 0.00 C ATOM 1115 C ASP A 70 -11.920 -23.228 -14.982 1.00 0.00 C ATOM 1116 O ASP A 70 -11.703 -24.373 -14.589 1.00 0.00 O ATOM 1117 CB ASP A 70 -13.612 -22.763 -16.717 1.00 0.00 C ATOM 1118 CG ASP A 70 -13.260 -24.122 -17.313 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -12.279 -24.187 -18.089 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -13.981 -25.086 -16.982 1.00 0.00 O1- ATOM 0 H ASP A 70 -13.672 -20.682 -15.372 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.043 -23.412 -14.696 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.661 -22.537 -16.908 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.024 -21.984 -17.202 1.00 0.00 H new ATOM 1125 N SER A 71 -10.955 -22.342 -15.232 1.00 0.00 N ATOM 1126 CA SER A 71 -9.552 -22.697 -15.170 1.00 0.00 C ATOM 1127 C SER A 71 -9.159 -23.019 -13.736 1.00 0.00 C ATOM 1128 O SER A 71 -8.652 -24.108 -13.459 1.00 0.00 O ATOM 1129 CB SER A 71 -8.720 -21.535 -15.709 1.00 0.00 C ATOM 1130 OG SER A 71 -9.147 -21.195 -17.011 1.00 0.00 O ATOM 0 H SER A 71 -11.130 -21.368 -15.480 1.00 0.00 H new ATOM 0 HA SER A 71 -9.368 -23.582 -15.779 1.00 0.00 H new ATOM 0 HB2 SER A 71 -8.816 -20.672 -15.050 1.00 0.00 H new ATOM 0 HB3 SER A 71 -7.665 -21.809 -15.724 1.00 0.00 H new ATOM 0 HG SER A 71 -9.985 -20.690 -16.959 1.00 0.00 H new ATOM 1136 N ILE A 72 -9.395 -22.074 -12.822 1.00 0.00 N ATOM 1137 CA ILE A 72 -9.008 -22.230 -11.432 1.00 0.00 C ATOM 1138 C ILE A 72 -9.953 -23.202 -10.735 1.00 0.00 C ATOM 1139 O ILE A 72 -9.535 -23.934 -9.840 1.00 0.00 O ATOM 1140 CB ILE A 72 -8.978 -20.841 -10.777 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -8.149 -20.808 -9.484 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -10.380 -20.271 -10.539 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -8.924 -21.196 -8.220 1.00 0.00 C ATOM 0 H ILE A 72 -9.857 -21.189 -13.030 1.00 0.00 H new ATOM 0 HA ILE A 72 -8.010 -22.661 -11.347 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.478 -20.195 -11.499 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.300 -21.482 -9.595 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.744 -19.804 -9.353 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -10.299 -19.288 -10.074 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -10.902 -20.180 -11.491 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -10.937 -20.938 -9.882 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -8.261 -21.145 -7.357 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -9.757 -20.508 -8.079 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -9.306 -22.212 -8.325 1.00 0.00 H new ATOM 1155 N GLY A 73 -11.228 -23.217 -11.143 1.00 0.00 N ATOM 1156 CA GLY A 73 -12.234 -24.029 -10.487 1.00 0.00 C ATOM 1157 C GLY A 73 -11.948 -25.512 -10.659 1.00 0.00 C ATOM 1158 O GLY A 73 -11.794 -26.230 -9.669 1.00 0.00 O ATOM 0 H GLY A 73 -11.578 -22.670 -11.929 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.266 -23.784 -9.425 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.216 -23.796 -10.898 1.00 0.00 H new ATOM 1162 N ARG A 74 -11.872 -25.985 -11.909 1.00 0.00 N ATOM 1163 CA ARG A 74 -11.623 -27.400 -12.143 1.00 0.00 C ATOM 1164 C ARG A 74 -10.203 -27.766 -11.739 1.00 0.00 C ATOM 1165 O ARG A 74 -9.992 -28.861 -11.225 1.00 0.00 O ATOM 1166 CB ARG A 74 -11.867 -27.758 -13.609 1.00 0.00 C ATOM 1167 CG ARG A 74 -13.365 -27.745 -13.905 1.00 0.00 C ATOM 1168 CD ARG A 74 -13.626 -28.349 -15.283 1.00 0.00 C ATOM 1169 NE ARG A 74 -13.073 -27.496 -16.339 1.00 0.00 N ATOM 1170 CZ ARG A 74 -12.042 -27.807 -17.130 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -11.450 -28.999 -17.058 1.00 0.00 N1+ ATOM 1172 NH2 ARG A 74 -11.598 -26.903 -18.008 1.00 0.00 N ATOM 0 H ARG A 74 -11.977 -25.419 -12.751 1.00 0.00 H new ATOM 0 HA ARG A 74 -12.318 -27.973 -11.529 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.353 -27.047 -14.256 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -11.453 -28.743 -13.826 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.900 -28.311 -13.143 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.743 -26.723 -13.868 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -13.180 -29.342 -15.340 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -14.698 -28.473 -15.434 1.00 0.00 H new ATOM 0 HE ARG A 74 -13.513 -26.587 -16.482 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.783 -29.694 -16.390 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.664 -29.216 -17.671 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -12.045 -25.988 -18.069 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.812 -27.128 -18.618 1.00 0.00 H new ATOM 1186 N ALA A 75 -9.232 -26.873 -11.961 1.00 0.00 N ATOM 1187 CA ALA A 75 -7.868 -27.187 -11.581 1.00 0.00 C ATOM 1188 C ALA A 75 -7.752 -27.345 -10.065 1.00 0.00 C ATOM 1189 O ALA A 75 -6.901 -28.098 -9.604 1.00 0.00 O ATOM 1190 CB ALA A 75 -6.938 -26.097 -12.100 1.00 0.00 C ATOM 0 H ALA A 75 -9.367 -25.957 -12.389 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.576 -28.138 -12.028 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.911 -26.329 -11.816 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.011 -26.043 -13.186 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.225 -25.138 -11.669 1.00 0.00 H new ATOM 1196 N TYR A 76 -8.590 -26.650 -9.281 1.00 0.00 N ATOM 1197 CA TYR A 76 -8.596 -26.832 -7.836 1.00 0.00 C ATOM 1198 C TYR A 76 -9.191 -28.184 -7.468 1.00 0.00 C ATOM 1199 O TYR A 76 -8.626 -28.896 -6.640 1.00 0.00 O ATOM 1200 CB TYR A 76 -9.407 -25.724 -7.160 1.00 0.00 C ATOM 1201 CG TYR A 76 -8.582 -24.572 -6.636 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -9.128 -23.726 -5.660 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -7.281 -24.350 -7.111 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -8.363 -22.684 -5.124 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -6.510 -23.317 -6.571 1.00 0.00 C ATOM 1206 CZ TYR A 76 -7.039 -22.487 -5.563 1.00 0.00 C ATOM 1207 OH TYR A 76 -6.271 -21.501 -5.017 1.00 0.00 O ATOM 0 H TYR A 76 -9.263 -25.965 -9.626 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.564 -26.788 -7.488 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -10.135 -25.338 -7.873 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -9.970 -26.157 -6.333 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -10.142 -23.879 -5.321 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.876 -24.976 -7.892 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -8.787 -22.032 -4.375 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -5.504 -23.154 -6.928 1.00 0.00 H new ATOM 0 HH TYR A 76 -5.334 -21.641 -5.266 1.00 0.00 H new ATOM 1217 N LEU A 77 -10.324 -28.556 -8.069 1.00 0.00 N ATOM 1218 CA LEU A 77 -10.932 -29.821 -7.705 1.00 0.00 C ATOM 1219 C LEU A 77 -9.976 -30.940 -8.114 1.00 0.00 C ATOM 1220 O LEU A 77 -9.736 -31.866 -7.343 1.00 0.00 O ATOM 1221 CB LEU A 77 -12.309 -29.921 -8.371 1.00 0.00 C ATOM 1222 CG LEU A 77 -13.190 -31.087 -7.888 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -12.742 -32.431 -8.447 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -13.240 -31.163 -6.361 1.00 0.00 C ATOM 0 H LEU A 77 -10.817 -28.018 -8.782 1.00 0.00 H new ATOM 0 HA LEU A 77 -11.097 -29.905 -6.631 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -12.845 -28.987 -8.201 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -12.168 -30.016 -9.448 1.00 0.00 H new ATOM 0 HG LEU A 77 -14.190 -30.878 -8.269 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -13.398 -33.217 -8.074 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.788 -32.406 -9.536 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -11.718 -32.633 -8.132 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -13.871 -31.998 -6.059 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.233 -31.310 -5.971 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -13.651 -30.235 -5.964 1.00 0.00 H new ATOM 1236 N ASP A 78 -9.427 -30.851 -9.328 1.00 0.00 N ATOM 1237 CA ASP A 78 -8.400 -31.773 -9.805 1.00 0.00 C ATOM 1238 C ASP A 78 -7.177 -31.842 -8.897 1.00 0.00 C ATOM 1239 O ASP A 78 -6.719 -32.941 -8.586 1.00 0.00 O ATOM 1240 CB ASP A 78 -7.938 -31.352 -11.203 1.00 0.00 C ATOM 1241 CG ASP A 78 -9.032 -31.496 -12.258 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -8.867 -30.888 -13.337 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -10.019 -32.212 -11.976 1.00 0.00 O1- ATOM 0 H ASP A 78 -9.685 -30.135 -10.007 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.860 -32.761 -9.816 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.604 -30.315 -11.173 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.078 -31.956 -11.493 1.00 0.00 H new ATOM 1248 N GLU A 79 -6.634 -30.697 -8.465 1.00 0.00 N ATOM 1249 CA GLU A 79 -5.450 -30.695 -7.629 1.00 0.00 C ATOM 1250 C GLU A 79 -5.727 -31.358 -6.287 1.00 0.00 C ATOM 1251 O GLU A 79 -4.949 -32.199 -5.840 1.00 0.00 O ATOM 1252 CB GLU A 79 -4.987 -29.255 -7.443 1.00 0.00 C ATOM 1253 CG GLU A 79 -3.560 -29.208 -6.911 1.00 0.00 C ATOM 1254 CD GLU A 79 -3.432 -29.631 -5.449 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -4.342 -29.303 -4.656 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -2.413 -30.284 -5.139 1.00 0.00 O1- ATOM 0 H GLU A 79 -7.001 -29.771 -8.684 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.662 -31.271 -8.113 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.043 -28.725 -8.394 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.654 -28.740 -6.752 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -2.933 -29.856 -7.523 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.174 -28.194 -7.021 1.00 0.00 H new ATOM 1263 N THR A 80 -6.832 -30.988 -5.639 1.00 0.00 N ATOM 1264 CA THR A 80 -7.175 -31.555 -4.346 1.00 0.00 C ATOM 1265 C THR A 80 -7.568 -33.020 -4.488 1.00 0.00 C ATOM 1266 O THR A 80 -7.404 -33.788 -3.544 1.00 0.00 O ATOM 1267 CB THR A 80 -8.298 -30.743 -3.708 1.00 0.00 C ATOM 1268 OG1 THR A 80 -9.449 -30.797 -4.519 1.00 0.00 O ATOM 1269 CG2 THR A 80 -7.855 -29.294 -3.527 1.00 0.00 C ATOM 0 H THR A 80 -7.499 -30.301 -5.991 1.00 0.00 H new ATOM 0 HA THR A 80 -6.302 -31.510 -3.695 1.00 0.00 H new ATOM 0 HB THR A 80 -8.532 -31.166 -2.731 1.00 0.00 H new ATOM 0 HG1 THR A 80 -10.175 -30.299 -4.090 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.662 -28.721 -3.071 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.977 -29.260 -2.882 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.609 -28.865 -4.498 1.00 0.00 H new ATOM 1277 N ARG A 81 -8.083 -33.424 -5.655 1.00 0.00 N ATOM 1278 CA ARG A 81 -8.338 -34.825 -5.934 1.00 0.00 C ATOM 1279 C ARG A 81 -7.018 -35.578 -6.104 1.00 0.00 C ATOM 1280 O ARG A 81 -6.953 -36.779 -5.844 1.00 0.00 O ATOM 1281 CB ARG A 81 -9.170 -34.923 -7.205 1.00 0.00 C ATOM 1282 CG ARG A 81 -9.608 -36.365 -7.438 1.00 0.00 C ATOM 1283 CD ARG A 81 -10.599 -36.385 -8.590 1.00 0.00 C ATOM 1284 NE ARG A 81 -9.924 -36.158 -9.877 1.00 0.00 N ATOM 1285 CZ ARG A 81 -10.048 -35.050 -10.617 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -10.844 -34.050 -10.246 1.00 0.00 N1+ ATOM 1287 NH2 ARG A 81 -9.368 -34.917 -11.756 1.00 0.00 N ATOM 0 H ARG A 81 -8.329 -32.792 -6.417 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.881 -35.275 -5.103 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -10.045 -34.278 -7.126 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.589 -34.570 -8.057 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.746 -36.991 -7.669 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.066 -36.773 -6.537 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -11.116 -37.344 -8.612 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.357 -35.618 -8.434 1.00 0.00 H new ATOM 0 HE ARG A 81 -9.318 -36.898 -10.231 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.377 -34.117 -9.379 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -10.921 -33.216 -10.828 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -8.747 -35.663 -12.070 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -9.468 -34.069 -12.314 1.00 0.00 H new ATOM 1301 N SER A 82 -5.971 -34.872 -6.541 1.00 0.00 N ATOM 1302 CA SER A 82 -4.675 -35.467 -6.822 1.00 0.00 C ATOM 1303 C SER A 82 -3.776 -35.554 -5.587 1.00 0.00 C ATOM 1304 O SER A 82 -3.034 -36.524 -5.452 1.00 0.00 O ATOM 1305 CB SER A 82 -3.977 -34.648 -7.909 1.00 0.00 C ATOM 1306 OG SER A 82 -4.797 -34.567 -9.057 1.00 0.00 O ATOM 0 H SER A 82 -6.006 -33.866 -6.709 1.00 0.00 H new ATOM 0 HA SER A 82 -4.850 -36.490 -7.156 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.758 -33.647 -7.537 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.023 -35.108 -8.166 1.00 0.00 H new ATOM 0 HG SER A 82 -5.538 -33.948 -8.887 1.00 0.00 H new ATOM 1420 N PRO A 91 -11.293 -23.346 4.957 1.00 0.00 N ATOM 1421 CA PRO A 91 -10.762 -22.336 4.062 1.00 0.00 C ATOM 1422 C PRO A 91 -9.317 -22.691 3.737 1.00 0.00 C ATOM 1423 O PRO A 91 -8.618 -23.296 4.549 1.00 0.00 O ATOM 1424 CB PRO A 91 -10.888 -21.004 4.800 1.00 0.00 C ATOM 1425 CG PRO A 91 -10.867 -21.425 6.267 1.00 0.00 C ATOM 1426 CD PRO A 91 -11.606 -22.760 6.249 1.00 0.00 C ATOM 0 HA PRO A 91 -11.297 -22.274 3.114 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -10.065 -20.330 4.561 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -11.811 -20.485 4.542 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -9.849 -21.532 6.642 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -11.367 -20.695 6.904 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -11.277 -23.404 7.065 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -12.680 -22.618 6.368 1.00 0.00 H new ATOM 1434 N GLY A 92 -8.867 -22.311 2.540 1.00 0.00 N ATOM 1435 CA GLY A 92 -7.528 -22.639 2.087 1.00 0.00 C ATOM 1436 C GLY A 92 -7.480 -23.966 1.339 1.00 0.00 C ATOM 1437 O GLY A 92 -6.401 -24.526 1.174 1.00 0.00 O ATOM 0 H GLY A 92 -9.418 -21.774 1.870 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -7.162 -21.844 1.437 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.857 -22.683 2.945 1.00 0.00 H new ATOM 1441 N THR A 93 -8.635 -24.474 0.886 1.00 0.00 N ATOM 1442 CA THR A 93 -8.723 -25.695 0.099 1.00 0.00 C ATOM 1443 C THR A 93 -9.940 -25.645 -0.815 1.00 0.00 C ATOM 1444 O THR A 93 -10.767 -24.736 -0.727 1.00 0.00 O ATOM 1445 CB THR A 93 -8.874 -26.926 0.994 1.00 0.00 C ATOM 1446 OG1 THR A 93 -9.950 -26.767 1.887 1.00 0.00 O ATOM 1447 CG2 THR A 93 -7.584 -27.268 1.731 1.00 0.00 C ATOM 0 H THR A 93 -9.540 -24.038 1.062 1.00 0.00 H new ATOM 0 HA THR A 93 -7.802 -25.769 -0.479 1.00 0.00 H new ATOM 0 HB THR A 93 -9.094 -27.773 0.344 1.00 0.00 H new ATOM 0 HG1 THR A 93 -10.030 -27.566 2.449 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.743 -28.149 2.353 1.00 0.00 H new ATOM 0 HG22 THR A 93 -6.795 -27.472 1.007 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.291 -26.428 2.360 1.00 0.00 H new ATOM 1455 N CYS A 94 -10.040 -26.641 -1.698 1.00 0.00 N ATOM 1456 CA CYS A 94 -11.178 -26.800 -2.581 1.00 0.00 C ATOM 1457 C CYS A 94 -12.451 -26.971 -1.762 1.00 0.00 C ATOM 1458 O CYS A 94 -13.543 -26.738 -2.271 1.00 0.00 O ATOM 1459 CB CYS A 94 -10.970 -28.050 -3.436 1.00 0.00 C ATOM 1460 SG CYS A 94 -11.035 -29.511 -2.362 1.00 0.00 S ATOM 0 H CYS A 94 -9.325 -27.359 -1.815 1.00 0.00 H new ATOM 0 HA CYS A 94 -11.270 -25.917 -3.214 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -11.739 -28.113 -4.206 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -10.009 -28.001 -3.949 1.00 0.00 H new ATOM 0 HG CYS A 94 -11.551 -30.508 -3.017 1.00 0.00 H new ATOM 1466 N ALA A 95 -12.328 -27.377 -0.493 1.00 0.00 N ATOM 1467 CA ALA A 95 -13.492 -27.620 0.334 1.00 0.00 C ATOM 1468 C ALA A 95 -14.302 -26.335 0.458 1.00 0.00 C ATOM 1469 O ALA A 95 -15.493 -26.313 0.147 1.00 0.00 O ATOM 1470 CB ALA A 95 -13.027 -28.119 1.701 1.00 0.00 C ATOM 0 H ALA A 95 -11.435 -27.540 -0.028 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.132 -28.379 -0.116 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.894 -28.306 2.334 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.461 -29.043 1.578 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.393 -27.365 2.167 1.00 0.00 H new ATOM 1476 N HIS A 96 -13.656 -25.260 0.911 1.00 0.00 N ATOM 1477 CA HIS A 96 -14.313 -23.979 1.067 1.00 0.00 C ATOM 1478 C HIS A 96 -14.518 -23.305 -0.284 1.00 0.00 C ATOM 1479 O HIS A 96 -15.520 -22.622 -0.485 1.00 0.00 O ATOM 1480 CB HIS A 96 -13.432 -23.099 1.943 1.00 0.00 C ATOM 1481 CG HIS A 96 -14.084 -21.788 2.284 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -15.013 -21.600 3.309 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -13.868 -20.601 1.647 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -15.336 -20.298 3.260 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -14.662 -19.675 2.277 1.00 0.00 N ATOM 0 H HIS A 96 -12.671 -25.260 1.176 1.00 0.00 H new ATOM 0 HA HIS A 96 -15.292 -24.127 1.524 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -13.193 -23.632 2.863 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -12.489 -22.909 1.430 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -13.205 -20.425 0.813 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -16.042 -19.816 3.921 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -14.729 -18.685 2.040 1.00 0.00 H new ATOM 1493 N ALA A 97 -13.568 -23.497 -1.206 1.00 0.00 N ATOM 1494 CA ALA A 97 -13.603 -22.846 -2.502 1.00 0.00 C ATOM 1495 C ALA A 97 -14.781 -23.341 -3.334 1.00 0.00 C ATOM 1496 O ALA A 97 -15.525 -22.527 -3.880 1.00 0.00 O ATOM 1497 CB ALA A 97 -12.284 -23.116 -3.225 1.00 0.00 C ATOM 0 H ALA A 97 -12.762 -24.106 -1.067 1.00 0.00 H new ATOM 0 HA ALA A 97 -13.732 -21.773 -2.360 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -12.298 -22.631 -4.201 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -11.458 -22.719 -2.635 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -12.154 -24.190 -3.355 1.00 0.00 H new ATOM 1503 N ILE A 98 -14.962 -24.663 -3.444 1.00 0.00 N ATOM 1504 CA ILE A 98 -16.068 -25.206 -4.216 1.00 0.00 C ATOM 1505 C ILE A 98 -17.377 -24.993 -3.470 1.00 0.00 C ATOM 1506 O ILE A 98 -18.402 -24.767 -4.109 1.00 0.00 O ATOM 1507 CB ILE A 98 -15.830 -26.692 -4.540 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -14.888 -26.890 -5.739 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -17.145 -27.388 -4.907 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -13.485 -26.327 -5.543 1.00 0.00 C ATOM 0 H ILE A 98 -14.360 -25.363 -3.011 1.00 0.00 H new ATOM 0 HA ILE A 98 -16.132 -24.676 -5.166 1.00 0.00 H new ATOM 0 HB ILE A 98 -15.385 -27.117 -3.640 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -14.811 -27.956 -5.952 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -15.334 -26.421 -6.616 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -16.951 -28.437 -5.132 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -17.839 -27.319 -4.070 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -17.581 -26.904 -5.781 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.891 -26.512 -6.438 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.546 -25.254 -5.363 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -13.014 -26.812 -4.688 1.00 0.00 H new ATOM 1522 N ASN A 99 -17.371 -25.059 -2.136 1.00 0.00 N ATOM 1523 CA ASN A 99 -18.594 -24.834 -1.384 1.00 0.00 C ATOM 1524 C ASN A 99 -19.075 -23.394 -1.527 1.00 0.00 C ATOM 1525 O ASN A 99 -20.271 -23.162 -1.654 1.00 0.00 O ATOM 1526 CB ASN A 99 -18.336 -25.130 0.089 1.00 0.00 C ATOM 1527 CG ASN A 99 -18.370 -26.623 0.411 1.00 0.00 C ATOM 1528 OD1 ASN A 99 -18.293 -27.480 -0.605 1.00 0.00 O flip ATOM 1529 ND2 ASN A 99 -18.465 -27.001 1.577 1.00 0.00 N flip ATOM 0 H ASN A 99 -16.547 -25.263 -1.570 1.00 0.00 H new ATOM 0 HA ASN A 99 -19.366 -25.495 -1.778 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -17.364 -24.725 0.371 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -19.083 -24.616 0.694 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -18.522 -26.317 2.332 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -18.487 -27.998 1.790 1.00 0.00 H new ATOM 1536 N THR A 100 -18.159 -22.422 -1.509 1.00 0.00 N ATOM 1537 CA THR A 100 -18.546 -21.024 -1.607 1.00 0.00 C ATOM 1538 C THR A 100 -18.940 -20.670 -3.034 1.00 0.00 C ATOM 1539 O THR A 100 -19.838 -19.857 -3.246 1.00 0.00 O ATOM 1540 CB THR A 100 -17.376 -20.151 -1.145 1.00 0.00 C ATOM 1541 OG1 THR A 100 -17.045 -20.465 0.189 1.00 0.00 O ATOM 1542 CG2 THR A 100 -17.718 -18.664 -1.236 1.00 0.00 C ATOM 0 H THR A 100 -17.155 -22.581 -1.428 1.00 0.00 H new ATOM 0 HA THR A 100 -19.412 -20.846 -0.969 1.00 0.00 H new ATOM 0 HB THR A 100 -16.530 -20.353 -1.802 1.00 0.00 H new ATOM 0 HG1 THR A 100 -16.455 -21.247 0.204 1.00 0.00 H new ATOM 0 HG21 THR A 100 -16.866 -18.073 -0.900 1.00 0.00 H new ATOM 0 HG22 THR A 100 -17.953 -18.407 -2.269 1.00 0.00 H new ATOM 0 HG23 THR A 100 -18.579 -18.449 -0.604 1.00 0.00 H new ATOM 1550 N LEU A 101 -18.271 -21.278 -4.018 1.00 0.00 N ATOM 1551 CA LEU A 101 -18.522 -21.013 -5.422 1.00 0.00 C ATOM 1552 C LEU A 101 -19.812 -21.686 -5.884 1.00 0.00 C ATOM 1553 O LEU A 101 -20.560 -21.109 -6.670 1.00 0.00 O ATOM 1554 CB LEU A 101 -17.316 -21.524 -6.217 1.00 0.00 C ATOM 1555 CG LEU A 101 -17.450 -21.315 -7.728 1.00 0.00 C ATOM 1556 CD1 LEU A 101 -17.472 -19.826 -8.081 1.00 0.00 C ATOM 1557 CD2 LEU A 101 -16.268 -21.979 -8.432 1.00 0.00 C ATOM 0 H LEU A 101 -17.539 -21.969 -3.854 1.00 0.00 H new ATOM 0 HA LEU A 101 -18.651 -19.943 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -16.418 -21.017 -5.866 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -17.181 -22.587 -6.015 1.00 0.00 H new ATOM 0 HG LEU A 101 -18.389 -21.761 -8.055 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -17.568 -19.709 -9.160 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -18.318 -19.348 -7.588 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -16.546 -19.359 -7.747 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -16.357 -21.834 -9.509 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -15.338 -21.532 -8.082 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -16.264 -23.046 -8.209 1.00 0.00 H new ATOM 1569 N GLY A 102 -20.080 -22.904 -5.404 1.00 0.00 N ATOM 1570 CA GLY A 102 -21.204 -23.700 -5.876 1.00 0.00 C ATOM 1571 C GLY A 102 -22.564 -23.110 -5.507 1.00 0.00 C ATOM 1572 O GLY A 102 -23.553 -23.403 -6.175 1.00 0.00 O ATOM 0 H GLY A 102 -19.523 -23.359 -4.681 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -21.141 -23.797 -6.960 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -21.128 -24.705 -5.461 1.00 0.00 H new ATOM 1576 N GLU A 103 -22.630 -22.287 -4.458 1.00 0.00 N ATOM 1577 CA GLU A 103 -23.888 -21.675 -4.052 1.00 0.00 C ATOM 1578 C GLU A 103 -24.285 -20.555 -5.000 1.00 0.00 C ATOM 1579 O GLU A 103 -25.468 -20.362 -5.274 1.00 0.00 O ATOM 1580 CB GLU A 103 -23.709 -21.082 -2.657 1.00 0.00 C ATOM 1581 CG GLU A 103 -23.301 -22.147 -1.644 1.00 0.00 C ATOM 1582 CD GLU A 103 -24.492 -22.924 -1.092 1.00 0.00 C ATOM 1583 OE1 GLU A 103 -25.533 -22.960 -1.785 1.00 0.00 O ATOM 1584 OE2 GLU A 103 -24.346 -23.476 0.023 1.00 0.00 O1- ATOM 0 H GLU A 103 -21.829 -22.033 -3.880 1.00 0.00 H new ATOM 0 HA GLU A 103 -24.667 -22.438 -4.065 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -22.951 -20.299 -2.688 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -24.640 -20.613 -2.338 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -22.606 -22.842 -2.115 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.769 -21.673 -0.820 1.00 0.00 H new ATOM 1591 N VAL A 104 -23.290 -19.817 -5.502 1.00 0.00 N ATOM 1592 CA VAL A 104 -23.550 -18.665 -6.354 1.00 0.00 C ATOM 1593 C VAL A 104 -23.335 -18.949 -7.840 1.00 0.00 C ATOM 1594 O VAL A 104 -23.754 -18.145 -8.668 1.00 0.00 O ATOM 1595 CB VAL A 104 -22.682 -17.481 -5.911 1.00 0.00 C ATOM 1596 CG1 VAL A 104 -22.960 -17.133 -4.449 1.00 0.00 C ATOM 1597 CG2 VAL A 104 -21.192 -17.780 -6.083 1.00 0.00 C ATOM 0 H VAL A 104 -22.301 -20.001 -5.331 1.00 0.00 H new ATOM 0 HA VAL A 104 -24.606 -18.421 -6.237 1.00 0.00 H new ATOM 0 HB VAL A 104 -22.941 -16.634 -6.546 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -22.336 -16.291 -4.150 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -24.010 -16.866 -4.332 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -22.732 -17.994 -3.820 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -20.608 -16.918 -5.759 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -20.923 -18.648 -5.481 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -20.981 -17.987 -7.132 1.00 0.00 H new ATOM 1607 N ILE A 105 -22.693 -20.066 -8.205 1.00 0.00 N ATOM 1608 CA ILE A 105 -22.379 -20.321 -9.607 1.00 0.00 C ATOM 1609 C ILE A 105 -23.646 -20.424 -10.457 1.00 0.00 C ATOM 1610 O ILE A 105 -23.612 -20.139 -11.651 1.00 0.00 O ATOM 1611 CB ILE A 105 -21.514 -21.584 -9.728 1.00 0.00 C ATOM 1612 CG1 ILE A 105 -20.872 -21.700 -11.113 1.00 0.00 C ATOM 1613 CG2 ILE A 105 -22.343 -22.843 -9.467 1.00 0.00 C ATOM 1614 CD1 ILE A 105 -19.873 -20.565 -11.347 1.00 0.00 C ATOM 0 H ILE A 105 -22.387 -20.793 -7.558 1.00 0.00 H new ATOM 0 HA ILE A 105 -21.811 -19.475 -9.993 1.00 0.00 H new ATOM 0 HB ILE A 105 -20.728 -21.497 -8.977 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -20.365 -22.661 -11.204 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -21.646 -21.673 -11.880 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -21.707 -23.723 -9.559 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -22.761 -22.801 -8.461 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -23.152 -22.903 -10.195 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -19.430 -20.669 -12.337 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -20.388 -19.607 -11.279 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -19.088 -20.610 -10.592 1.00 0.00 H new ATOM 1626 N GLN A 106 -24.763 -20.830 -9.847 1.00 0.00 N ATOM 1627 CA GLN A 106 -26.043 -20.900 -10.532 1.00 0.00 C ATOM 1628 C GLN A 106 -26.519 -19.496 -10.893 1.00 0.00 C ATOM 1629 O GLN A 106 -27.220 -19.330 -11.890 1.00 0.00 O ATOM 1630 CB GLN A 106 -27.045 -21.635 -9.639 1.00 0.00 C ATOM 1631 CG GLN A 106 -27.174 -21.018 -8.243 1.00 0.00 C ATOM 1632 CD GLN A 106 -27.910 -21.949 -7.286 1.00 0.00 C ATOM 1633 OE1 GLN A 106 -28.651 -22.831 -7.712 1.00 0.00 O ATOM 1634 NE2 GLN A 106 -27.713 -21.761 -5.983 1.00 0.00 N ATOM 0 H GLN A 106 -24.799 -21.117 -8.869 1.00 0.00 H new ATOM 0 HA GLN A 106 -25.945 -21.456 -11.464 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -28.022 -21.633 -10.122 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -26.740 -22.677 -9.542 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -26.182 -20.799 -7.848 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -27.707 -20.070 -8.311 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -27.091 -21.019 -5.663 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -28.184 -22.359 -5.304 1.00 0.00 H new ATOM 1643 N GLU A 107 -26.150 -18.484 -10.100 1.00 0.00 N ATOM 1644 CA GLU A 107 -26.487 -17.108 -10.426 1.00 0.00 C ATOM 1645 C GLU A 107 -25.583 -16.603 -11.545 1.00 0.00 C ATOM 1646 O GLU A 107 -26.052 -15.917 -12.449 1.00 0.00 O ATOM 1647 CB GLU A 107 -26.309 -16.205 -9.205 1.00 0.00 C ATOM 1648 CG GLU A 107 -27.160 -16.654 -8.014 1.00 0.00 C ATOM 1649 CD GLU A 107 -27.047 -15.662 -6.856 1.00 0.00 C ATOM 1650 OE1 GLU A 107 -26.338 -14.644 -7.037 1.00 0.00 O ATOM 1651 OE2 GLU A 107 -27.671 -15.936 -5.810 1.00 0.00 O1- ATOM 0 H GLU A 107 -25.622 -18.598 -9.235 1.00 0.00 H new ATOM 0 HA GLU A 107 -27.529 -17.081 -10.746 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -25.259 -16.196 -8.914 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -26.575 -15.182 -9.472 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -28.202 -16.744 -8.320 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -26.838 -17.642 -7.684 1.00 0.00 H new ATOM 1658 N LEU A 108 -24.288 -16.941 -11.484 1.00 0.00 N ATOM 1659 CA LEU A 108 -23.326 -16.488 -12.480 1.00 0.00 C ATOM 1660 C LEU A 108 -23.661 -17.073 -13.844 1.00 0.00 C ATOM 1661 O LEU A 108 -23.585 -16.369 -14.847 1.00 0.00 O ATOM 1662 CB LEU A 108 -21.913 -16.920 -12.088 1.00 0.00 C ATOM 1663 CG LEU A 108 -21.243 -15.938 -11.123 1.00 0.00 C ATOM 1664 CD1 LEU A 108 -21.871 -15.948 -9.731 1.00 0.00 C ATOM 1665 CD2 LEU A 108 -19.773 -16.327 -10.998 1.00 0.00 C ATOM 0 H LEU A 108 -23.889 -17.528 -10.752 1.00 0.00 H new ATOM 0 HA LEU A 108 -23.375 -15.400 -12.528 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -21.954 -17.907 -11.626 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -21.303 -17.014 -12.987 1.00 0.00 H new ATOM 0 HG LEU A 108 -21.371 -14.934 -11.527 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -21.353 -15.232 -9.093 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.923 -15.674 -9.805 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -21.785 -16.946 -9.300 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -19.272 -15.641 -10.315 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -19.697 -17.344 -10.612 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -19.298 -16.274 -11.978 1.00 0.00 H new ATOM 1677 N LEU A 109 -24.031 -18.356 -13.886 1.00 0.00 N ATOM 1678 CA LEU A 109 -24.390 -18.987 -15.145 1.00 0.00 C ATOM 1679 C LEU A 109 -25.675 -18.371 -15.684 1.00 0.00 C ATOM 1680 O LEU A 109 -25.711 -17.970 -16.843 1.00 0.00 O ATOM 1681 CB LEU A 109 -24.562 -20.494 -14.938 1.00 0.00 C ATOM 1682 CG LEU A 109 -23.224 -21.210 -14.734 1.00 0.00 C ATOM 1683 CD1 LEU A 109 -23.483 -22.635 -14.248 1.00 0.00 C ATOM 1684 CD2 LEU A 109 -22.445 -21.267 -16.048 1.00 0.00 C ATOM 0 H LEU A 109 -24.087 -18.966 -13.070 1.00 0.00 H new ATOM 0 HA LEU A 109 -23.595 -18.823 -15.872 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -25.201 -20.669 -14.072 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -25.072 -20.921 -15.802 1.00 0.00 H new ATOM 0 HG LEU A 109 -22.640 -20.660 -13.996 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -22.532 -23.148 -14.102 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -24.028 -22.604 -13.304 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -24.074 -23.171 -14.991 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -21.496 -21.779 -15.887 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -23.028 -21.809 -16.793 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -22.255 -20.254 -16.403 1.00 0.00 H new ATOM 1696 N SER A 110 -26.722 -18.292 -14.856 1.00 0.00 N ATOM 1697 CA SER A 110 -28.004 -17.746 -15.278 1.00 0.00 C ATOM 1698 C SER A 110 -27.856 -16.300 -15.747 1.00 0.00 C ATOM 1699 O SER A 110 -28.392 -15.928 -16.792 1.00 0.00 O ATOM 1700 CB SER A 110 -28.999 -17.804 -14.118 1.00 0.00 C ATOM 1701 OG SER A 110 -29.066 -19.109 -13.582 1.00 0.00 O ATOM 0 H SER A 110 -26.700 -18.603 -13.885 1.00 0.00 H new ATOM 0 HA SER A 110 -28.371 -18.346 -16.111 1.00 0.00 H new ATOM 0 HB2 SER A 110 -28.700 -17.101 -13.340 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.986 -17.496 -14.463 1.00 0.00 H new ATOM 0 HG SER A 110 -28.649 -19.120 -12.695 1.00 0.00 H new ATOM 1707 N ASP A 111 -27.128 -15.484 -14.977 1.00 0.00 N ATOM 1708 CA ASP A 111 -26.913 -14.093 -15.343 1.00 0.00 C ATOM 1709 C ASP A 111 -26.146 -14.041 -16.653 1.00 0.00 C ATOM 1710 O ASP A 111 -26.415 -13.192 -17.494 1.00 0.00 O ATOM 1711 CB ASP A 111 -26.097 -13.398 -14.253 1.00 0.00 C ATOM 1712 CG ASP A 111 -25.893 -11.908 -14.532 1.00 0.00 C ATOM 1713 OD1 ASP A 111 -26.686 -11.341 -15.319 1.00 0.00 O ATOM 1714 OD2 ASP A 111 -24.937 -11.350 -13.949 1.00 0.00 O1- ATOM 0 H ASP A 111 -26.683 -15.767 -14.104 1.00 0.00 H new ATOM 0 HA ASP A 111 -27.873 -13.589 -15.453 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -26.601 -13.519 -13.294 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -25.125 -13.884 -14.166 1.00 0.00 H new ATOM 1719 N ALA A 112 -25.183 -14.950 -16.837 1.00 0.00 N ATOM 1720 CA ALA A 112 -24.356 -14.924 -18.023 1.00 0.00 C ATOM 1721 C ALA A 112 -25.156 -15.272 -19.273 1.00 0.00 C ATOM 1722 O ALA A 112 -24.842 -14.766 -20.351 1.00 0.00 O ATOM 1723 CB ALA A 112 -23.167 -15.866 -17.845 1.00 0.00 C ATOM 0 H ALA A 112 -24.967 -15.701 -16.181 1.00 0.00 H new ATOM 0 HA ALA A 112 -23.982 -13.909 -18.160 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -22.547 -15.843 -18.741 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -22.576 -15.547 -16.986 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -23.528 -16.881 -17.680 1.00 0.00 H new ATOM 1729 N ILE A 113 -26.184 -16.124 -19.171 1.00 0.00 N ATOM 1730 CA ILE A 113 -26.971 -16.419 -20.357 1.00 0.00 C ATOM 1731 C ILE A 113 -27.793 -15.191 -20.737 1.00 0.00 C ATOM 1732 O ILE A 113 -27.869 -14.828 -21.907 1.00 0.00 O ATOM 1733 CB ILE A 113 -27.928 -17.599 -20.133 1.00 0.00 C ATOM 1734 CG1 ILE A 113 -27.285 -18.866 -19.558 1.00 0.00 C ATOM 1735 CG2 ILE A 113 -28.594 -17.909 -21.471 1.00 0.00 C ATOM 1736 CD1 ILE A 113 -26.079 -19.364 -20.350 1.00 0.00 C ATOM 0 H ILE A 113 -26.475 -16.599 -18.317 1.00 0.00 H new ATOM 0 HA ILE A 113 -26.277 -16.687 -21.154 1.00 0.00 H new ATOM 0 HB ILE A 113 -28.643 -17.291 -19.370 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -26.977 -18.671 -18.531 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -28.034 -19.657 -19.521 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -29.283 -18.745 -21.349 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -29.144 -17.033 -21.816 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -27.832 -18.171 -22.205 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -25.681 -20.263 -19.880 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -26.384 -19.593 -21.371 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -25.310 -18.592 -20.366 1.00 0.00 H new ATOM 1748 N ALA A 114 -28.405 -14.557 -19.734 1.00 0.00 N ATOM 1749 CA ALA A 114 -29.248 -13.393 -19.943 1.00 0.00 C ATOM 1750 C ALA A 114 -28.452 -12.131 -20.290 1.00 0.00 C ATOM 1751 O ALA A 114 -28.932 -11.306 -21.063 1.00 0.00 O ATOM 1752 CB ALA A 114 -30.071 -13.156 -18.677 1.00 0.00 C ATOM 0 H ALA A 114 -28.326 -14.841 -18.758 1.00 0.00 H new ATOM 0 HA ALA A 114 -29.892 -13.596 -20.798 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -30.711 -12.284 -18.817 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -30.689 -14.031 -18.476 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -29.401 -12.983 -17.835 1.00 0.00 H new ATOM 1758 N LYS A 115 -27.243 -11.970 -19.735 1.00 0.00 N ATOM 1759 CA LYS A 115 -26.425 -10.793 -19.995 1.00 0.00 C ATOM 1760 C LYS A 115 -25.709 -10.887 -21.334 1.00 0.00 C ATOM 1761 O LYS A 115 -25.560 -9.884 -22.028 1.00 0.00 O ATOM 1762 CB LYS A 115 -25.360 -10.657 -18.903 1.00 0.00 C ATOM 1763 CG LYS A 115 -24.969 -9.190 -18.718 1.00 0.00 C ATOM 1764 CD LYS A 115 -25.690 -8.568 -17.516 1.00 0.00 C ATOM 1765 CE LYS A 115 -27.219 -8.594 -17.597 1.00 0.00 C ATOM 1766 NZ LYS A 115 -27.765 -9.936 -17.310 1.00 0.00 N1+ ATOM 0 H LYS A 115 -26.815 -12.646 -19.102 1.00 0.00 H new ATOM 0 HA LYS A 115 -27.092 -9.931 -20.008 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -25.740 -11.060 -17.964 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -24.481 -11.243 -19.169 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.891 -9.114 -18.577 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -25.213 -8.630 -19.621 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -25.380 -9.093 -16.613 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.364 -7.533 -17.411 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -27.632 -7.875 -16.889 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -27.535 -8.279 -18.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -28.605 -9.847 -16.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -28.029 -10.401 -18.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -27.045 -10.506 -16.822 1.00 0.00 H new ATOM 1780 N SER A 116 -25.265 -12.094 -21.693 1.00 0.00 N ATOM 1781 CA SER A 116 -24.413 -12.283 -22.850 1.00 0.00 C ATOM 1782 C SER A 116 -25.222 -12.426 -24.141 1.00 0.00 C ATOM 1783 O SER A 116 -26.429 -12.655 -24.108 1.00 0.00 O ATOM 1784 CB SER A 116 -23.468 -13.452 -22.591 1.00 0.00 C ATOM 1785 OG SER A 116 -24.112 -14.685 -22.810 1.00 0.00 O ATOM 0 H SER A 116 -25.488 -12.953 -21.191 1.00 0.00 H new ATOM 0 HA SER A 116 -23.805 -11.391 -23.002 1.00 0.00 H new ATOM 0 HB2 SER A 116 -22.599 -13.372 -23.244 1.00 0.00 H new ATOM 0 HB3 SER A 116 -23.102 -13.407 -21.565 1.00 0.00 H new ATOM 0 HG SER A 116 -24.613 -14.940 -22.007 1.00 0.00 H new ATOM 1791 N ASN A 117 -24.538 -12.284 -25.279 1.00 0.00 N ATOM 1792 CA ASN A 117 -25.157 -12.200 -26.593 1.00 0.00 C ATOM 1793 C ASN A 117 -25.592 -13.551 -27.149 1.00 0.00 C ATOM 1794 O ASN A 117 -26.644 -14.064 -26.771 1.00 0.00 O ATOM 1795 CB ASN A 117 -24.228 -11.431 -27.541 1.00 0.00 C ATOM 1796 CG ASN A 117 -23.877 -10.078 -26.941 1.00 0.00 C ATOM 1797 OD1 ASN A 117 -24.557 -9.088 -27.189 1.00 0.00 O ATOM 1798 ND2 ASN A 117 -22.811 -10.032 -26.147 1.00 0.00 N ATOM 0 H ASN A 117 -23.520 -12.224 -25.308 1.00 0.00 H new ATOM 0 HA ASN A 117 -26.090 -11.646 -26.493 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -23.319 -12.006 -27.719 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -24.713 -11.295 -28.508 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -22.532 -9.149 -25.718 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -22.272 -10.879 -25.967 1.00 0.00 H new ATOM 1805 N GLN A 118 -24.788 -14.126 -28.047 1.00 0.00 N ATOM 1806 CA GLN A 118 -25.105 -15.410 -28.669 1.00 0.00 C ATOM 1807 C GLN A 118 -23.867 -16.291 -28.724 1.00 0.00 C ATOM 1808 O GLN A 118 -23.901 -17.452 -28.322 1.00 0.00 O ATOM 1809 CB GLN A 118 -25.645 -15.193 -30.084 1.00 0.00 C ATOM 1810 CG GLN A 118 -26.991 -14.469 -30.074 1.00 0.00 C ATOM 1811 CD GLN A 118 -28.097 -15.290 -29.416 1.00 0.00 C ATOM 1812 OE1 GLN A 118 -29.019 -14.734 -28.825 1.00 0.00 O ATOM 1813 NE2 GLN A 118 -28.021 -16.618 -29.507 1.00 0.00 N ATOM 0 H GLN A 118 -23.907 -13.718 -28.360 1.00 0.00 H new ATOM 0 HA GLN A 118 -25.867 -15.905 -28.067 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -24.925 -14.614 -30.663 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -25.754 -16.156 -30.583 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -26.885 -13.521 -29.546 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -27.280 -14.233 -31.098 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -27.243 -17.051 -30.004 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -28.741 -17.201 -29.079 1.00 0.00 H new ATOM 1822 N ASP A 119 -22.774 -15.719 -29.227 1.00 0.00 N ATOM 1823 CA ASP A 119 -21.480 -16.379 -29.261 1.00 0.00 C ATOM 1824 C ASP A 119 -21.035 -16.643 -27.828 1.00 0.00 C ATOM 1825 O ASP A 119 -20.469 -17.687 -27.520 1.00 0.00 O ATOM 1826 CB ASP A 119 -20.458 -15.473 -29.963 1.00 0.00 C ATOM 1827 CG ASP A 119 -20.467 -14.009 -29.503 1.00 0.00 C ATOM 1828 OD1 ASP A 119 -21.436 -13.598 -28.823 1.00 0.00 O ATOM 1829 OD2 ASP A 119 -19.489 -13.312 -29.848 1.00 0.00 O1- ATOM 0 H ASP A 119 -22.767 -14.779 -29.623 1.00 0.00 H new ATOM 0 HA ASP A 119 -21.552 -17.319 -29.808 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -19.461 -15.883 -29.802 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -20.646 -15.502 -31.036 1.00 0.00 H new ATOM 1834 N HIS A 120 -21.304 -15.678 -26.954 1.00 0.00 N ATOM 1835 CA HIS A 120 -21.019 -15.792 -25.537 1.00 0.00 C ATOM 1836 C HIS A 120 -21.883 -16.876 -24.893 1.00 0.00 C ATOM 1837 O HIS A 120 -21.387 -17.631 -24.059 1.00 0.00 O ATOM 1838 CB HIS A 120 -21.297 -14.443 -24.891 1.00 0.00 C ATOM 1839 CG HIS A 120 -20.539 -13.283 -25.486 1.00 0.00 C ATOM 1840 ND1 HIS A 120 -20.771 -11.941 -25.176 1.00 0.00 N ATOM 1841 CD2 HIS A 120 -19.531 -13.365 -26.401 1.00 0.00 C ATOM 1842 CE1 HIS A 120 -19.892 -11.248 -25.919 1.00 0.00 C ATOM 1843 NE2 HIS A 120 -19.139 -12.077 -26.663 1.00 0.00 N ATOM 0 H HIS A 120 -21.730 -14.789 -27.217 1.00 0.00 H new ATOM 0 HA HIS A 120 -19.976 -16.075 -25.392 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -22.365 -14.235 -24.964 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -21.056 -14.509 -23.830 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -19.122 -14.266 -26.834 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -19.802 -10.172 -25.919 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -18.403 -11.796 -27.311 1.00 0.00 H new ATOM 1851 N LYS A 121 -23.167 -16.961 -25.268 1.00 0.00 N ATOM 1852 CA LYS A 121 -24.053 -17.972 -24.712 1.00 0.00 C ATOM 1853 C LYS A 121 -23.561 -19.360 -25.102 1.00 0.00 C ATOM 1854 O LYS A 121 -23.691 -20.294 -24.314 1.00 0.00 O ATOM 1855 CB LYS A 121 -25.499 -17.744 -25.160 1.00 0.00 C ATOM 1856 CG LYS A 121 -25.984 -16.389 -24.639 1.00 0.00 C ATOM 1857 CD LYS A 121 -27.489 -16.193 -24.801 1.00 0.00 C ATOM 1858 CE LYS A 121 -27.964 -16.594 -26.193 1.00 0.00 C ATOM 1859 NZ LYS A 121 -29.345 -16.144 -26.445 1.00 0.00 N1+ ATOM 0 H LYS A 121 -23.605 -16.342 -25.950 1.00 0.00 H new ATOM 0 HA LYS A 121 -24.038 -17.893 -23.625 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -25.563 -17.772 -26.248 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -26.139 -18.542 -24.782 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -25.722 -16.296 -23.585 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -25.460 -15.593 -25.169 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -28.016 -16.785 -24.052 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -27.742 -15.149 -24.617 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -27.299 -16.166 -26.943 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -27.909 -17.677 -26.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -29.952 -16.969 -26.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -29.699 -15.628 -25.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -29.360 -15.517 -27.275 1.00 0.00 H new ATOM 1873 N GLU A 122 -22.997 -19.504 -26.305 1.00 0.00 N ATOM 1874 CA GLU A 122 -22.460 -20.779 -26.760 1.00 0.00 C ATOM 1875 C GLU A 122 -21.280 -21.201 -25.889 1.00 0.00 C ATOM 1876 O GLU A 122 -21.220 -22.340 -25.428 1.00 0.00 O ATOM 1877 CB GLU A 122 -22.046 -20.650 -28.228 1.00 0.00 C ATOM 1878 CG GLU A 122 -21.172 -21.830 -28.662 1.00 0.00 C ATOM 1879 CD GLU A 122 -19.675 -21.575 -28.473 1.00 0.00 C ATOM 1880 OE1 GLU A 122 -18.998 -22.513 -28.002 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -19.233 -20.455 -28.804 1.00 0.00 O1- ATOM 0 H GLU A 122 -22.903 -18.746 -26.981 1.00 0.00 H new ATOM 0 HA GLU A 122 -23.224 -21.552 -26.674 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -22.935 -20.602 -28.857 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -21.501 -19.717 -28.374 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -21.458 -22.714 -28.092 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -21.366 -22.051 -29.712 1.00 0.00 H new ATOM 1888 N LYS A 123 -20.339 -20.282 -25.665 1.00 0.00 N ATOM 1889 CA LYS A 123 -19.174 -20.556 -24.838 1.00 0.00 C ATOM 1890 C LYS A 123 -19.576 -20.940 -23.417 1.00 0.00 C ATOM 1891 O LYS A 123 -18.877 -21.716 -22.766 1.00 0.00 O ATOM 1892 CB LYS A 123 -18.278 -19.319 -24.800 1.00 0.00 C ATOM 1893 CG LYS A 123 -17.620 -19.026 -26.151 1.00 0.00 C ATOM 1894 CD LYS A 123 -16.710 -20.179 -26.568 1.00 0.00 C ATOM 1895 CE LYS A 123 -15.841 -19.753 -27.745 1.00 0.00 C ATOM 1896 NZ LYS A 123 -14.812 -20.770 -28.025 1.00 0.00 N1+ ATOM 0 H LYS A 123 -20.366 -19.338 -26.050 1.00 0.00 H new ATOM 0 HA LYS A 123 -18.636 -21.397 -25.275 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.869 -18.456 -24.493 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -17.504 -19.459 -24.046 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -18.388 -18.869 -26.909 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -17.042 -18.104 -26.087 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -16.081 -20.479 -25.730 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -17.310 -21.047 -26.843 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -16.463 -19.604 -28.628 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -15.365 -18.797 -27.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -14.230 -20.462 -28.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -14.208 -20.892 -27.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -15.271 -21.674 -28.256 1.00 0.00 H new ATOM 1910 N ILE A 124 -20.696 -20.412 -22.918 1.00 0.00 N ATOM 1911 CA ILE A 124 -21.151 -20.758 -21.582 1.00 0.00 C ATOM 1912 C ILE A 124 -21.746 -22.162 -21.576 1.00 0.00 C ATOM 1913 O ILE A 124 -21.609 -22.883 -20.589 1.00 0.00 O ATOM 1914 CB ILE A 124 -22.183 -19.731 -21.106 1.00 0.00 C ATOM 1915 CG1 ILE A 124 -21.509 -18.358 -20.989 1.00 0.00 C ATOM 1916 CG2 ILE A 124 -22.752 -20.139 -19.743 1.00 0.00 C ATOM 1917 CD1 ILE A 124 -22.548 -17.246 -21.076 1.00 0.00 C ATOM 0 H ILE A 124 -21.293 -19.752 -23.416 1.00 0.00 H new ATOM 0 HA ILE A 124 -20.302 -20.744 -20.898 1.00 0.00 H new ATOM 0 HB ILE A 124 -22.999 -19.685 -21.827 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -20.972 -18.289 -20.043 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.772 -18.239 -21.783 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -23.484 -19.399 -19.418 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -23.233 -21.113 -19.827 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -21.944 -20.195 -19.013 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -22.053 -16.278 -20.991 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -23.066 -17.306 -22.033 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -23.269 -17.357 -20.266 1.00 0.00 H new ATOM 1929 N ARG A 125 -22.405 -22.564 -22.669 1.00 0.00 N ATOM 1930 CA ARG A 125 -22.971 -23.902 -22.753 1.00 0.00 C ATOM 1931 C ARG A 125 -21.876 -24.962 -22.824 1.00 0.00 C ATOM 1932 O ARG A 125 -22.046 -26.042 -22.264 1.00 0.00 O ATOM 1933 CB ARG A 125 -23.895 -24.030 -23.967 1.00 0.00 C ATOM 1934 CG ARG A 125 -25.173 -23.194 -23.854 1.00 0.00 C ATOM 1935 CD ARG A 125 -25.967 -23.530 -22.593 1.00 0.00 C ATOM 1936 NE ARG A 125 -27.285 -22.883 -22.626 1.00 0.00 N ATOM 1937 CZ ARG A 125 -27.930 -22.395 -21.561 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -27.389 -22.456 -20.344 1.00 0.00 N1+ ATOM 1939 NH2 ARG A 125 -29.132 -21.840 -21.719 1.00 0.00 N ATOM 0 H ARG A 125 -22.555 -21.985 -23.495 1.00 0.00 H new ATOM 0 HA ARG A 125 -23.554 -24.066 -21.847 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -23.350 -23.727 -24.861 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -24.166 -25.078 -24.098 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -24.914 -22.135 -23.848 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -25.797 -23.365 -24.731 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -26.088 -24.610 -22.509 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -25.416 -23.202 -21.711 1.00 0.00 H new ATOM 0 HE ARG A 125 -27.745 -22.799 -23.533 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -26.470 -22.879 -20.215 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -27.894 -22.079 -19.542 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -29.553 -21.790 -22.647 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -29.631 -21.465 -20.912 1.00 0.00 H new ATOM 1953 N MET A 126 -20.752 -24.685 -23.498 1.00 0.00 N ATOM 1954 CA MET A 126 -19.677 -25.670 -23.530 1.00 0.00 C ATOM 1955 C MET A 126 -19.005 -25.737 -22.159 1.00 0.00 C ATOM 1956 O MET A 126 -18.559 -26.806 -21.752 1.00 0.00 O ATOM 1957 CB MET A 126 -18.667 -25.369 -24.644 1.00 0.00 C ATOM 1958 CG MET A 126 -17.926 -24.050 -24.435 1.00 0.00 C ATOM 1959 SD MET A 126 -16.620 -23.708 -25.645 1.00 0.00 S ATOM 1960 CE MET A 126 -15.411 -24.966 -25.160 1.00 0.00 C ATOM 0 H MET A 126 -20.571 -23.821 -24.008 1.00 0.00 H new ATOM 0 HA MET A 126 -20.103 -26.647 -23.757 1.00 0.00 H new ATOM 0 HB2 MET A 126 -17.943 -26.182 -24.700 1.00 0.00 H new ATOM 0 HB3 MET A 126 -19.188 -25.340 -25.601 1.00 0.00 H new ATOM 0 HG2 MET A 126 -18.650 -23.235 -24.463 1.00 0.00 H new ATOM 0 HG3 MET A 126 -17.486 -24.051 -23.438 1.00 0.00 H new ATOM 0 HE1 MET A 126 -14.455 -24.756 -25.640 1.00 0.00 H new ATOM 0 HE2 MET A 126 -15.284 -24.951 -24.078 1.00 0.00 H new ATOM 0 HE3 MET A 126 -15.765 -25.949 -25.470 1.00 0.00 H new ATOM 1970 N LEU A 127 -18.925 -24.609 -21.439 1.00 0.00 N ATOM 1971 CA LEU A 127 -18.379 -24.614 -20.089 1.00 0.00 C ATOM 1972 C LEU A 127 -19.344 -25.314 -19.133 1.00 0.00 C ATOM 1973 O LEU A 127 -18.914 -25.837 -18.110 1.00 0.00 O ATOM 1974 CB LEU A 127 -18.101 -23.178 -19.641 1.00 0.00 C ATOM 1975 CG LEU A 127 -16.874 -22.580 -20.331 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -16.748 -21.116 -19.918 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -15.593 -23.298 -19.912 1.00 0.00 C ATOM 0 H LEU A 127 -19.230 -23.694 -21.771 1.00 0.00 H new ATOM 0 HA LEU A 127 -17.439 -25.166 -20.079 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.972 -22.559 -19.854 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -17.953 -23.159 -18.561 1.00 0.00 H new ATOM 0 HG LEU A 127 -17.003 -22.686 -21.408 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -15.877 -20.675 -20.402 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -17.644 -20.574 -20.220 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -16.633 -21.052 -18.836 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -14.741 -22.848 -20.421 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -15.461 -23.208 -18.834 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -15.662 -24.352 -20.182 1.00 0.00 H new ATOM 1989 N LEU A 128 -20.642 -25.329 -19.452 1.00 0.00 N ATOM 1990 CA LEU A 128 -21.626 -26.009 -18.628 1.00 0.00 C ATOM 1991 C LEU A 128 -21.418 -27.517 -18.714 1.00 0.00 C ATOM 1992 O LEU A 128 -21.481 -28.207 -17.698 1.00 0.00 O ATOM 1993 CB LEU A 128 -23.026 -25.622 -19.108 1.00 0.00 C ATOM 1994 CG LEU A 128 -24.133 -26.231 -18.238 1.00 0.00 C ATOM 1995 CD1 LEU A 128 -24.046 -25.713 -16.804 1.00 0.00 C ATOM 1996 CD2 LEU A 128 -25.493 -25.855 -18.825 1.00 0.00 C ATOM 0 H LEU A 128 -21.029 -24.874 -20.279 1.00 0.00 H new ATOM 0 HA LEU A 128 -21.513 -25.711 -17.586 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -23.121 -24.536 -19.104 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -23.157 -25.950 -20.139 1.00 0.00 H new ATOM 0 HG LEU A 128 -24.010 -27.314 -18.224 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -24.841 -26.159 -16.207 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -23.079 -25.981 -16.378 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -24.156 -24.629 -16.802 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -26.285 -26.284 -18.212 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -25.595 -24.770 -18.842 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -25.570 -26.242 -19.841 1.00 0.00 H new ATOM 2008 N ASP A 129 -21.172 -28.024 -19.926 1.00 0.00 N ATOM 2009 CA ASP A 129 -20.864 -29.433 -20.128 1.00 0.00 C ATOM 2010 C ASP A 129 -19.585 -29.789 -19.378 1.00 0.00 C ATOM 2011 O ASP A 129 -19.525 -30.803 -18.688 1.00 0.00 O ATOM 2012 CB ASP A 129 -20.667 -29.701 -21.622 1.00 0.00 C ATOM 2013 CG ASP A 129 -20.144 -31.114 -21.863 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -20.755 -32.051 -21.306 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -19.142 -31.244 -22.598 1.00 0.00 O1- ATOM 0 H ASP A 129 -21.182 -27.471 -20.783 1.00 0.00 H new ATOM 0 HA ASP A 129 -21.687 -30.041 -19.752 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -21.613 -29.566 -22.147 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -19.967 -28.975 -22.035 1.00 0.00 H new ATOM 2020 N ILE A 130 -18.562 -28.945 -19.518 1.00 0.00 N ATOM 2021 CA ILE A 130 -17.268 -29.186 -18.907 1.00 0.00 C ATOM 2022 C ILE A 130 -17.389 -29.280 -17.394 1.00 0.00 C ATOM 2023 O ILE A 130 -16.744 -30.122 -16.772 1.00 0.00 O ATOM 2024 CB ILE A 130 -16.328 -28.062 -19.344 1.00 0.00 C ATOM 2025 CG1 ILE A 130 -16.008 -28.260 -20.830 1.00 0.00 C ATOM 2026 CG2 ILE A 130 -15.040 -28.093 -18.533 1.00 0.00 C ATOM 2027 CD1 ILE A 130 -15.371 -27.012 -21.429 1.00 0.00 C ATOM 0 H ILE A 130 -18.613 -28.081 -20.057 1.00 0.00 H new ATOM 0 HA ILE A 130 -16.862 -30.143 -19.235 1.00 0.00 H new ATOM 0 HB ILE A 130 -16.808 -27.097 -19.179 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -15.334 -29.108 -20.949 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -16.922 -28.501 -21.372 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -14.385 -27.285 -18.859 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -15.273 -27.967 -17.476 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -14.539 -29.049 -18.682 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -15.156 -27.184 -22.484 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -16.057 -26.171 -21.331 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -14.444 -26.788 -20.901 1.00 0.00 H new ATOM 2039 N TRP A 131 -18.211 -28.423 -16.789 1.00 0.00 N ATOM 2040 CA TRP A 131 -18.406 -28.469 -15.350 1.00 0.00 C ATOM 2041 C TRP A 131 -19.318 -29.613 -14.914 1.00 0.00 C ATOM 2042 O TRP A 131 -19.215 -30.064 -13.775 1.00 0.00 O ATOM 2043 CB TRP A 131 -18.951 -27.129 -14.867 1.00 0.00 C ATOM 2044 CG TRP A 131 -18.064 -25.954 -15.119 1.00 0.00 C ATOM 2045 CD1 TRP A 131 -16.808 -26.005 -15.613 1.00 0.00 C ATOM 2046 CD2 TRP A 131 -18.338 -24.536 -14.900 1.00 0.00 C ATOM 2047 NE1 TRP A 131 -16.290 -24.735 -15.718 1.00 0.00 N ATOM 2048 CE2 TRP A 131 -17.189 -23.787 -15.275 1.00 0.00 C ATOM 2049 CE3 TRP A 131 -19.442 -23.812 -14.414 1.00 0.00 C ATOM 2050 CZ2 TRP A 131 -17.131 -22.395 -15.166 1.00 0.00 C ATOM 2051 CZ3 TRP A 131 -19.397 -22.413 -14.305 1.00 0.00 C ATOM 2052 CH2 TRP A 131 -18.244 -21.705 -14.673 1.00 0.00 C ATOM 0 H TRP A 131 -18.744 -27.699 -17.270 1.00 0.00 H new ATOM 0 HA TRP A 131 -17.436 -28.659 -14.891 1.00 0.00 H new ATOM 0 HB2 TRP A 131 -19.911 -26.950 -15.351 1.00 0.00 H new ATOM 0 HB3 TRP A 131 -19.142 -27.197 -13.796 1.00 0.00 H new ATOM 0 HD1 TRP A 131 -16.287 -26.911 -15.886 1.00 0.00 H new ATOM 0 HE1 TRP A 131 -15.360 -24.521 -16.078 1.00 0.00 H new ATOM 0 HE3 TRP A 131 -20.337 -24.340 -14.120 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 -16.240 -21.859 -15.458 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 -20.258 -21.877 -13.934 1.00 0.00 H new ATOM 0 HH2 TRP A 131 -18.215 -20.630 -14.576 1.00 0.00 H new