USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=32 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 67 TYR OH : rot 165:sc= -0.025 USER MOD Set 1.2: A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 96 HIS : no HD1:sc=-0.00686 X(o=1.1,f=1.1) USER MOD Set 2.2: A 100 THR OG1 : rot 61:sc= 1.14 USER MOD Set 3.1: A 80 THR OG1 : rot -86:sc= 1.61 USER MOD Set 3.2: A 94 CYS SG : rot -166:sc= -0.867 USER MOD Set 4.1: A 54 SER OG : rot 89:sc= 2.2 USER MOD Set 4.2: A 65 SER OG : rot 169:sc= 1.26 USER MOD Set 5.1: A 53 TYR OH : rot 180:sc= -0.418 USER MOD Set 5.2: A 61 HIS : no HD1:sc= -3.78! C(o=-4.2!,f=-8.5!) USER MOD Single : A 8 GLN : amide:sc= -0.0602 K(o=-0.06,f=-0.56) USER MOD Single : A 9 ASN : amide:sc= 0.645 K(o=0.65,f=-0.081) USER MOD Single : A 13 THR OG1 : rot 96:sc= 1.27 USER MOD Single : A 16 SER OG : rot 170:sc= -0.107 USER MOD Single : A 18 LYS NZ :NH3+ 153:sc= 1.18 (180deg=1.17) USER MOD Single : A 21 LYS NZ :NH3+ 160:sc= 1.13 (180deg=0.755) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 140:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 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 63:sc= 1.15 USER MOD Single : A 34 THR OG1 : rot 70:sc= 1.29 USER MOD Single : A 35 TYR OH : rot 10:sc= 1.22 USER MOD Single : A 39 HIS : no HD1:sc= -1.02 X(o=-1,f=-1.4) USER MOD Single : A 44 SER OG : rot 21:sc= 1.06 USER MOD Single : A 45 LYS NZ :NH3+ -107:sc= -0.371 (180deg=-2.81!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 99:sc= -1.08 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -149:sc= 2.35 (180deg=0.0344) USER MOD Single : A 71 SER OG : rot 82:sc= 1.3 USER MOD Single : A 76 TYR OH : rot 154:sc= 0.601 USER MOD Single : A 82 SER OG : rot -21:sc= 0.656 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0231 USER MOD Single : A 99 ASN : amide:sc= 1.22 K(o=1.2,f=-0.12) USER MOD Single : A 106 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -174:sc= 1.02 (180deg=0.806) USER MOD Single : A 116 SER OG : rot 77:sc= 1.21 USER MOD Single : A 117 ASN : amide:sc= 0.903 K(o=0.9,f=-0.72) USER MOD Single : A 118 GLN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 120 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-4.6!) USER MOD Single : A 121 LYS NZ :NH3+ -137:sc= 2.35 (180deg=1.24) USER MOD Single : A 126 MET CE :methyl -165:sc= -0.0168 (180deg=-0.309) USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 -0.158 -9.644 -2.047 1.00 0.00 N ATOM 79 CA ASP A 6 0.026 -10.751 -2.975 1.00 0.00 C ATOM 80 C ASP A 6 -1.171 -10.734 -3.920 1.00 0.00 C ATOM 81 O ASP A 6 -1.059 -11.065 -5.100 1.00 0.00 O ATOM 82 CB ASP A 6 0.083 -12.093 -2.241 1.00 0.00 C ATOM 83 CG ASP A 6 -1.247 -12.483 -1.595 1.00 0.00 C ATOM 84 OD1 ASP A 6 -1.890 -11.596 -0.991 1.00 0.00 O ATOM 85 OD2 ASP A 6 -1.605 -13.674 -1.715 1.00 0.00 O1- ATOM 0 HA ASP A 6 0.968 -10.637 -3.511 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.381 -12.872 -2.943 1.00 0.00 H new ATOM 0 HB3 ASP A 6 0.854 -12.047 -1.471 1.00 0.00 H new ATOM 90 N PHE A 7 -2.316 -10.336 -3.359 1.00 0.00 N ATOM 91 CA PHE A 7 -3.585 -10.242 -4.041 1.00 0.00 C ATOM 92 C PHE A 7 -3.505 -9.209 -5.158 1.00 0.00 C ATOM 93 O PHE A 7 -4.163 -9.357 -6.181 1.00 0.00 O ATOM 94 CB PHE A 7 -4.635 -9.805 -3.017 1.00 0.00 C ATOM 95 CG PHE A 7 -6.077 -10.035 -3.412 1.00 0.00 C ATOM 96 CD1 PHE A 7 -6.410 -10.805 -4.536 1.00 0.00 C ATOM 97 CD2 PHE A 7 -7.094 -9.469 -2.629 1.00 0.00 C ATOM 98 CE1 PHE A 7 -7.752 -11.025 -4.870 1.00 0.00 C ATOM 99 CE2 PHE A 7 -8.437 -9.685 -2.963 1.00 0.00 C ATOM 100 CZ PHE A 7 -8.762 -10.469 -4.077 1.00 0.00 C ATOM 0 H PHE A 7 -2.374 -10.062 -2.378 1.00 0.00 H new ATOM 0 HA PHE A 7 -3.848 -11.205 -4.479 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -4.445 -10.333 -2.083 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -4.498 -8.742 -2.816 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -5.628 -11.230 -5.147 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -6.842 -8.867 -1.769 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -8.006 -11.620 -5.735 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -9.221 -9.248 -2.362 1.00 0.00 H new ATOM 0 HZ PHE A 7 -9.798 -10.645 -4.325 1.00 0.00 H new ATOM 110 N GLN A 8 -2.697 -8.165 -4.953 1.00 0.00 N ATOM 111 CA GLN A 8 -2.528 -7.063 -5.887 1.00 0.00 C ATOM 112 C GLN A 8 -2.284 -7.559 -7.309 1.00 0.00 C ATOM 113 O GLN A 8 -2.804 -6.976 -8.258 1.00 0.00 O ATOM 114 CB GLN A 8 -1.335 -6.228 -5.414 1.00 0.00 C ATOM 115 CG GLN A 8 -1.006 -5.116 -6.411 1.00 0.00 C ATOM 116 CD GLN A 8 -2.163 -4.138 -6.561 1.00 0.00 C ATOM 117 OE1 GLN A 8 -2.875 -3.856 -5.602 1.00 0.00 O ATOM 118 NE2 GLN A 8 -2.358 -3.613 -7.768 1.00 0.00 N ATOM 0 H GLN A 8 -2.131 -8.066 -4.110 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.440 -6.467 -5.908 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -1.557 -5.792 -4.440 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.466 -6.873 -5.285 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -0.117 -4.580 -6.079 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.771 -5.554 -7.381 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -1.745 -3.871 -8.542 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.120 -2.952 -7.920 1.00 0.00 H new ATOM 127 N ASN A 9 -1.500 -8.627 -7.460 1.00 0.00 N ATOM 128 CA ASN A 9 -1.168 -9.165 -8.771 1.00 0.00 C ATOM 129 C ASN A 9 -2.388 -9.849 -9.383 1.00 0.00 C ATOM 130 O ASN A 9 -2.589 -9.799 -10.597 1.00 0.00 O ATOM 131 CB ASN A 9 -0.009 -10.149 -8.604 1.00 0.00 C ATOM 132 CG ASN A 9 1.102 -9.556 -7.754 1.00 0.00 C ATOM 133 OD1 ASN A 9 1.931 -8.798 -8.249 1.00 0.00 O ATOM 134 ND2 ASN A 9 1.125 -9.899 -6.468 1.00 0.00 N ATOM 0 H ASN A 9 -1.082 -9.137 -6.681 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.869 -8.364 -9.447 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -0.372 -11.067 -8.142 1.00 0.00 H new ATOM 0 HB3 ASN A 9 0.385 -10.420 -9.584 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.851 -9.529 -5.854 1.00 0.00 H new ATOM 0 HD22 ASN A 9 0.417 -10.532 -6.096 1.00 0.00 H new ATOM 141 N PHE A 10 -3.202 -10.487 -8.540 1.00 0.00 N ATOM 142 CA PHE A 10 -4.422 -11.154 -8.949 1.00 0.00 C ATOM 143 C PHE A 10 -5.477 -10.112 -9.307 1.00 0.00 C ATOM 144 O PHE A 10 -6.230 -10.288 -10.265 1.00 0.00 O ATOM 145 CB PHE A 10 -4.895 -12.002 -7.769 1.00 0.00 C ATOM 146 CG PHE A 10 -5.670 -13.245 -8.136 1.00 0.00 C ATOM 147 CD1 PHE A 10 -6.914 -13.154 -8.775 1.00 0.00 C ATOM 148 CD2 PHE A 10 -5.134 -14.500 -7.830 1.00 0.00 C ATOM 149 CE1 PHE A 10 -7.620 -14.320 -9.108 1.00 0.00 C ATOM 150 CE2 PHE A 10 -5.830 -15.666 -8.168 1.00 0.00 C ATOM 151 CZ PHE A 10 -7.076 -15.580 -8.807 1.00 0.00 C ATOM 0 H PHE A 10 -3.021 -10.551 -7.538 1.00 0.00 H new ATOM 0 HA PHE A 10 -4.252 -11.782 -9.824 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -4.025 -12.297 -7.183 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.518 -11.382 -7.125 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.330 -12.186 -9.011 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -4.179 -14.570 -7.331 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -8.581 -14.249 -9.595 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -5.408 -16.633 -7.937 1.00 0.00 H new ATOM 0 HZ PHE A 10 -7.615 -16.479 -9.067 1.00 0.00 H new ATOM 161 N VAL A 11 -5.526 -9.021 -8.530 1.00 0.00 N ATOM 162 CA VAL A 11 -6.458 -7.931 -8.767 1.00 0.00 C ATOM 163 C VAL A 11 -6.093 -7.257 -10.083 1.00 0.00 C ATOM 164 O VAL A 11 -6.948 -7.091 -10.945 1.00 0.00 O ATOM 165 CB VAL A 11 -6.400 -6.916 -7.616 1.00 0.00 C ATOM 166 CG1 VAL A 11 -7.299 -5.717 -7.917 1.00 0.00 C ATOM 167 CG2 VAL A 11 -6.851 -7.538 -6.292 1.00 0.00 C ATOM 0 H VAL A 11 -4.918 -8.878 -7.723 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.474 -8.322 -8.821 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.362 -6.597 -7.524 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.247 -5.007 -7.092 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -6.964 -5.233 -8.834 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.328 -6.055 -8.040 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.796 -6.790 -5.501 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -7.878 -7.891 -6.387 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -6.200 -8.377 -6.044 1.00 0.00 H new ATOM 177 N ALA A 12 -4.824 -6.866 -10.245 1.00 0.00 N ATOM 178 CA ALA A 12 -4.353 -6.215 -11.454 1.00 0.00 C ATOM 179 C ALA A 12 -4.536 -7.101 -12.685 1.00 0.00 C ATOM 180 O ALA A 12 -4.713 -6.580 -13.785 1.00 0.00 O ATOM 181 CB ALA A 12 -2.878 -5.859 -11.276 1.00 0.00 C ATOM 0 H ALA A 12 -4.101 -6.996 -9.537 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.944 -5.314 -11.617 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.511 -5.369 -12.178 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.766 -5.186 -10.426 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.303 -6.768 -11.097 1.00 0.00 H new ATOM 187 N THR A 13 -4.498 -8.429 -12.531 1.00 0.00 N ATOM 188 CA THR A 13 -4.743 -9.315 -13.661 1.00 0.00 C ATOM 189 C THR A 13 -6.238 -9.306 -13.988 1.00 0.00 C ATOM 190 O THR A 13 -6.630 -9.364 -15.153 1.00 0.00 O ATOM 191 CB THR A 13 -4.251 -10.727 -13.336 1.00 0.00 C ATOM 192 OG1 THR A 13 -2.886 -10.699 -12.973 1.00 0.00 O ATOM 193 CG2 THR A 13 -4.389 -11.627 -14.560 1.00 0.00 C ATOM 0 H THR A 13 -4.303 -8.902 -11.649 1.00 0.00 H new ATOM 0 HA THR A 13 -4.193 -8.967 -14.535 1.00 0.00 H new ATOM 0 HB THR A 13 -4.853 -11.110 -12.512 1.00 0.00 H new ATOM 0 HG1 THR A 13 -2.808 -10.664 -11.997 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.036 -12.629 -14.317 1.00 0.00 H new ATOM 0 HG22 THR A 13 -5.436 -11.674 -14.861 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.794 -11.222 -15.379 1.00 0.00 H new ATOM 201 N LEU A 14 -7.083 -9.228 -12.957 1.00 0.00 N ATOM 202 CA LEU A 14 -8.521 -9.167 -13.158 1.00 0.00 C ATOM 203 C LEU A 14 -8.891 -7.856 -13.842 1.00 0.00 C ATOM 204 O LEU A 14 -9.660 -7.831 -14.800 1.00 0.00 O ATOM 205 CB LEU A 14 -9.225 -9.232 -11.809 1.00 0.00 C ATOM 206 CG LEU A 14 -10.726 -9.407 -12.034 1.00 0.00 C ATOM 207 CD1 LEU A 14 -11.070 -10.897 -12.036 1.00 0.00 C ATOM 208 CD2 LEU A 14 -11.482 -8.668 -10.932 1.00 0.00 C ATOM 0 H LEU A 14 -6.791 -9.206 -11.980 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.829 -10.007 -13.781 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.834 -10.062 -11.221 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.034 -8.321 -11.241 1.00 0.00 H new ATOM 0 HG LEU A 14 -11.018 -8.989 -12.998 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.141 -11.023 -12.196 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.522 -11.396 -12.835 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.793 -11.336 -11.078 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.555 -8.787 -11.084 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -11.205 -9.080 -9.962 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.227 -7.609 -10.963 1.00 0.00 H new ATOM 220 N GLU A 15 -8.322 -6.765 -13.327 1.00 0.00 N ATOM 221 CA GLU A 15 -8.513 -5.427 -13.845 1.00 0.00 C ATOM 222 C GLU A 15 -7.989 -5.364 -15.278 1.00 0.00 C ATOM 223 O GLU A 15 -8.461 -4.573 -16.092 1.00 0.00 O ATOM 224 CB GLU A 15 -7.734 -4.485 -12.928 1.00 0.00 C ATOM 225 CG GLU A 15 -8.356 -4.460 -11.526 1.00 0.00 C ATOM 226 CD GLU A 15 -9.647 -3.643 -11.478 1.00 0.00 C ATOM 227 OE1 GLU A 15 -10.499 -3.975 -10.625 1.00 0.00 O ATOM 228 OE2 GLU A 15 -9.773 -2.697 -12.289 1.00 0.00 O1- ATOM 0 H GLU A 15 -7.702 -6.798 -12.518 1.00 0.00 H new ATOM 0 HA GLU A 15 -9.565 -5.142 -13.866 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -6.695 -4.807 -12.865 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -7.731 -3.479 -13.348 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -8.563 -5.481 -11.204 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -7.638 -4.043 -10.820 1.00 0.00 H new ATOM 235 N SER A 16 -7.004 -6.212 -15.581 1.00 0.00 N ATOM 236 CA SER A 16 -6.451 -6.301 -16.917 1.00 0.00 C ATOM 237 C SER A 16 -7.464 -6.951 -17.855 1.00 0.00 C ATOM 238 O SER A 16 -7.451 -6.664 -19.047 1.00 0.00 O ATOM 239 CB SER A 16 -5.136 -7.076 -16.886 1.00 0.00 C ATOM 240 OG SER A 16 -4.603 -7.175 -18.189 1.00 0.00 O ATOM 0 H SER A 16 -6.576 -6.848 -14.908 1.00 0.00 H new ATOM 0 HA SER A 16 -6.240 -5.300 -17.293 1.00 0.00 H new ATOM 0 HB2 SER A 16 -4.424 -6.575 -16.230 1.00 0.00 H new ATOM 0 HB3 SER A 16 -5.301 -8.072 -16.475 1.00 0.00 H new ATOM 0 HG SER A 16 -3.690 -7.528 -18.143 1.00 0.00 H new ATOM 246 N PHE A 17 -8.344 -7.820 -17.344 1.00 0.00 N ATOM 247 CA PHE A 17 -9.444 -8.315 -18.158 1.00 0.00 C ATOM 248 C PHE A 17 -10.495 -7.229 -18.374 1.00 0.00 C ATOM 249 O PHE A 17 -11.089 -7.162 -19.446 1.00 0.00 O ATOM 250 CB PHE A 17 -10.148 -9.491 -17.492 1.00 0.00 C ATOM 251 CG PHE A 17 -9.269 -10.640 -17.076 1.00 0.00 C ATOM 252 CD1 PHE A 17 -9.407 -11.161 -15.785 1.00 0.00 C ATOM 253 CD2 PHE A 17 -8.332 -11.184 -17.963 1.00 0.00 C ATOM 254 CE1 PHE A 17 -8.593 -12.215 -15.367 1.00 0.00 C ATOM 255 CE2 PHE A 17 -7.534 -12.255 -17.545 1.00 0.00 C ATOM 256 CZ PHE A 17 -7.653 -12.763 -16.247 1.00 0.00 C ATOM 0 H PHE A 17 -8.313 -8.184 -16.392 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.006 -8.625 -19.107 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -10.671 -9.123 -16.610 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.906 -9.870 -18.177 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.143 -10.748 -15.112 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -8.226 -10.781 -18.959 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.689 -12.607 -14.365 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.822 -12.692 -18.229 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.020 -13.577 -15.925 1.00 0.00 H new ATOM 266 N LYS A 18 -10.724 -6.379 -17.365 1.00 0.00 N ATOM 267 CA LYS A 18 -11.669 -5.277 -17.494 1.00 0.00 C ATOM 268 C LYS A 18 -11.191 -4.316 -18.577 1.00 0.00 C ATOM 269 O LYS A 18 -11.985 -3.614 -19.200 1.00 0.00 O ATOM 270 CB LYS A 18 -11.814 -4.529 -16.168 1.00 0.00 C ATOM 271 CG LYS A 18 -12.123 -5.495 -15.025 1.00 0.00 C ATOM 272 CD LYS A 18 -12.471 -4.712 -13.762 1.00 0.00 C ATOM 273 CE LYS A 18 -12.651 -5.673 -12.590 1.00 0.00 C ATOM 274 NZ LYS A 18 -12.844 -4.946 -11.322 1.00 0.00 N1+ ATOM 0 H LYS A 18 -10.266 -6.438 -16.455 1.00 0.00 H new ATOM 0 HA LYS A 18 -12.642 -5.685 -17.769 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -10.895 -3.985 -15.951 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.610 -3.789 -16.249 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.954 -6.145 -15.301 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -11.263 -6.139 -14.839 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -11.681 -3.995 -13.538 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.385 -4.140 -13.918 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -13.510 -6.318 -12.775 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.777 -6.320 -12.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -13.395 -5.534 -10.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.918 -4.731 -10.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.355 -4.059 -11.505 1.00 0.00 H new ATOM 288 N ASP A 19 -9.876 -4.304 -18.783 1.00 0.00 N ATOM 289 CA ASP A 19 -9.230 -3.511 -19.827 1.00 0.00 C ATOM 290 C ASP A 19 -9.399 -4.148 -21.216 1.00 0.00 C ATOM 291 O ASP A 19 -9.173 -3.501 -22.240 1.00 0.00 O ATOM 292 CB ASP A 19 -7.749 -3.356 -19.479 1.00 0.00 C ATOM 293 CG ASP A 19 -7.042 -2.297 -20.321 1.00 0.00 C ATOM 294 OD1 ASP A 19 -5.794 -2.366 -20.374 1.00 0.00 O ATOM 295 OD2 ASP A 19 -7.742 -1.438 -20.896 1.00 0.00 O1- ATOM 0 H ASP A 19 -9.221 -4.851 -18.224 1.00 0.00 H new ATOM 0 HA ASP A 19 -9.707 -2.532 -19.871 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -7.655 -3.095 -18.425 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.248 -4.314 -19.616 1.00 0.00 H new ATOM 300 N LEU A 20 -9.797 -5.423 -21.275 1.00 0.00 N ATOM 301 CA LEU A 20 -9.964 -6.107 -22.543 1.00 0.00 C ATOM 302 C LEU A 20 -11.350 -5.863 -23.124 1.00 0.00 C ATOM 303 O LEU A 20 -12.343 -5.766 -22.403 1.00 0.00 O ATOM 304 CB LEU A 20 -9.694 -7.606 -22.397 1.00 0.00 C ATOM 305 CG LEU A 20 -8.221 -7.897 -22.120 1.00 0.00 C ATOM 306 CD1 LEU A 20 -8.031 -9.391 -21.883 1.00 0.00 C ATOM 307 CD2 LEU A 20 -7.342 -7.495 -23.303 1.00 0.00 C ATOM 0 H LEU A 20 -10.007 -5.994 -20.456 1.00 0.00 H new ATOM 0 HA LEU A 20 -9.232 -5.696 -23.238 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.302 -8.007 -21.586 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.000 -8.120 -23.308 1.00 0.00 H new ATOM 0 HG LEU A 20 -7.931 -7.320 -21.242 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -6.979 -9.597 -21.685 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -8.629 -9.702 -21.026 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -8.349 -9.943 -22.767 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.300 -7.715 -23.073 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.645 -8.055 -24.188 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.454 -6.428 -23.493 1.00 0.00 H new ATOM 319 N LYS A 21 -11.398 -5.769 -24.454 1.00 0.00 N ATOM 320 CA LYS A 21 -12.626 -5.594 -25.214 1.00 0.00 C ATOM 321 C LYS A 21 -13.274 -6.964 -25.429 1.00 0.00 C ATOM 322 O LYS A 21 -14.160 -7.114 -26.266 1.00 0.00 O ATOM 323 CB LYS A 21 -12.300 -4.902 -26.545 1.00 0.00 C ATOM 324 CG LYS A 21 -12.007 -3.403 -26.400 1.00 0.00 C ATOM 325 CD LYS A 21 -10.824 -3.068 -25.483 1.00 0.00 C ATOM 326 CE LYS A 21 -9.546 -3.780 -25.922 1.00 0.00 C ATOM 327 NZ LYS A 21 -8.435 -3.523 -24.984 1.00 0.00 N1+ ATOM 0 H LYS A 21 -10.564 -5.814 -25.040 1.00 0.00 H new ATOM 0 HA LYS A 21 -13.332 -4.964 -24.673 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.437 -5.391 -26.998 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.138 -5.036 -27.230 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.812 -2.987 -27.389 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.899 -2.908 -26.016 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.658 -1.991 -25.483 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.066 -3.353 -24.459 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.729 -4.853 -25.986 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.266 -3.445 -26.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.707 -4.256 -25.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.021 -2.590 -25.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -8.793 -3.541 -24.008 1.00 0.00 H new ATOM 341 N SER A 22 -12.815 -7.958 -24.661 1.00 0.00 N ATOM 342 CA SER A 22 -13.226 -9.348 -24.772 1.00 0.00 C ATOM 343 C SER A 22 -13.351 -10.015 -23.400 1.00 0.00 C ATOM 344 O SER A 22 -14.110 -10.969 -23.252 1.00 0.00 O ATOM 345 CB SER A 22 -12.160 -10.071 -25.593 1.00 0.00 C ATOM 346 OG SER A 22 -10.932 -9.985 -24.906 1.00 0.00 O ATOM 0 H SER A 22 -12.126 -7.805 -23.924 1.00 0.00 H new ATOM 0 HA SER A 22 -14.206 -9.399 -25.246 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.439 -11.114 -25.741 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.073 -9.621 -26.582 1.00 0.00 H new ATOM 0 HG SER A 22 -10.237 -10.446 -25.420 1.00 0.00 H new ATOM 352 N GLY A 23 -12.615 -9.524 -22.395 1.00 0.00 N ATOM 353 CA GLY A 23 -12.696 -10.004 -21.020 1.00 0.00 C ATOM 354 C GLY A 23 -11.999 -11.345 -20.811 1.00 0.00 C ATOM 355 O GLY A 23 -11.741 -11.727 -19.673 1.00 0.00 O ATOM 0 H GLY A 23 -11.938 -8.771 -22.522 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.251 -9.263 -20.356 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.744 -10.098 -20.736 1.00 0.00 H new ATOM 359 N ILE A 24 -11.696 -12.055 -21.899 1.00 0.00 N ATOM 360 CA ILE A 24 -10.977 -13.315 -21.856 1.00 0.00 C ATOM 361 C ILE A 24 -9.495 -13.077 -22.130 1.00 0.00 C ATOM 362 O ILE A 24 -9.144 -12.178 -22.893 1.00 0.00 O ATOM 363 CB ILE A 24 -11.561 -14.260 -22.909 1.00 0.00 C ATOM 364 CG1 ILE A 24 -13.009 -14.634 -22.566 1.00 0.00 C ATOM 365 CG2 ILE A 24 -10.703 -15.523 -23.002 1.00 0.00 C ATOM 366 CD1 ILE A 24 -13.723 -15.244 -23.773 1.00 0.00 C ATOM 0 H ILE A 24 -11.949 -11.762 -22.843 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.081 -13.763 -20.868 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.560 -13.749 -23.872 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -13.018 -15.343 -21.738 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.547 -13.747 -22.232 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.122 -16.193 -23.753 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.686 -15.252 -23.285 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.689 -16.025 -22.035 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -14.747 -15.499 -23.499 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.735 -14.524 -24.591 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.197 -16.145 -24.090 1.00 0.00 H new ATOM 378 N SER A 25 -8.624 -13.878 -21.511 1.00 0.00 N ATOM 379 CA SER A 25 -7.204 -13.877 -21.827 1.00 0.00 C ATOM 380 C SER A 25 -6.558 -15.114 -21.217 1.00 0.00 C ATOM 381 O SER A 25 -6.250 -15.125 -20.029 1.00 0.00 O ATOM 382 CB SER A 25 -6.539 -12.616 -21.288 1.00 0.00 C ATOM 383 OG SER A 25 -5.159 -12.688 -21.564 1.00 0.00 O ATOM 0 H SER A 25 -8.887 -14.540 -20.781 1.00 0.00 H new ATOM 0 HA SER A 25 -7.075 -13.893 -22.909 1.00 0.00 H new ATOM 0 HB2 SER A 25 -6.973 -11.730 -21.752 1.00 0.00 H new ATOM 0 HB3 SER A 25 -6.707 -12.528 -20.215 1.00 0.00 H new ATOM 0 HG SER A 25 -4.834 -11.806 -21.841 1.00 0.00 H new ATOM 389 N GLY A 26 -6.352 -16.155 -22.027 1.00 0.00 N ATOM 390 CA GLY A 26 -5.891 -17.432 -21.520 1.00 0.00 C ATOM 391 C GLY A 26 -4.599 -17.313 -20.723 1.00 0.00 C ATOM 392 O GLY A 26 -4.519 -17.847 -19.621 1.00 0.00 O ATOM 0 H GLY A 26 -6.500 -16.130 -23.036 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -6.664 -17.869 -20.888 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.737 -18.116 -22.355 1.00 0.00 H new ATOM 396 N SER A 27 -3.585 -16.624 -21.251 1.00 0.00 N ATOM 397 CA SER A 27 -2.308 -16.524 -20.563 1.00 0.00 C ATOM 398 C SER A 27 -2.459 -15.802 -19.229 1.00 0.00 C ATOM 399 O SER A 27 -1.884 -16.241 -18.235 1.00 0.00 O ATOM 400 CB SER A 27 -1.299 -15.808 -21.457 1.00 0.00 C ATOM 401 OG SER A 27 -0.846 -16.703 -22.455 1.00 0.00 O ATOM 0 H SER A 27 -3.627 -16.133 -22.144 1.00 0.00 H new ATOM 0 HA SER A 27 -1.944 -17.529 -20.352 1.00 0.00 H new ATOM 0 HB2 SER A 27 -1.759 -14.933 -21.917 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.458 -15.450 -20.863 1.00 0.00 H new ATOM 0 HG SER A 27 -0.199 -16.248 -23.033 1.00 0.00 H new ATOM 407 N ARG A 28 -3.222 -14.707 -19.195 1.00 0.00 N ATOM 408 CA ARG A 28 -3.434 -13.938 -17.976 1.00 0.00 C ATOM 409 C ARG A 28 -4.288 -14.727 -16.988 1.00 0.00 C ATOM 410 O ARG A 28 -4.006 -14.743 -15.791 1.00 0.00 O ATOM 411 CB ARG A 28 -4.125 -12.625 -18.338 1.00 0.00 C ATOM 412 CG ARG A 28 -3.185 -11.739 -19.156 1.00 0.00 C ATOM 413 CD ARG A 28 -3.885 -10.457 -19.606 1.00 0.00 C ATOM 414 NE ARG A 28 -3.191 -9.883 -20.764 1.00 0.00 N ATOM 415 CZ ARG A 28 -3.448 -8.694 -21.317 1.00 0.00 C ATOM 416 NH1 ARG A 28 -4.389 -7.888 -20.828 1.00 0.00 N1+ ATOM 417 NH2 ARG A 28 -2.747 -8.308 -22.383 1.00 0.00 N ATOM 0 H ARG A 28 -3.707 -14.333 -20.011 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.473 -13.733 -17.504 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -5.032 -12.828 -18.908 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.429 -12.104 -17.430 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -2.308 -11.487 -18.560 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.831 -12.288 -20.028 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.922 -10.671 -19.863 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -3.902 -9.736 -18.788 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.447 -10.440 -21.184 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -4.932 -8.174 -20.013 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.566 -6.985 -21.268 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -2.025 -8.918 -22.767 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.933 -7.403 -22.815 1.00 0.00 H new ATOM 431 N ILE A 29 -5.336 -15.385 -17.490 1.00 0.00 N ATOM 432 CA ILE A 29 -6.162 -16.248 -16.674 1.00 0.00 C ATOM 433 C ILE A 29 -5.276 -17.329 -16.064 1.00 0.00 C ATOM 434 O ILE A 29 -5.431 -17.656 -14.890 1.00 0.00 O ATOM 435 CB ILE A 29 -7.273 -16.844 -17.553 1.00 0.00 C ATOM 436 CG1 ILE A 29 -8.294 -15.746 -17.884 1.00 0.00 C ATOM 437 CG2 ILE A 29 -7.954 -18.039 -16.877 1.00 0.00 C ATOM 438 CD1 ILE A 29 -9.358 -16.229 -18.870 1.00 0.00 C ATOM 0 H ILE A 29 -5.626 -15.329 -18.466 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.635 -15.696 -15.862 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.826 -17.217 -18.475 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.776 -15.411 -16.966 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.776 -14.884 -18.304 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.733 -18.431 -17.531 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.216 -18.817 -16.684 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.398 -17.719 -15.934 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -10.058 -15.419 -19.075 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.879 -16.539 -19.799 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.896 -17.074 -18.440 1.00 0.00 H new ATOM 450 N LYS A 30 -4.346 -17.884 -16.852 1.00 0.00 N ATOM 451 CA LYS A 30 -3.410 -18.892 -16.376 1.00 0.00 C ATOM 452 C LYS A 30 -2.392 -18.310 -15.397 1.00 0.00 C ATOM 453 O LYS A 30 -1.828 -19.075 -14.614 1.00 0.00 O ATOM 454 CB LYS A 30 -2.715 -19.552 -17.570 1.00 0.00 C ATOM 455 CG LYS A 30 -3.654 -20.585 -18.201 1.00 0.00 C ATOM 456 CD LYS A 30 -3.094 -21.174 -19.499 1.00 0.00 C ATOM 457 CE LYS A 30 -3.268 -20.177 -20.647 1.00 0.00 C ATOM 458 NZ LYS A 30 -2.877 -20.757 -21.944 1.00 0.00 N1+ ATOM 0 H LYS A 30 -4.227 -17.642 -17.836 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.972 -19.648 -15.828 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.440 -18.797 -18.307 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.792 -20.033 -17.247 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.834 -21.390 -17.489 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.618 -20.118 -18.404 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.038 -21.414 -19.373 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.607 -22.106 -19.736 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.308 -19.854 -20.693 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.667 -19.289 -20.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -3.010 -20.050 -22.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.877 -21.042 -21.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.467 -21.589 -22.144 1.00 0.00 H new ATOM 472 N LYS A 31 -2.140 -16.994 -15.408 1.00 0.00 N ATOM 473 CA LYS A 31 -1.249 -16.395 -14.419 1.00 0.00 C ATOM 474 C LYS A 31 -1.892 -16.487 -13.041 1.00 0.00 C ATOM 475 O LYS A 31 -1.297 -17.045 -12.118 1.00 0.00 O ATOM 476 CB LYS A 31 -0.925 -14.928 -14.732 1.00 0.00 C ATOM 477 CG LYS A 31 -0.077 -14.702 -15.988 1.00 0.00 C ATOM 478 CD LYS A 31 1.194 -15.554 -16.043 1.00 0.00 C ATOM 479 CE LYS A 31 0.919 -16.929 -16.658 1.00 0.00 C ATOM 480 NZ LYS A 31 2.155 -17.722 -16.765 1.00 0.00 N1+ ATOM 0 H LYS A 31 -2.536 -16.337 -16.081 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.311 -16.949 -14.445 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.861 -14.381 -14.842 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.403 -14.497 -13.878 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.684 -14.917 -16.867 1.00 0.00 H new ATOM 0 HG3 LYS A 31 0.201 -13.649 -16.042 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.955 -15.038 -16.628 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.595 -15.677 -15.037 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.192 -17.465 -16.047 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.476 -16.806 -17.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.938 -18.648 -17.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.838 -17.220 -17.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.563 -17.858 -15.818 1.00 0.00 H new ATOM 494 N LEU A 32 -3.104 -15.941 -12.893 1.00 0.00 N ATOM 495 CA LEU A 32 -3.755 -15.947 -11.588 1.00 0.00 C ATOM 496 C LEU A 32 -4.200 -17.358 -11.207 1.00 0.00 C ATOM 497 O LEU A 32 -4.318 -17.661 -10.021 1.00 0.00 O ATOM 498 CB LEU A 32 -4.903 -14.928 -11.569 1.00 0.00 C ATOM 499 CG LEU A 32 -5.982 -15.165 -12.635 1.00 0.00 C ATOM 500 CD1 LEU A 32 -7.022 -16.208 -12.229 1.00 0.00 C ATOM 501 CD2 LEU A 32 -6.755 -13.870 -12.853 1.00 0.00 C ATOM 0 H LEU A 32 -3.639 -15.501 -13.642 1.00 0.00 H new ATOM 0 HA LEU A 32 -3.040 -15.639 -10.825 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.372 -14.946 -10.585 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.488 -13.929 -11.706 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.455 -15.514 -13.523 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.753 -16.324 -13.029 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.528 -17.163 -12.047 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.528 -15.883 -11.320 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.524 -14.028 -13.609 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.223 -13.564 -11.917 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -6.071 -13.090 -13.189 1.00 0.00 H new ATOM 513 N THR A 33 -4.445 -18.224 -12.196 1.00 0.00 N ATOM 514 CA THR A 33 -4.850 -19.598 -11.930 1.00 0.00 C ATOM 515 C THR A 33 -3.668 -20.392 -11.381 1.00 0.00 C ATOM 516 O THR A 33 -3.848 -21.257 -10.526 1.00 0.00 O ATOM 517 CB THR A 33 -5.323 -20.238 -13.233 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.470 -19.579 -13.711 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.675 -21.713 -13.061 1.00 0.00 C ATOM 0 H THR A 33 -4.368 -17.992 -13.186 1.00 0.00 H new ATOM 0 HA THR A 33 -5.656 -19.602 -11.196 1.00 0.00 H new ATOM 0 HB THR A 33 -4.495 -20.149 -13.937 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.249 -18.647 -13.919 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.006 -22.122 -14.016 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.797 -22.259 -12.717 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.475 -21.813 -12.327 1.00 0.00 H new ATOM 527 N THR A 34 -2.459 -20.096 -11.871 1.00 0.00 N ATOM 528 CA THR A 34 -1.271 -20.818 -11.444 1.00 0.00 C ATOM 529 C THR A 34 -0.878 -20.406 -10.031 1.00 0.00 C ATOM 530 O THR A 34 -0.437 -21.246 -9.250 1.00 0.00 O ATOM 531 CB THR A 34 -0.131 -20.565 -12.432 1.00 0.00 C ATOM 532 OG1 THR A 34 -0.479 -21.070 -13.702 1.00 0.00 O ATOM 533 CG2 THR A 34 1.139 -21.261 -11.951 1.00 0.00 C ATOM 0 H THR A 34 -2.285 -19.364 -12.560 1.00 0.00 H new ATOM 0 HA THR A 34 -1.485 -21.887 -11.430 1.00 0.00 H new ATOM 0 HB THR A 34 0.044 -19.491 -12.498 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.186 -20.515 -14.092 1.00 0.00 H new ATOM 0 HG21 THR A 34 1.946 -21.076 -12.660 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.419 -20.871 -10.972 1.00 0.00 H new ATOM 0 HG23 THR A 34 0.960 -22.334 -11.877 1.00 0.00 H new ATOM 541 N TYR A 35 -1.033 -19.123 -9.689 1.00 0.00 N ATOM 542 CA TYR A 35 -0.741 -18.695 -8.327 1.00 0.00 C ATOM 543 C TYR A 35 -1.767 -19.280 -7.363 1.00 0.00 C ATOM 544 O TYR A 35 -1.437 -19.587 -6.220 1.00 0.00 O ATOM 545 CB TYR A 35 -0.748 -17.167 -8.231 1.00 0.00 C ATOM 546 CG TYR A 35 -0.572 -16.675 -6.804 1.00 0.00 C ATOM 547 CD1 TYR A 35 -1.564 -15.882 -6.204 1.00 0.00 C ATOM 548 CD2 TYR A 35 0.581 -17.014 -6.081 1.00 0.00 C ATOM 549 CE1 TYR A 35 -1.414 -15.438 -4.881 1.00 0.00 C ATOM 550 CE2 TYR A 35 0.736 -16.578 -4.758 1.00 0.00 C ATOM 551 CZ TYR A 35 -0.264 -15.791 -4.152 1.00 0.00 C ATOM 552 OH TYR A 35 -0.106 -15.380 -2.860 1.00 0.00 O ATOM 0 H TYR A 35 -1.350 -18.386 -10.319 1.00 0.00 H new ATOM 0 HA TYR A 35 0.251 -19.057 -8.056 1.00 0.00 H new ATOM 0 HB2 TYR A 35 0.051 -16.763 -8.853 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -1.687 -16.785 -8.631 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -2.447 -15.612 -6.764 1.00 0.00 H new ATOM 0 HD2 TYR A 35 1.351 -17.612 -6.545 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -2.179 -14.827 -4.424 1.00 0.00 H new ATOM 0 HE2 TYR A 35 1.623 -16.845 -4.202 1.00 0.00 H new ATOM 0 HH TYR A 35 -0.943 -14.986 -2.537 1.00 0.00 H new ATOM 562 N ALA A 36 -3.011 -19.440 -7.822 1.00 0.00 N ATOM 563 CA ALA A 36 -4.058 -20.026 -7.012 1.00 0.00 C ATOM 564 C ALA A 36 -3.797 -21.512 -6.790 1.00 0.00 C ATOM 565 O ALA A 36 -4.129 -22.038 -5.731 1.00 0.00 O ATOM 566 CB ALA A 36 -5.383 -19.821 -7.746 1.00 0.00 C ATOM 0 H ALA A 36 -3.309 -19.167 -8.758 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.088 -19.549 -6.032 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.194 -20.253 -7.160 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.562 -18.755 -7.883 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.339 -20.309 -8.719 1.00 0.00 H new ATOM 572 N LEU A 37 -3.205 -22.188 -7.781 1.00 0.00 N ATOM 573 CA LEU A 37 -2.864 -23.598 -7.671 1.00 0.00 C ATOM 574 C LEU A 37 -1.671 -23.792 -6.746 1.00 0.00 C ATOM 575 O LEU A 37 -1.642 -24.740 -5.967 1.00 0.00 O ATOM 576 CB LEU A 37 -2.514 -24.114 -9.066 1.00 0.00 C ATOM 577 CG LEU A 37 -3.766 -24.553 -9.833 1.00 0.00 C ATOM 578 CD1 LEU A 37 -3.356 -24.824 -11.281 1.00 0.00 C ATOM 579 CD2 LEU A 37 -4.374 -25.820 -9.224 1.00 0.00 C ATOM 0 H LEU A 37 -2.952 -21.769 -8.676 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.710 -24.146 -7.257 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.999 -23.333 -9.625 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.824 -24.954 -8.982 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.519 -23.767 -9.780 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.228 -25.139 -11.853 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.944 -23.915 -11.719 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.603 -25.612 -11.305 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.261 -26.106 -9.790 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.643 -26.628 -9.261 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.651 -25.628 -8.187 1.00 0.00 H new ATOM 591 N ASP A 38 -0.689 -22.894 -6.834 1.00 0.00 N ATOM 592 CA ASP A 38 0.467 -22.921 -5.956 1.00 0.00 C ATOM 593 C ASP A 38 0.049 -22.690 -4.499 1.00 0.00 C ATOM 594 O ASP A 38 0.737 -23.137 -3.583 1.00 0.00 O ATOM 595 CB ASP A 38 1.443 -21.835 -6.425 1.00 0.00 C ATOM 596 CG ASP A 38 2.812 -21.922 -5.754 1.00 0.00 C ATOM 597 OD1 ASP A 38 3.507 -20.878 -5.747 1.00 0.00 O ATOM 598 OD2 ASP A 38 3.143 -23.020 -5.260 1.00 0.00 O1- ATOM 0 H ASP A 38 -0.678 -22.134 -7.514 1.00 0.00 H new ATOM 0 HA ASP A 38 0.948 -23.898 -6.000 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.570 -21.912 -7.505 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.009 -20.855 -6.224 1.00 0.00 H new ATOM 603 N HIS A 39 -1.078 -21.996 -4.282 1.00 0.00 N ATOM 604 CA HIS A 39 -1.546 -21.657 -2.948 1.00 0.00 C ATOM 605 C HIS A 39 -3.069 -21.576 -2.894 1.00 0.00 C ATOM 606 O HIS A 39 -3.659 -20.572 -3.291 1.00 0.00 O ATOM 607 CB HIS A 39 -0.918 -20.322 -2.551 1.00 0.00 C ATOM 608 CG HIS A 39 0.584 -20.366 -2.483 1.00 0.00 C ATOM 609 ND1 HIS A 39 1.339 -20.843 -1.409 1.00 0.00 N ATOM 610 CD2 HIS A 39 1.420 -19.947 -3.475 1.00 0.00 C ATOM 611 CE1 HIS A 39 2.619 -20.713 -1.795 1.00 0.00 C ATOM 612 NE2 HIS A 39 2.698 -20.186 -3.030 1.00 0.00 N ATOM 0 H HIS A 39 -1.683 -21.659 -5.031 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.248 -22.437 -2.248 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -1.220 -19.559 -3.269 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -1.310 -20.019 -1.580 1.00 0.00 H new ATOM 0 HD2 HIS A 39 1.135 -19.513 -4.422 1.00 0.00 H new ATOM 0 HE1 HIS A 39 3.471 -20.994 -1.194 1.00 0.00 H new ATOM 0 HE2 HIS A 39 3.557 -19.997 -3.546 1.00 0.00 H new ATOM 620 N ILE A 40 -3.704 -22.643 -2.401 1.00 0.00 N ATOM 621 CA ILE A 40 -5.144 -22.699 -2.247 1.00 0.00 C ATOM 622 C ILE A 40 -5.593 -21.868 -1.050 1.00 0.00 C ATOM 623 O ILE A 40 -6.764 -21.516 -0.981 1.00 0.00 O ATOM 624 CB ILE A 40 -5.613 -24.151 -2.072 1.00 0.00 C ATOM 625 CG1 ILE A 40 -4.753 -24.961 -1.084 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.740 -24.841 -3.430 1.00 0.00 C ATOM 627 CD1 ILE A 40 -3.597 -25.725 -1.741 1.00 0.00 C ATOM 0 H ILE A 40 -3.224 -23.491 -2.099 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.593 -22.287 -3.151 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.602 -24.111 -1.615 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.346 -24.284 -0.333 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.392 -25.671 -0.560 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.073 -25.869 -3.286 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.466 -24.307 -4.043 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.772 -24.840 -3.930 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.040 -26.269 -0.978 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.995 -26.429 -2.472 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.933 -25.020 -2.241 1.00 0.00 H new ATOM 639 N ASP A 41 -4.693 -21.553 -0.113 1.00 0.00 N ATOM 640 CA ASP A 41 -5.045 -20.844 1.113 1.00 0.00 C ATOM 641 C ASP A 41 -5.607 -19.442 0.866 1.00 0.00 C ATOM 642 O ASP A 41 -6.097 -18.813 1.801 1.00 0.00 O ATOM 643 CB ASP A 41 -3.834 -20.793 2.045 1.00 0.00 C ATOM 644 CG ASP A 41 -3.580 -22.143 2.718 1.00 0.00 C ATOM 645 OD1 ASP A 41 -4.572 -22.880 2.933 1.00 0.00 O ATOM 646 OD2 ASP A 41 -2.395 -22.416 3.008 1.00 0.00 O1- ATOM 0 H ASP A 41 -3.702 -21.784 -0.187 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.851 -21.405 1.587 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.951 -20.497 1.478 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.994 -20.031 2.808 1.00 0.00 H new ATOM 651 N ILE A 42 -5.545 -18.947 -0.372 1.00 0.00 N ATOM 652 CA ILE A 42 -6.173 -17.687 -0.742 1.00 0.00 C ATOM 653 C ILE A 42 -7.372 -17.904 -1.666 1.00 0.00 C ATOM 654 O ILE A 42 -7.860 -16.955 -2.275 1.00 0.00 O ATOM 655 CB ILE A 42 -5.161 -16.696 -1.327 1.00 0.00 C ATOM 656 CG1 ILE A 42 -4.320 -17.299 -2.461 1.00 0.00 C ATOM 657 CG2 ILE A 42 -4.325 -16.082 -0.200 1.00 0.00 C ATOM 658 CD1 ILE A 42 -2.898 -17.654 -2.036 1.00 0.00 C ATOM 0 H ILE A 42 -5.059 -19.410 -1.140 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.558 -17.236 0.173 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.710 -15.886 -1.807 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -4.815 -18.196 -2.833 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.278 -16.591 -3.289 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.607 -15.378 -0.621 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -4.981 -15.559 0.496 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.791 -16.872 0.329 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.359 -18.075 -2.885 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.386 -16.756 -1.691 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -2.931 -18.385 -1.228 1.00 0.00 H new ATOM 670 N GLU A 43 -7.866 -19.140 -1.787 1.00 0.00 N ATOM 671 CA GLU A 43 -9.038 -19.416 -2.608 1.00 0.00 C ATOM 672 C GLU A 43 -10.208 -18.508 -2.229 1.00 0.00 C ATOM 673 O GLU A 43 -11.002 -18.131 -3.086 1.00 0.00 O ATOM 674 CB GLU A 43 -9.421 -20.888 -2.448 1.00 0.00 C ATOM 675 CG GLU A 43 -9.810 -21.277 -1.019 1.00 0.00 C ATOM 676 CD GLU A 43 -11.216 -20.856 -0.604 1.00 0.00 C ATOM 677 OE1 GLU A 43 -12.102 -20.797 -1.484 1.00 0.00 O ATOM 678 OE2 GLU A 43 -11.374 -20.599 0.608 1.00 0.00 O1- ATOM 0 H GLU A 43 -7.471 -19.960 -1.327 1.00 0.00 H new ATOM 0 HA GLU A 43 -8.797 -19.212 -3.651 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -10.254 -21.111 -3.114 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.583 -21.508 -2.767 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -9.724 -22.359 -0.915 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -9.094 -20.832 -0.328 1.00 0.00 H new ATOM 685 N SER A 44 -10.323 -18.153 -0.948 1.00 0.00 N ATOM 686 CA SER A 44 -11.446 -17.356 -0.476 1.00 0.00 C ATOM 687 C SER A 44 -11.448 -15.951 -1.089 1.00 0.00 C ATOM 688 O SER A 44 -12.515 -15.458 -1.448 1.00 0.00 O ATOM 689 CB SER A 44 -11.441 -17.321 1.052 1.00 0.00 C ATOM 690 OG SER A 44 -12.113 -18.455 1.555 1.00 0.00 O ATOM 0 H SER A 44 -9.651 -18.406 -0.224 1.00 0.00 H new ATOM 0 HA SER A 44 -12.373 -17.826 -0.806 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.416 -17.300 1.422 1.00 0.00 H new ATOM 0 HB3 SER A 44 -11.926 -16.412 1.406 1.00 0.00 H new ATOM 0 HG SER A 44 -12.130 -19.156 0.870 1.00 0.00 H new ATOM 696 N LYS A 45 -10.288 -15.291 -1.224 1.00 0.00 N ATOM 697 CA LYS A 45 -10.260 -13.981 -1.869 1.00 0.00 C ATOM 698 C LYS A 45 -10.460 -14.149 -3.374 1.00 0.00 C ATOM 699 O LYS A 45 -10.952 -13.239 -4.036 1.00 0.00 O ATOM 700 CB LYS A 45 -8.954 -13.233 -1.582 1.00 0.00 C ATOM 701 CG LYS A 45 -7.729 -14.057 -1.989 1.00 0.00 C ATOM 702 CD LYS A 45 -6.430 -13.249 -2.041 1.00 0.00 C ATOM 703 CE LYS A 45 -6.108 -12.641 -0.686 1.00 0.00 C ATOM 704 NZ LYS A 45 -4.666 -12.339 -0.562 1.00 0.00 N1+ ATOM 0 H LYS A 45 -9.383 -15.635 -0.903 1.00 0.00 H new ATOM 0 HA LYS A 45 -11.072 -13.381 -1.457 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.951 -12.286 -2.121 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.896 -12.995 -0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.606 -14.880 -1.285 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.910 -14.500 -2.968 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.610 -13.893 -2.358 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.520 -12.458 -2.786 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.686 -11.727 -0.548 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.407 -13.330 0.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -4.222 -13.025 0.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -4.217 -12.400 -1.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -4.544 -11.379 -0.182 1.00 0.00 H new ATOM 718 N ILE A 46 -10.074 -15.311 -3.911 1.00 0.00 N ATOM 719 CA ILE A 46 -10.156 -15.583 -5.334 1.00 0.00 C ATOM 720 C ILE A 46 -11.607 -15.780 -5.744 1.00 0.00 C ATOM 721 O ILE A 46 -12.047 -15.203 -6.735 1.00 0.00 O ATOM 722 CB ILE A 46 -9.316 -16.824 -5.651 1.00 0.00 C ATOM 723 CG1 ILE A 46 -7.841 -16.464 -5.453 1.00 0.00 C ATOM 724 CG2 ILE A 46 -9.575 -17.299 -7.083 1.00 0.00 C ATOM 725 CD1 ILE A 46 -6.956 -17.706 -5.371 1.00 0.00 C ATOM 0 H ILE A 46 -9.697 -16.085 -3.364 1.00 0.00 H new ATOM 0 HA ILE A 46 -9.764 -14.738 -5.900 1.00 0.00 H new ATOM 0 HB ILE A 46 -9.589 -17.642 -4.984 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.507 -15.835 -6.278 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.730 -15.879 -4.540 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.969 -18.181 -7.289 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.630 -17.548 -7.199 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.311 -16.506 -7.783 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.918 -17.404 -5.230 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.272 -18.323 -4.530 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -7.046 -18.278 -6.294 1.00 0.00 H new ATOM 737 N ILE A 47 -12.349 -16.590 -4.984 1.00 0.00 N ATOM 738 CA ILE A 47 -13.752 -16.839 -5.278 1.00 0.00 C ATOM 739 C ILE A 47 -14.550 -15.547 -5.108 1.00 0.00 C ATOM 740 O ILE A 47 -15.466 -15.276 -5.882 1.00 0.00 O ATOM 741 CB ILE A 47 -14.287 -17.962 -4.379 1.00 0.00 C ATOM 742 CG1 ILE A 47 -13.581 -19.295 -4.653 1.00 0.00 C ATOM 743 CG2 ILE A 47 -15.794 -18.126 -4.587 1.00 0.00 C ATOM 744 CD1 ILE A 47 -13.750 -19.801 -6.086 1.00 0.00 C ATOM 0 H ILE A 47 -11.997 -17.081 -4.163 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.860 -17.167 -6.312 1.00 0.00 H new ATOM 0 HB ILE A 47 -14.085 -17.681 -3.345 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -12.518 -19.182 -4.441 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -13.966 -20.047 -3.964 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -16.165 -18.925 -3.945 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -16.300 -17.194 -4.335 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -15.992 -18.376 -5.629 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -13.223 -20.748 -6.202 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.809 -19.947 -6.298 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -13.339 -19.069 -6.781 1.00 0.00 H new ATOM 756 N SER A 48 -14.208 -14.740 -4.097 1.00 0.00 N ATOM 757 CA SER A 48 -14.889 -13.468 -3.908 1.00 0.00 C ATOM 758 C SER A 48 -14.595 -12.526 -5.074 1.00 0.00 C ATOM 759 O SER A 48 -15.439 -11.714 -5.447 1.00 0.00 O ATOM 760 CB SER A 48 -14.444 -12.838 -2.590 1.00 0.00 C ATOM 761 OG SER A 48 -15.141 -11.627 -2.385 1.00 0.00 O ATOM 0 H SER A 48 -13.479 -14.944 -3.414 1.00 0.00 H new ATOM 0 HA SER A 48 -15.964 -13.643 -3.874 1.00 0.00 H new ATOM 0 HB2 SER A 48 -14.635 -13.524 -1.765 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.370 -12.653 -2.608 1.00 0.00 H new ATOM 0 HG SER A 48 -14.856 -11.225 -1.538 1.00 0.00 H new ATOM 767 N LEU A 49 -13.398 -12.622 -5.658 1.00 0.00 N ATOM 768 CA LEU A 49 -13.011 -11.724 -6.731 1.00 0.00 C ATOM 769 C LEU A 49 -13.678 -12.075 -8.065 1.00 0.00 C ATOM 770 O LEU A 49 -13.960 -11.173 -8.852 1.00 0.00 O ATOM 771 CB LEU A 49 -11.482 -11.699 -6.821 1.00 0.00 C ATOM 772 CG LEU A 49 -10.976 -10.612 -7.773 1.00 0.00 C ATOM 773 CD1 LEU A 49 -11.458 -9.227 -7.342 1.00 0.00 C ATOM 774 CD2 LEU A 49 -9.453 -10.596 -7.798 1.00 0.00 C ATOM 0 H LEU A 49 -12.689 -13.310 -5.403 1.00 0.00 H new ATOM 0 HA LEU A 49 -13.369 -10.720 -6.501 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -11.064 -11.533 -5.828 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -11.124 -12.671 -7.159 1.00 0.00 H new ATOM 0 HG LEU A 49 -11.371 -10.842 -8.763 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.082 -8.478 -8.038 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -12.548 -9.205 -7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -11.089 -9.009 -6.340 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -9.108 -9.818 -8.479 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.075 -10.394 -6.796 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.084 -11.564 -8.137 1.00 0.00 H new ATOM 786 N ILE A 50 -13.939 -13.358 -8.342 1.00 0.00 N ATOM 787 CA ILE A 50 -14.616 -13.733 -9.580 1.00 0.00 C ATOM 788 C ILE A 50 -16.098 -13.384 -9.518 1.00 0.00 C ATOM 789 O ILE A 50 -16.654 -12.947 -10.524 1.00 0.00 O ATOM 790 CB ILE A 50 -14.477 -15.228 -9.883 1.00 0.00 C ATOM 791 CG1 ILE A 50 -14.754 -16.052 -8.624 1.00 0.00 C ATOM 792 CG2 ILE A 50 -13.100 -15.542 -10.463 1.00 0.00 C ATOM 793 CD1 ILE A 50 -14.896 -17.539 -8.911 1.00 0.00 C ATOM 0 H ILE A 50 -13.695 -14.140 -7.734 1.00 0.00 H new ATOM 0 HA ILE A 50 -14.134 -13.167 -10.377 1.00 0.00 H new ATOM 0 HB ILE A 50 -15.217 -15.500 -10.636 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.944 -15.900 -7.911 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -15.667 -15.689 -8.152 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -13.027 -16.610 -10.669 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.959 -14.983 -11.388 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -12.330 -15.258 -9.746 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -15.091 -18.072 -7.981 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.724 -17.699 -9.602 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -13.974 -17.913 -9.357 1.00 0.00 H new ATOM 805 N ILE A 51 -16.750 -13.564 -8.366 1.00 0.00 N ATOM 806 CA ILE A 51 -18.161 -13.202 -8.275 1.00 0.00 C ATOM 807 C ILE A 51 -18.322 -11.690 -8.414 1.00 0.00 C ATOM 808 O ILE A 51 -19.285 -11.231 -9.021 1.00 0.00 O ATOM 809 CB ILE A 51 -18.793 -13.709 -6.971 1.00 0.00 C ATOM 810 CG1 ILE A 51 -18.141 -13.054 -5.749 1.00 0.00 C ATOM 811 CG2 ILE A 51 -18.706 -15.238 -6.914 1.00 0.00 C ATOM 812 CD1 ILE A 51 -18.863 -13.418 -4.454 1.00 0.00 C ATOM 0 H ILE A 51 -16.339 -13.944 -7.513 1.00 0.00 H new ATOM 0 HA ILE A 51 -18.691 -13.687 -9.095 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.846 -13.426 -6.954 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -17.099 -13.366 -5.683 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -18.143 -11.971 -5.873 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -19.156 -15.594 -5.987 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -19.240 -15.665 -7.763 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -17.661 -15.545 -6.951 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.368 -12.933 -3.613 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -19.899 -13.083 -4.508 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.838 -14.499 -4.315 1.00 0.00 H new ATOM 824 N ASP A 52 -17.387 -10.915 -7.857 1.00 0.00 N ATOM 825 CA ASP A 52 -17.416 -9.469 -8.004 1.00 0.00 C ATOM 826 C ASP A 52 -17.153 -9.057 -9.454 1.00 0.00 C ATOM 827 O ASP A 52 -17.755 -8.098 -9.938 1.00 0.00 O ATOM 828 CB ASP A 52 -16.394 -8.843 -7.052 1.00 0.00 C ATOM 829 CG ASP A 52 -16.782 -9.005 -5.579 1.00 0.00 C ATOM 830 OD1 ASP A 52 -17.958 -9.355 -5.328 1.00 0.00 O ATOM 831 OD2 ASP A 52 -15.893 -8.773 -4.731 1.00 0.00 O1- ATOM 0 H ASP A 52 -16.607 -11.269 -7.304 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.409 -9.103 -7.745 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.419 -9.301 -7.219 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.291 -7.783 -7.282 1.00 0.00 H new ATOM 836 N TYR A 53 -16.266 -9.772 -10.153 1.00 0.00 N ATOM 837 CA TYR A 53 -16.001 -9.518 -11.562 1.00 0.00 C ATOM 838 C TYR A 53 -17.227 -9.881 -12.395 1.00 0.00 C ATOM 839 O TYR A 53 -17.539 -9.215 -13.376 1.00 0.00 O ATOM 840 CB TYR A 53 -14.800 -10.362 -11.990 1.00 0.00 C ATOM 841 CG TYR A 53 -14.358 -10.229 -13.437 1.00 0.00 C ATOM 842 CD1 TYR A 53 -14.235 -8.970 -14.053 1.00 0.00 C ATOM 843 CD2 TYR A 53 -14.067 -11.390 -14.168 1.00 0.00 C ATOM 844 CE1 TYR A 53 -13.814 -8.867 -15.390 1.00 0.00 C ATOM 845 CE2 TYR A 53 -13.648 -11.298 -15.502 1.00 0.00 C ATOM 846 CZ TYR A 53 -13.530 -10.040 -16.120 1.00 0.00 C ATOM 847 OH TYR A 53 -13.141 -9.957 -17.424 1.00 0.00 O ATOM 0 H TYR A 53 -15.718 -10.536 -9.757 1.00 0.00 H new ATOM 0 HA TYR A 53 -15.782 -8.462 -11.717 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -13.956 -10.103 -11.351 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -15.034 -11.409 -11.800 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -14.466 -8.075 -13.494 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -14.166 -12.359 -13.701 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -13.709 -7.898 -15.855 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -13.415 -12.195 -16.057 1.00 0.00 H new ATOM 0 HH TYR A 53 -12.985 -10.858 -17.777 1.00 0.00 H new ATOM 857 N SER A 54 -17.924 -10.946 -11.996 1.00 0.00 N ATOM 858 CA SER A 54 -19.093 -11.426 -12.711 1.00 0.00 C ATOM 859 C SER A 54 -20.307 -10.540 -12.457 1.00 0.00 C ATOM 860 O SER A 54 -21.238 -10.534 -13.262 1.00 0.00 O ATOM 861 CB SER A 54 -19.412 -12.851 -12.259 1.00 0.00 C ATOM 862 OG SER A 54 -18.257 -13.654 -12.349 1.00 0.00 O ATOM 0 H SER A 54 -17.689 -11.495 -11.169 1.00 0.00 H new ATOM 0 HA SER A 54 -18.870 -11.403 -13.778 1.00 0.00 H new ATOM 0 HB2 SER A 54 -19.780 -12.842 -11.233 1.00 0.00 H new ATOM 0 HB3 SER A 54 -20.205 -13.269 -12.879 1.00 0.00 H new ATOM 0 HG SER A 54 -17.758 -13.605 -11.507 1.00 0.00 H new ATOM 868 N ARG A 55 -20.299 -9.798 -11.347 1.00 0.00 N ATOM 869 CA ARG A 55 -21.416 -8.952 -10.955 1.00 0.00 C ATOM 870 C ARG A 55 -21.350 -7.562 -11.583 1.00 0.00 C ATOM 871 O ARG A 55 -22.352 -7.082 -12.108 1.00 0.00 O ATOM 872 CB ARG A 55 -21.425 -8.858 -9.434 1.00 0.00 C ATOM 873 CG ARG A 55 -22.687 -8.145 -8.961 1.00 0.00 C ATOM 874 CD ARG A 55 -22.842 -8.362 -7.461 1.00 0.00 C ATOM 875 NE ARG A 55 -21.819 -7.635 -6.697 1.00 0.00 N ATOM 876 CZ ARG A 55 -20.714 -8.183 -6.179 1.00 0.00 C ATOM 877 NH1 ARG A 55 -20.443 -9.480 -6.319 1.00 0.00 N1+ ATOM 878 NH2 ARG A 55 -19.846 -7.438 -5.502 1.00 0.00 N ATOM 0 H ARG A 55 -19.513 -9.771 -10.697 1.00 0.00 H new ATOM 0 HA ARG A 55 -22.340 -9.401 -11.319 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -21.378 -9.857 -9.000 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -20.542 -8.319 -9.090 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -22.624 -7.080 -9.184 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -23.559 -8.530 -9.490 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -23.833 -8.034 -7.146 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -22.774 -9.427 -7.239 1.00 0.00 H new ATOM 0 HE ARG A 55 -21.962 -6.636 -6.550 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -21.086 -10.083 -6.832 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -19.592 -9.870 -5.913 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -20.020 -6.441 -5.374 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -19.006 -7.863 -5.110 1.00 0.00 H new ATOM 892 N LEU A 56 -20.177 -6.925 -11.526 1.00 0.00 N ATOM 893 CA LEU A 56 -20.013 -5.551 -11.976 1.00 0.00 C ATOM 894 C LEU A 56 -19.755 -5.449 -13.475 1.00 0.00 C ATOM 895 O LEU A 56 -20.372 -4.642 -14.165 1.00 0.00 O ATOM 896 CB LEU A 56 -18.820 -4.941 -11.240 1.00 0.00 C ATOM 897 CG LEU A 56 -18.966 -5.027 -9.719 1.00 0.00 C ATOM 898 CD1 LEU A 56 -17.632 -4.638 -9.092 1.00 0.00 C ATOM 899 CD2 LEU A 56 -20.070 -4.093 -9.225 1.00 0.00 C ATOM 0 H LEU A 56 -19.322 -7.350 -11.168 1.00 0.00 H new ATOM 0 HA LEU A 56 -20.941 -5.021 -11.762 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -17.908 -5.454 -11.544 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -18.711 -3.897 -11.533 1.00 0.00 H new ATOM 0 HG LEU A 56 -19.239 -6.043 -9.433 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.711 -4.692 -8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -16.856 -5.323 -9.434 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.374 -3.621 -9.387 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -20.155 -4.172 -8.141 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -19.826 -3.066 -9.496 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -21.017 -4.374 -9.685 1.00 0.00 H new ATOM 911 N CYS A 57 -18.833 -6.275 -13.972 1.00 0.00 N ATOM 912 CA CYS A 57 -18.374 -6.211 -15.349 1.00 0.00 C ATOM 913 C CYS A 57 -19.409 -6.774 -16.331 1.00 0.00 C ATOM 914 O CYS A 57 -20.298 -7.526 -15.934 1.00 0.00 O ATOM 915 CB CYS A 57 -17.006 -6.890 -15.426 1.00 0.00 C ATOM 916 SG CYS A 57 -15.915 -6.085 -14.222 1.00 0.00 S ATOM 0 H CYS A 57 -18.385 -7.009 -13.423 1.00 0.00 H new ATOM 0 HA CYS A 57 -18.257 -5.173 -15.661 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -17.096 -7.954 -15.208 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -16.594 -6.804 -16.431 1.00 0.00 H new ATOM 0 HG CYS A 57 -15.865 -6.798 -13.136 1.00 0.00 H new ATOM 922 N PRO A 58 -19.294 -6.405 -17.615 1.00 0.00 N ATOM 923 CA PRO A 58 -20.282 -6.660 -18.652 1.00 0.00 C ATOM 924 C PRO A 58 -20.214 -8.097 -19.177 1.00 0.00 C ATOM 925 O PRO A 58 -19.443 -8.918 -18.685 1.00 0.00 O ATOM 926 CB PRO A 58 -19.955 -5.645 -19.746 1.00 0.00 C ATOM 927 CG PRO A 58 -18.438 -5.527 -19.660 1.00 0.00 C ATOM 928 CD PRO A 58 -18.162 -5.687 -18.168 1.00 0.00 C ATOM 0 HA PRO A 58 -21.300 -6.553 -18.276 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -20.278 -5.991 -20.728 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -20.445 -4.688 -19.568 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.940 -6.299 -20.247 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.087 -4.565 -20.034 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.235 -6.236 -18.002 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.047 -4.715 -17.688 1.00 0.00 H new ATOM 936 N ASP A 59 -21.038 -8.387 -20.189 1.00 0.00 N ATOM 937 CA ASP A 59 -21.240 -9.723 -20.735 1.00 0.00 C ATOM 938 C ASP A 59 -19.940 -10.436 -21.090 1.00 0.00 C ATOM 939 O ASP A 59 -19.729 -11.581 -20.695 1.00 0.00 O ATOM 940 CB ASP A 59 -22.098 -9.627 -22.004 1.00 0.00 C ATOM 941 CG ASP A 59 -21.623 -8.602 -23.045 1.00 0.00 C ATOM 942 OD1 ASP A 59 -20.617 -7.900 -22.796 1.00 0.00 O ATOM 943 OD2 ASP A 59 -22.293 -8.536 -24.096 1.00 0.00 O1- ATOM 0 H ASP A 59 -21.596 -7.675 -20.661 1.00 0.00 H new ATOM 0 HA ASP A 59 -21.732 -10.305 -19.956 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -22.131 -10.609 -22.475 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -23.119 -9.378 -21.714 1.00 0.00 H new ATOM 948 N SER A 60 -19.070 -9.760 -21.837 1.00 0.00 N ATOM 949 CA SER A 60 -17.839 -10.356 -22.327 1.00 0.00 C ATOM 950 C SER A 60 -16.914 -10.671 -21.157 1.00 0.00 C ATOM 951 O SER A 60 -16.174 -11.653 -21.187 1.00 0.00 O ATOM 952 CB SER A 60 -17.174 -9.386 -23.303 1.00 0.00 C ATOM 953 OG SER A 60 -18.084 -9.049 -24.328 1.00 0.00 O ATOM 0 H SER A 60 -19.202 -8.788 -22.116 1.00 0.00 H new ATOM 0 HA SER A 60 -18.056 -11.290 -22.846 1.00 0.00 H new ATOM 0 HB2 SER A 60 -16.854 -8.487 -22.777 1.00 0.00 H new ATOM 0 HB3 SER A 60 -16.280 -9.840 -23.731 1.00 0.00 H new ATOM 0 HG SER A 60 -17.657 -8.426 -24.952 1.00 0.00 H new ATOM 959 N HIS A 61 -16.955 -9.834 -20.118 1.00 0.00 N ATOM 960 CA HIS A 61 -16.138 -10.027 -18.935 1.00 0.00 C ATOM 961 C HIS A 61 -16.719 -11.149 -18.074 1.00 0.00 C ATOM 962 O HIS A 61 -15.980 -11.807 -17.346 1.00 0.00 O ATOM 963 CB HIS A 61 -16.024 -8.700 -18.186 1.00 0.00 C ATOM 964 CG HIS A 61 -15.318 -7.615 -18.970 1.00 0.00 C ATOM 965 ND1 HIS A 61 -14.995 -6.353 -18.465 1.00 0.00 N ATOM 966 CD2 HIS A 61 -14.895 -7.695 -20.269 1.00 0.00 C ATOM 967 CE1 HIS A 61 -14.393 -5.704 -19.474 1.00 0.00 C ATOM 968 NE2 HIS A 61 -14.304 -6.489 -20.562 1.00 0.00 N ATOM 0 H HIS A 61 -17.555 -9.010 -20.080 1.00 0.00 H new ATOM 0 HA HIS A 61 -15.130 -10.338 -19.211 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -17.024 -8.354 -17.924 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -15.489 -8.866 -17.251 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -15.004 -8.540 -20.933 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -14.029 -4.689 -19.419 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -13.873 -6.234 -21.450 1.00 0.00 H new ATOM 976 N LYS A 62 -18.036 -11.377 -18.148 1.00 0.00 N ATOM 977 CA LYS A 62 -18.665 -12.498 -17.458 1.00 0.00 C ATOM 978 C LYS A 62 -18.330 -13.804 -18.171 1.00 0.00 C ATOM 979 O LYS A 62 -18.172 -14.833 -17.517 1.00 0.00 O ATOM 980 CB LYS A 62 -20.182 -12.316 -17.423 1.00 0.00 C ATOM 981 CG LYS A 62 -20.587 -11.181 -16.481 1.00 0.00 C ATOM 982 CD LYS A 62 -22.090 -10.930 -16.587 1.00 0.00 C ATOM 983 CE LYS A 62 -22.892 -12.146 -16.114 1.00 0.00 C ATOM 984 NZ LYS A 62 -22.910 -12.239 -14.644 1.00 0.00 N1+ ATOM 0 H LYS A 62 -18.683 -10.796 -18.681 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.285 -12.533 -16.437 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -20.548 -12.105 -18.428 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.654 -13.244 -17.101 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -20.324 -11.437 -15.455 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -20.039 -10.273 -16.734 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -22.359 -10.059 -15.989 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -22.350 -10.699 -17.620 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -23.913 -12.078 -16.488 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -22.459 -13.055 -16.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -22.964 -13.238 -14.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -22.042 -11.816 -14.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -23.737 -11.729 -14.274 1.00 0.00 H new ATOM 998 N LEU A 63 -18.219 -13.778 -19.504 1.00 0.00 N ATOM 999 CA LEU A 63 -17.816 -14.956 -20.259 1.00 0.00 C ATOM 1000 C LEU A 63 -16.391 -15.326 -19.823 1.00 0.00 C ATOM 1001 O LEU A 63 -16.071 -16.492 -19.597 1.00 0.00 O ATOM 1002 CB LEU A 63 -17.859 -14.630 -21.757 1.00 0.00 C ATOM 1003 CG LEU A 63 -18.196 -15.855 -22.620 1.00 0.00 C ATOM 1004 CD1 LEU A 63 -17.959 -15.503 -24.086 1.00 0.00 C ATOM 1005 CD2 LEU A 63 -17.335 -17.075 -22.288 1.00 0.00 C ATOM 0 H LEU A 63 -18.403 -12.953 -20.075 1.00 0.00 H new ATOM 0 HA LEU A 63 -18.486 -15.795 -20.072 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -18.600 -13.851 -21.934 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -16.894 -14.228 -22.065 1.00 0.00 H new ATOM 0 HG LEU A 63 -19.236 -16.111 -22.418 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -18.195 -16.365 -24.710 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -18.598 -14.666 -24.367 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -16.915 -15.226 -24.229 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -17.621 -17.908 -22.931 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -16.285 -16.834 -22.451 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -17.486 -17.354 -21.245 1.00 0.00 H new ATOM 1017 N GLY A 64 -15.530 -14.307 -19.702 1.00 0.00 N ATOM 1018 CA GLY A 64 -14.153 -14.498 -19.279 1.00 0.00 C ATOM 1019 C GLY A 64 -14.062 -14.889 -17.807 1.00 0.00 C ATOM 1020 O GLY A 64 -13.087 -15.513 -17.397 1.00 0.00 O ATOM 0 H GLY A 64 -15.775 -13.336 -19.895 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.689 -15.272 -19.890 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.590 -13.580 -19.447 1.00 0.00 H new ATOM 1024 N SER A 65 -15.064 -14.531 -17.001 1.00 0.00 N ATOM 1025 CA SER A 65 -15.100 -14.946 -15.610 1.00 0.00 C ATOM 1026 C SER A 65 -15.349 -16.445 -15.528 1.00 0.00 C ATOM 1027 O SER A 65 -14.786 -17.123 -14.668 1.00 0.00 O ATOM 1028 CB SER A 65 -16.200 -14.190 -14.878 1.00 0.00 C ATOM 1029 OG SER A 65 -16.247 -14.642 -13.546 1.00 0.00 O ATOM 0 H SER A 65 -15.855 -13.957 -17.293 1.00 0.00 H new ATOM 0 HA SER A 65 -14.143 -14.721 -15.140 1.00 0.00 H new ATOM 0 HB2 SER A 65 -16.006 -13.118 -14.907 1.00 0.00 H new ATOM 0 HB3 SER A 65 -17.161 -14.353 -15.367 1.00 0.00 H new ATOM 0 HG SER A 65 -16.817 -14.045 -13.018 1.00 0.00 H new ATOM 1035 N LEU A 66 -16.192 -16.971 -16.421 1.00 0.00 N ATOM 1036 CA LEU A 66 -16.487 -18.391 -16.457 1.00 0.00 C ATOM 1037 C LEU A 66 -15.295 -19.167 -17.014 1.00 0.00 C ATOM 1038 O LEU A 66 -15.149 -20.350 -16.710 1.00 0.00 O ATOM 1039 CB LEU A 66 -17.756 -18.617 -17.278 1.00 0.00 C ATOM 1040 CG LEU A 66 -18.977 -18.052 -16.539 1.00 0.00 C ATOM 1041 CD1 LEU A 66 -20.170 -17.980 -17.485 1.00 0.00 C ATOM 1042 CD2 LEU A 66 -19.355 -18.951 -15.363 1.00 0.00 C ATOM 0 H LEU A 66 -16.681 -16.424 -17.130 1.00 0.00 H new ATOM 0 HA LEU A 66 -16.663 -18.763 -15.448 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.658 -18.137 -18.252 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.894 -19.683 -17.461 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.720 -17.057 -16.175 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -21.032 -17.578 -16.953 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.928 -17.331 -18.327 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -20.404 -18.979 -17.853 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -20.223 -18.535 -14.851 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.595 -19.949 -15.730 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.518 -19.012 -14.668 1.00 0.00 H new ATOM 1054 N TYR A 67 -14.447 -18.523 -17.821 1.00 0.00 N ATOM 1055 CA TYR A 67 -13.189 -19.130 -18.236 1.00 0.00 C ATOM 1056 C TYR A 67 -12.225 -19.211 -17.064 1.00 0.00 C ATOM 1057 O TYR A 67 -11.485 -20.188 -16.938 1.00 0.00 O ATOM 1058 CB TYR A 67 -12.530 -18.275 -19.313 1.00 0.00 C ATOM 1059 CG TYR A 67 -12.917 -18.621 -20.723 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -11.999 -18.351 -21.739 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -14.158 -19.205 -21.017 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -12.322 -18.649 -23.070 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -14.483 -19.528 -22.342 1.00 0.00 C ATOM 1064 CZ TYR A 67 -13.567 -19.238 -23.379 1.00 0.00 C ATOM 1065 OH TYR A 67 -13.876 -19.522 -24.677 1.00 0.00 O ATOM 0 H TYR A 67 -14.611 -17.588 -18.195 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.409 -20.129 -18.614 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -12.780 -17.230 -19.130 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.448 -18.366 -19.216 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -11.041 -17.913 -21.500 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.863 -19.406 -20.223 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -11.618 -18.428 -23.859 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -15.429 -19.996 -22.570 1.00 0.00 H new ATOM 0 HH TYR A 67 -14.644 -20.130 -24.705 1.00 0.00 H new ATOM 1075 N ILE A 68 -12.224 -18.190 -16.202 1.00 0.00 N ATOM 1076 CA ILE A 68 -11.362 -18.213 -15.040 1.00 0.00 C ATOM 1077 C ILE A 68 -11.847 -19.311 -14.104 1.00 0.00 C ATOM 1078 O ILE A 68 -11.059 -20.166 -13.708 1.00 0.00 O ATOM 1079 CB ILE A 68 -11.367 -16.840 -14.359 1.00 0.00 C ATOM 1080 CG1 ILE A 68 -10.579 -15.839 -15.209 1.00 0.00 C ATOM 1081 CG2 ILE A 68 -10.748 -16.920 -12.961 1.00 0.00 C ATOM 1082 CD1 ILE A 68 -11.051 -14.413 -14.925 1.00 0.00 C ATOM 0 H ILE A 68 -12.803 -17.355 -16.292 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.333 -18.427 -15.327 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.401 -16.510 -14.262 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.514 -15.927 -14.992 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.709 -16.068 -16.267 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -10.764 -15.933 -12.499 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.321 -17.616 -12.349 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.718 -17.268 -13.039 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -10.482 -13.713 -15.536 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.111 -14.326 -15.165 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -10.897 -14.182 -13.871 1.00 0.00 H new ATOM 1094 N ILE A 69 -13.141 -19.279 -13.760 1.00 0.00 N ATOM 1095 CA ILE A 69 -13.784 -20.301 -12.945 1.00 0.00 C ATOM 1096 C ILE A 69 -13.552 -21.701 -13.512 1.00 0.00 C ATOM 1097 O ILE A 69 -13.416 -22.648 -12.744 1.00 0.00 O ATOM 1098 CB ILE A 69 -15.287 -20.005 -12.874 1.00 0.00 C ATOM 1099 CG1 ILE A 69 -15.520 -18.749 -12.032 1.00 0.00 C ATOM 1100 CG2 ILE A 69 -16.052 -21.175 -12.250 1.00 0.00 C ATOM 1101 CD1 ILE A 69 -16.921 -18.170 -12.242 1.00 0.00 C ATOM 0 H ILE A 69 -13.773 -18.531 -14.047 1.00 0.00 H new ATOM 0 HA ILE A 69 -13.347 -20.277 -11.947 1.00 0.00 H new ATOM 0 HB ILE A 69 -15.652 -19.853 -13.890 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -15.381 -18.988 -10.978 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -14.774 -17.997 -12.289 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -17.115 -20.936 -12.213 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -15.902 -22.071 -12.853 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -15.684 -21.352 -11.239 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -17.043 -17.280 -11.625 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -17.052 -17.905 -13.291 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -17.668 -18.912 -11.959 1.00 0.00 H new ATOM 1113 N ASP A 70 -13.509 -21.853 -14.836 1.00 0.00 N ATOM 1114 CA ASP A 70 -13.245 -23.161 -15.421 1.00 0.00 C ATOM 1115 C ASP A 70 -11.802 -23.583 -15.170 1.00 0.00 C ATOM 1116 O ASP A 70 -11.537 -24.744 -14.862 1.00 0.00 O ATOM 1117 CB ASP A 70 -13.502 -23.091 -16.929 1.00 0.00 C ATOM 1118 CG ASP A 70 -13.031 -24.359 -17.638 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -12.006 -24.287 -18.352 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -13.705 -25.393 -17.454 1.00 0.00 O1- ATOM 0 H ASP A 70 -13.651 -21.101 -15.510 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.904 -23.896 -14.959 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.567 -22.946 -17.111 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.986 -22.227 -17.347 1.00 0.00 H new ATOM 1125 N SER A 71 -10.877 -22.632 -15.304 1.00 0.00 N ATOM 1126 CA SER A 71 -9.460 -22.909 -15.168 1.00 0.00 C ATOM 1127 C SER A 71 -9.118 -23.205 -13.714 1.00 0.00 C ATOM 1128 O SER A 71 -8.574 -24.261 -13.405 1.00 0.00 O ATOM 1129 CB SER A 71 -8.662 -21.706 -15.675 1.00 0.00 C ATOM 1130 OG SER A 71 -9.053 -21.379 -16.991 1.00 0.00 O ATOM 0 H SER A 71 -11.094 -21.657 -15.508 1.00 0.00 H new ATOM 0 HA SER A 71 -9.201 -23.786 -15.761 1.00 0.00 H new ATOM 0 HB2 SER A 71 -8.822 -20.851 -15.018 1.00 0.00 H new ATOM 0 HB3 SER A 71 -7.596 -21.932 -15.650 1.00 0.00 H new ATOM 0 HG SER A 71 -9.870 -20.838 -16.965 1.00 0.00 H new ATOM 1136 N ILE A 72 -9.441 -22.266 -12.818 1.00 0.00 N ATOM 1137 CA ILE A 72 -9.112 -22.389 -11.407 1.00 0.00 C ATOM 1138 C ILE A 72 -10.045 -23.395 -10.737 1.00 0.00 C ATOM 1139 O ILE A 72 -9.657 -24.055 -9.777 1.00 0.00 O ATOM 1140 CB ILE A 72 -9.176 -20.988 -10.781 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -8.331 -20.864 -9.507 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -10.611 -20.511 -10.533 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -9.082 -21.218 -8.225 1.00 0.00 C ATOM 0 H ILE A 72 -9.935 -21.406 -13.056 1.00 0.00 H new ATOM 0 HA ILE A 72 -8.103 -22.777 -11.265 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.738 -20.325 -11.527 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.460 -21.513 -9.597 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -7.960 -19.842 -9.428 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -10.592 -19.515 -10.090 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -11.152 -20.477 -11.479 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -11.112 -21.201 -9.854 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -8.416 -21.105 -7.370 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -9.937 -20.552 -8.109 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -9.430 -22.250 -8.280 1.00 0.00 H new ATOM 1155 N GLY A 73 -11.277 -23.519 -11.239 1.00 0.00 N ATOM 1156 CA GLY A 73 -12.269 -24.387 -10.635 1.00 0.00 C ATOM 1157 C GLY A 73 -11.915 -25.854 -10.822 1.00 0.00 C ATOM 1158 O GLY A 73 -11.797 -26.589 -9.842 1.00 0.00 O ATOM 0 H GLY A 73 -11.604 -23.022 -12.068 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.349 -24.164 -9.571 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.245 -24.188 -11.077 1.00 0.00 H new ATOM 1162 N ARG A 74 -11.740 -26.291 -12.071 1.00 0.00 N ATOM 1163 CA ARG A 74 -11.413 -27.684 -12.325 1.00 0.00 C ATOM 1164 C ARG A 74 -10.010 -27.994 -11.834 1.00 0.00 C ATOM 1165 O ARG A 74 -9.785 -29.076 -11.301 1.00 0.00 O ATOM 1166 CB ARG A 74 -11.516 -27.998 -13.814 1.00 0.00 C ATOM 1167 CG ARG A 74 -12.977 -28.039 -14.255 1.00 0.00 C ATOM 1168 CD ARG A 74 -13.065 -28.573 -15.681 1.00 0.00 C ATOM 1169 NE ARG A 74 -12.492 -27.624 -16.643 1.00 0.00 N ATOM 1170 CZ ARG A 74 -11.242 -27.662 -17.119 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -10.393 -28.630 -16.763 1.00 0.00 N1+ ATOM 1172 NH2 ARG A 74 -10.836 -26.715 -17.962 1.00 0.00 N ATOM 0 H ARG A 74 -11.819 -25.708 -12.904 1.00 0.00 H new ATOM 0 HA ARG A 74 -12.127 -28.305 -11.784 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.978 -27.244 -14.388 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -11.041 -28.956 -14.023 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.553 -28.674 -13.582 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.412 -27.041 -14.202 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.538 -29.525 -15.748 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -14.107 -28.767 -15.935 1.00 0.00 H new ATOM 0 HE ARG A 74 -13.097 -26.873 -16.976 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.693 -29.359 -16.116 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.444 -28.640 -17.138 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -11.476 -25.970 -18.239 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.885 -26.734 -18.331 1.00 0.00 H new ATOM 1186 N ALA A 75 -9.067 -27.064 -12.006 1.00 0.00 N ATOM 1187 CA ALA A 75 -7.711 -27.329 -11.566 1.00 0.00 C ATOM 1188 C ALA A 75 -7.664 -27.490 -10.049 1.00 0.00 C ATOM 1189 O ALA A 75 -6.813 -28.216 -9.546 1.00 0.00 O ATOM 1190 CB ALA A 75 -6.789 -26.210 -12.039 1.00 0.00 C ATOM 0 H ALA A 75 -9.217 -26.150 -12.434 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.365 -28.265 -12.005 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.771 -26.412 -11.707 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.811 -26.156 -13.127 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.125 -25.261 -11.622 1.00 0.00 H new ATOM 1196 N TYR A 76 -8.563 -26.829 -9.310 1.00 0.00 N ATOM 1197 CA TYR A 76 -8.613 -27.000 -7.866 1.00 0.00 C ATOM 1198 C TYR A 76 -9.166 -28.369 -7.502 1.00 0.00 C ATOM 1199 O TYR A 76 -8.599 -29.051 -6.652 1.00 0.00 O ATOM 1200 CB TYR A 76 -9.492 -25.922 -7.227 1.00 0.00 C ATOM 1201 CG TYR A 76 -8.742 -24.710 -6.731 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -9.362 -23.862 -5.802 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -7.443 -24.433 -7.181 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -8.666 -22.764 -5.278 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -6.742 -23.344 -6.656 1.00 0.00 C ATOM 1206 CZ TYR A 76 -7.339 -22.516 -5.685 1.00 0.00 C ATOM 1207 OH TYR A 76 -6.642 -21.481 -5.140 1.00 0.00 O ATOM 0 H TYR A 76 -9.254 -26.181 -9.688 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.595 -26.912 -7.488 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -10.235 -25.599 -7.956 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -10.035 -26.363 -6.392 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -10.378 -24.055 -5.490 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -6.985 -25.060 -7.932 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -9.145 -22.110 -4.564 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -5.738 -23.136 -6.996 1.00 0.00 H new ATOM 0 HH TYR A 76 -5.682 -21.674 -5.184 1.00 0.00 H new ATOM 1217 N LEU A 77 -10.265 -28.796 -8.125 1.00 0.00 N ATOM 1218 CA LEU A 77 -10.813 -30.086 -7.752 1.00 0.00 C ATOM 1219 C LEU A 77 -9.792 -31.161 -8.139 1.00 0.00 C ATOM 1220 O LEU A 77 -9.567 -32.106 -7.388 1.00 0.00 O ATOM 1221 CB LEU A 77 -12.160 -30.288 -8.447 1.00 0.00 C ATOM 1222 CG LEU A 77 -13.123 -31.203 -7.675 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -12.480 -32.539 -7.315 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -13.603 -30.539 -6.386 1.00 0.00 C ATOM 0 H LEU A 77 -10.768 -28.291 -8.855 1.00 0.00 H new ATOM 0 HA LEU A 77 -10.995 -30.148 -6.679 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -12.633 -29.317 -8.592 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -11.988 -30.709 -9.437 1.00 0.00 H new ATOM 0 HG LEU A 77 -13.968 -31.381 -8.340 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -13.197 -33.153 -6.770 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.179 -33.055 -8.227 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -11.604 -32.365 -6.691 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -14.283 -31.211 -5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.746 -30.320 -5.749 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -14.123 -29.612 -6.626 1.00 0.00 H new ATOM 1236 N ASP A 78 -9.172 -31.018 -9.313 1.00 0.00 N ATOM 1237 CA ASP A 78 -8.151 -31.951 -9.779 1.00 0.00 C ATOM 1238 C ASP A 78 -6.887 -31.942 -8.924 1.00 0.00 C ATOM 1239 O ASP A 78 -6.347 -33.007 -8.628 1.00 0.00 O ATOM 1240 CB ASP A 78 -7.779 -31.592 -11.211 1.00 0.00 C ATOM 1241 CG ASP A 78 -8.939 -31.850 -12.178 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -8.850 -31.338 -13.315 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -9.893 -32.553 -11.772 1.00 0.00 O1- ATOM 0 H ASP A 78 -9.364 -30.255 -9.962 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.575 -32.953 -9.710 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.491 -30.542 -11.260 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.911 -32.175 -11.519 1.00 0.00 H new ATOM 1248 N GLU A 79 -6.402 -30.767 -8.519 1.00 0.00 N ATOM 1249 CA GLU A 79 -5.226 -30.707 -7.676 1.00 0.00 C ATOM 1250 C GLU A 79 -5.498 -31.354 -6.323 1.00 0.00 C ATOM 1251 O GLU A 79 -4.654 -32.080 -5.804 1.00 0.00 O ATOM 1252 CB GLU A 79 -4.820 -29.245 -7.524 1.00 0.00 C ATOM 1253 CG GLU A 79 -3.402 -29.140 -6.987 1.00 0.00 C ATOM 1254 CD GLU A 79 -3.301 -29.326 -5.472 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -4.326 -29.110 -4.786 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -2.193 -29.681 -5.010 1.00 0.00 O1- ATOM 0 H GLU A 79 -6.804 -29.861 -8.761 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.408 -31.264 -8.134 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.889 -28.740 -8.488 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.509 -28.738 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -2.781 -29.889 -7.478 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -2.994 -28.165 -7.252 1.00 0.00 H new ATOM 1263 N THR A 80 -6.677 -31.094 -5.750 1.00 0.00 N ATOM 1264 CA THR A 80 -7.042 -31.653 -4.456 1.00 0.00 C ATOM 1265 C THR A 80 -7.385 -33.134 -4.576 1.00 0.00 C ATOM 1266 O THR A 80 -7.329 -33.856 -3.583 1.00 0.00 O ATOM 1267 CB THR A 80 -8.208 -30.860 -3.870 1.00 0.00 C ATOM 1268 OG1 THR A 80 -9.309 -30.915 -4.753 1.00 0.00 O ATOM 1269 CG2 THR A 80 -7.814 -29.403 -3.649 1.00 0.00 C ATOM 0 H THR A 80 -7.392 -30.498 -6.167 1.00 0.00 H new ATOM 0 HA THR A 80 -6.189 -31.574 -3.782 1.00 0.00 H new ATOM 0 HB THR A 80 -8.477 -31.301 -2.910 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.226 -30.205 -5.424 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.660 -28.857 -3.231 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.973 -29.354 -2.957 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.527 -28.955 -4.601 1.00 0.00 H new ATOM 1277 N ARG A 81 -7.737 -33.600 -5.778 1.00 0.00 N ATOM 1278 CA ARG A 81 -7.857 -35.029 -6.050 1.00 0.00 C ATOM 1279 C ARG A 81 -6.478 -35.682 -6.007 1.00 0.00 C ATOM 1280 O ARG A 81 -6.339 -36.812 -5.545 1.00 0.00 O ATOM 1281 CB ARG A 81 -8.455 -35.242 -7.434 1.00 0.00 C ATOM 1282 CG ARG A 81 -9.980 -35.219 -7.403 1.00 0.00 C ATOM 1283 CD ARG A 81 -10.428 -35.277 -8.857 1.00 0.00 C ATOM 1284 NE ARG A 81 -11.881 -35.401 -8.989 1.00 0.00 N ATOM 1285 CZ ARG A 81 -12.611 -34.836 -9.961 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -12.071 -34.041 -10.891 1.00 0.00 N1+ ATOM 1287 NH2 ARG A 81 -13.924 -35.065 -10.016 1.00 0.00 N ATOM 0 H ARG A 81 -7.944 -33.003 -6.579 1.00 0.00 H new ATOM 0 HA ARG A 81 -8.502 -35.477 -5.294 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -8.094 -34.466 -8.109 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.114 -36.197 -7.834 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -10.372 -36.066 -6.839 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.347 -34.315 -6.917 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.095 -34.377 -9.373 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -9.948 -36.123 -9.349 1.00 0.00 H new ATOM 0 HE ARG A 81 -12.374 -35.958 -8.291 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.070 -33.846 -10.876 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -12.660 -33.630 -11.615 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -14.366 -35.667 -9.321 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -14.486 -34.638 -10.753 1.00 0.00 H new ATOM 1301 N SER A 82 -5.463 -34.960 -6.492 1.00 0.00 N ATOM 1302 CA SER A 82 -4.096 -35.451 -6.605 1.00 0.00 C ATOM 1303 C SER A 82 -3.265 -35.213 -5.347 1.00 0.00 C ATOM 1304 O SER A 82 -2.148 -35.715 -5.252 1.00 0.00 O ATOM 1305 CB SER A 82 -3.429 -34.752 -7.787 1.00 0.00 C ATOM 1306 OG SER A 82 -2.122 -35.250 -7.965 1.00 0.00 O ATOM 0 H SER A 82 -5.576 -34.001 -6.822 1.00 0.00 H new ATOM 0 HA SER A 82 -4.145 -36.530 -6.750 1.00 0.00 H new ATOM 0 HB2 SER A 82 -4.015 -34.912 -8.692 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.397 -33.676 -7.614 1.00 0.00 H new ATOM 0 HG SER A 82 -1.812 -35.661 -7.131 1.00 0.00 H new ATOM 1420 N PRO A 91 -11.396 -23.023 4.830 1.00 0.00 N ATOM 1421 CA PRO A 91 -11.179 -22.133 3.705 1.00 0.00 C ATOM 1422 C PRO A 91 -9.711 -22.268 3.326 1.00 0.00 C ATOM 1423 O PRO A 91 -8.852 -22.417 4.190 1.00 0.00 O ATOM 1424 CB PRO A 91 -11.516 -20.730 4.205 1.00 0.00 C ATOM 1425 CG PRO A 91 -11.178 -20.820 5.694 1.00 0.00 C ATOM 1426 CD PRO A 91 -11.563 -22.258 6.052 1.00 0.00 C ATOM 0 HA PRO A 91 -11.789 -22.355 2.829 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -10.925 -19.966 3.700 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -12.565 -20.482 4.041 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -10.121 -20.628 5.880 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -11.742 -20.094 6.280 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -10.928 -22.647 6.848 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -12.591 -22.311 6.410 1.00 0.00 H new ATOM 1434 N GLY A 92 -9.415 -22.220 2.031 1.00 0.00 N ATOM 1435 CA GLY A 92 -8.067 -22.493 1.577 1.00 0.00 C ATOM 1436 C GLY A 92 -7.943 -23.860 0.908 1.00 0.00 C ATOM 1437 O GLY A 92 -6.853 -24.427 0.890 1.00 0.00 O ATOM 0 H GLY A 92 -10.082 -21.998 1.292 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -7.760 -21.719 0.874 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -7.384 -22.443 2.425 1.00 0.00 H new ATOM 1441 N THR A 93 -9.043 -24.392 0.361 1.00 0.00 N ATOM 1442 CA THR A 93 -9.059 -25.658 -0.362 1.00 0.00 C ATOM 1443 C THR A 93 -10.207 -25.671 -1.361 1.00 0.00 C ATOM 1444 O THR A 93 -11.046 -24.774 -1.369 1.00 0.00 O ATOM 1445 CB THR A 93 -9.257 -26.838 0.591 1.00 0.00 C ATOM 1446 OG1 THR A 93 -10.398 -26.638 1.397 1.00 0.00 O ATOM 1447 CG2 THR A 93 -8.030 -27.098 1.455 1.00 0.00 C ATOM 0 H THR A 93 -9.958 -23.944 0.412 1.00 0.00 H new ATOM 0 HA THR A 93 -8.100 -25.755 -0.870 1.00 0.00 H new ATOM 0 HB THR A 93 -9.408 -27.725 -0.025 1.00 0.00 H new ATOM 0 HG1 THR A 93 -10.511 -27.403 1.999 1.00 0.00 H new ATOM 0 HG21 THR A 93 -8.222 -27.945 2.114 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.176 -27.321 0.816 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.813 -26.214 2.055 1.00 0.00 H new ATOM 1455 N CYS A 94 -10.240 -26.703 -2.209 1.00 0.00 N ATOM 1456 CA CYS A 94 -11.308 -26.900 -3.167 1.00 0.00 C ATOM 1457 C CYS A 94 -12.624 -27.096 -2.418 1.00 0.00 C ATOM 1458 O CYS A 94 -13.693 -26.875 -2.978 1.00 0.00 O ATOM 1459 CB CYS A 94 -10.983 -28.156 -3.978 1.00 0.00 C ATOM 1460 SG CYS A 94 -11.172 -29.613 -2.913 1.00 0.00 S ATOM 0 H CYS A 94 -9.519 -27.423 -2.243 1.00 0.00 H new ATOM 0 HA CYS A 94 -11.401 -26.037 -3.827 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -11.647 -28.230 -4.839 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -9.965 -28.102 -4.364 1.00 0.00 H new ATOM 0 HG CYS A 94 -10.621 -30.643 -3.484 1.00 0.00 H new ATOM 1466 N ALA A 95 -12.549 -27.513 -1.152 1.00 0.00 N ATOM 1467 CA ALA A 95 -13.735 -27.819 -0.385 1.00 0.00 C ATOM 1468 C ALA A 95 -14.572 -26.556 -0.224 1.00 0.00 C ATOM 1469 O ALA A 95 -15.732 -26.531 -0.626 1.00 0.00 O ATOM 1470 CB ALA A 95 -13.310 -28.377 0.968 1.00 0.00 C ATOM 0 H ALA A 95 -11.673 -27.643 -0.645 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.343 -28.565 -0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -14.195 -28.613 1.559 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.721 -29.282 0.820 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.709 -27.636 1.495 1.00 0.00 H new ATOM 1476 N HIS A 96 -13.984 -25.510 0.361 1.00 0.00 N ATOM 1477 CA HIS A 96 -14.694 -24.262 0.562 1.00 0.00 C ATOM 1478 C HIS A 96 -14.894 -23.551 -0.767 1.00 0.00 C ATOM 1479 O HIS A 96 -15.905 -22.879 -0.959 1.00 0.00 O ATOM 1480 CB HIS A 96 -13.888 -23.387 1.519 1.00 0.00 C ATOM 1481 CG HIS A 96 -14.605 -22.116 1.884 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -15.554 -21.992 2.903 1.00 0.00 N ATOM 1483 CD2 HIS A 96 -14.437 -20.907 1.271 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -15.937 -20.705 2.873 1.00 0.00 C ATOM 1485 NE2 HIS A 96 -15.281 -20.032 1.910 1.00 0.00 N ATOM 0 H HIS A 96 -13.022 -25.510 0.700 1.00 0.00 H new ATOM 0 HA HIS A 96 -15.676 -24.461 0.990 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -13.672 -23.951 2.426 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -12.930 -23.141 1.061 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -13.773 -20.684 0.449 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -16.672 -20.269 3.533 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -15.392 -19.042 1.692 1.00 0.00 H new ATOM 1493 N ALA A 97 -13.937 -23.691 -1.690 1.00 0.00 N ATOM 1494 CA ALA A 97 -13.995 -23.001 -2.962 1.00 0.00 C ATOM 1495 C ALA A 97 -15.165 -23.499 -3.804 1.00 0.00 C ATOM 1496 O ALA A 97 -15.983 -22.697 -4.249 1.00 0.00 O ATOM 1497 CB ALA A 97 -12.665 -23.193 -3.695 1.00 0.00 C ATOM 0 H ALA A 97 -13.114 -24.281 -1.569 1.00 0.00 H new ATOM 0 HA ALA A 97 -14.157 -21.937 -2.787 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -12.700 -22.676 -4.654 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -11.855 -22.783 -3.092 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -12.492 -24.256 -3.862 1.00 0.00 H new ATOM 1503 N ILE A 98 -15.261 -24.816 -4.033 1.00 0.00 N ATOM 1504 CA ILE A 98 -16.334 -25.344 -4.857 1.00 0.00 C ATOM 1505 C ILE A 98 -17.680 -25.230 -4.140 1.00 0.00 C ATOM 1506 O ILE A 98 -18.709 -25.095 -4.799 1.00 0.00 O ATOM 1507 CB ILE A 98 -16.018 -26.778 -5.310 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -14.984 -26.784 -6.447 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -17.281 -27.461 -5.848 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -13.545 -26.705 -5.941 1.00 0.00 C ATOM 0 H ILE A 98 -14.618 -25.516 -3.663 1.00 0.00 H new ATOM 0 HA ILE A 98 -16.412 -24.740 -5.761 1.00 0.00 H new ATOM 0 HB ILE A 98 -15.628 -27.307 -4.440 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -15.107 -27.691 -7.038 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -15.177 -25.942 -7.112 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -17.039 -28.476 -6.164 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -18.038 -27.496 -5.064 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -17.665 -26.898 -6.698 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.860 -26.713 -6.789 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.409 -25.784 -5.373 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -13.338 -27.561 -5.299 1.00 0.00 H new ATOM 1522 N ASN A 99 -17.703 -25.280 -2.803 1.00 0.00 N ATOM 1523 CA ASN A 99 -18.953 -25.100 -2.079 1.00 0.00 C ATOM 1524 C ASN A 99 -19.443 -23.659 -2.159 1.00 0.00 C ATOM 1525 O ASN A 99 -20.646 -23.433 -2.272 1.00 0.00 O ATOM 1526 CB ASN A 99 -18.745 -25.488 -0.621 1.00 0.00 C ATOM 1527 CG ASN A 99 -19.071 -26.961 -0.394 1.00 0.00 C ATOM 1528 OD1 ASN A 99 -20.232 -27.353 -0.446 1.00 0.00 O ATOM 1529 ND2 ASN A 99 -18.058 -27.784 -0.144 1.00 0.00 N ATOM 0 H ASN A 99 -16.885 -25.441 -2.216 1.00 0.00 H new ATOM 0 HA ASN A 99 -19.710 -25.737 -2.537 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -17.712 -25.292 -0.333 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -19.377 -24.870 0.017 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -18.234 -28.777 0.012 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -17.105 -27.423 -0.108 1.00 0.00 H new ATOM 1536 N THR A 100 -18.530 -22.683 -2.102 1.00 0.00 N ATOM 1537 CA THR A 100 -18.915 -21.279 -2.182 1.00 0.00 C ATOM 1538 C THR A 100 -19.457 -20.978 -3.569 1.00 0.00 C ATOM 1539 O THR A 100 -20.334 -20.133 -3.735 1.00 0.00 O ATOM 1540 CB THR A 100 -17.685 -20.409 -1.962 1.00 0.00 C ATOM 1541 OG1 THR A 100 -17.107 -20.672 -0.704 1.00 0.00 O ATOM 1542 CG2 THR A 100 -18.035 -18.922 -2.028 1.00 0.00 C ATOM 0 H THR A 100 -17.528 -22.843 -2.001 1.00 0.00 H new ATOM 0 HA THR A 100 -19.673 -21.074 -1.426 1.00 0.00 H new ATOM 0 HB THR A 100 -16.979 -20.651 -2.756 1.00 0.00 H new ATOM 0 HG1 THR A 100 -16.834 -21.612 -0.660 1.00 0.00 H new ATOM 0 HG21 THR A 100 -17.135 -18.329 -1.867 1.00 0.00 H new ATOM 0 HG22 THR A 100 -18.452 -18.690 -3.008 1.00 0.00 H new ATOM 0 HG23 THR A 100 -18.768 -18.686 -1.256 1.00 0.00 H new ATOM 1550 N LEU A 101 -18.933 -21.675 -4.578 1.00 0.00 N ATOM 1551 CA LEU A 101 -19.457 -21.542 -5.919 1.00 0.00 C ATOM 1552 C LEU A 101 -20.817 -22.223 -5.993 1.00 0.00 C ATOM 1553 O LEU A 101 -21.743 -21.690 -6.597 1.00 0.00 O ATOM 1554 CB LEU A 101 -18.478 -22.180 -6.900 1.00 0.00 C ATOM 1555 CG LEU A 101 -17.192 -21.371 -7.055 1.00 0.00 C ATOM 1556 CD1 LEU A 101 -16.208 -22.152 -7.925 1.00 0.00 C ATOM 1557 CD2 LEU A 101 -17.488 -20.030 -7.728 1.00 0.00 C ATOM 0 H LEU A 101 -18.155 -22.328 -4.485 1.00 0.00 H new ATOM 0 HA LEU A 101 -19.579 -20.490 -6.178 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -18.232 -23.186 -6.560 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -18.959 -22.282 -7.873 1.00 0.00 H new ATOM 0 HG LEU A 101 -16.766 -21.193 -6.068 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -15.288 -21.578 -8.039 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -15.983 -23.108 -7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -16.650 -22.328 -8.906 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -16.563 -19.463 -7.832 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -17.920 -20.205 -8.714 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -18.193 -19.465 -7.118 1.00 0.00 H new ATOM 1569 N GLY A 102 -20.949 -23.404 -5.380 1.00 0.00 N ATOM 1570 CA GLY A 102 -22.183 -24.169 -5.432 1.00 0.00 C ATOM 1571 C GLY A 102 -23.376 -23.409 -4.859 1.00 0.00 C ATOM 1572 O GLY A 102 -24.512 -23.821 -5.083 1.00 0.00 O ATOM 0 H GLY A 102 -20.206 -23.847 -4.840 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.394 -24.440 -6.467 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.052 -25.099 -4.880 1.00 0.00 H new ATOM 1576 N GLU A 103 -23.144 -22.312 -4.124 1.00 0.00 N ATOM 1577 CA GLU A 103 -24.230 -21.568 -3.503 1.00 0.00 C ATOM 1578 C GLU A 103 -24.567 -20.260 -4.227 1.00 0.00 C ATOM 1579 O GLU A 103 -25.503 -19.577 -3.822 1.00 0.00 O ATOM 1580 CB GLU A 103 -23.921 -21.356 -2.013 1.00 0.00 C ATOM 1581 CG GLU A 103 -22.667 -20.515 -1.791 1.00 0.00 C ATOM 1582 CD GLU A 103 -22.439 -20.196 -0.318 1.00 0.00 C ATOM 1583 OE1 GLU A 103 -23.299 -20.578 0.503 1.00 0.00 O ATOM 1584 OE2 GLU A 103 -21.396 -19.567 -0.033 1.00 0.00 O1- ATOM 0 H GLU A 103 -22.215 -21.928 -3.950 1.00 0.00 H new ATOM 0 HA GLU A 103 -25.137 -22.167 -3.591 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -24.771 -20.869 -1.535 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -23.795 -22.325 -1.530 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -21.801 -21.047 -2.184 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.751 -19.585 -2.353 1.00 0.00 H new ATOM 1591 N VAL A 104 -23.830 -19.895 -5.284 1.00 0.00 N ATOM 1592 CA VAL A 104 -24.157 -18.693 -6.056 1.00 0.00 C ATOM 1593 C VAL A 104 -23.903 -18.854 -7.553 1.00 0.00 C ATOM 1594 O VAL A 104 -24.268 -17.973 -8.329 1.00 0.00 O ATOM 1595 CB VAL A 104 -23.382 -17.469 -5.548 1.00 0.00 C ATOM 1596 CG1 VAL A 104 -23.721 -17.133 -4.096 1.00 0.00 C ATOM 1597 CG2 VAL A 104 -21.871 -17.660 -5.697 1.00 0.00 C ATOM 0 H VAL A 104 -23.015 -20.408 -5.620 1.00 0.00 H new ATOM 0 HA VAL A 104 -25.226 -18.540 -5.909 1.00 0.00 H new ATOM 0 HB VAL A 104 -23.693 -16.630 -6.171 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -23.149 -16.260 -3.781 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -24.786 -16.918 -4.011 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -23.470 -17.981 -3.458 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -21.354 -16.774 -5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -21.556 -18.531 -5.122 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -21.625 -17.811 -6.748 1.00 0.00 H new ATOM 1607 N ILE A 105 -23.287 -19.958 -7.985 1.00 0.00 N ATOM 1608 CA ILE A 105 -22.944 -20.139 -9.388 1.00 0.00 C ATOM 1609 C ILE A 105 -24.200 -20.212 -10.254 1.00 0.00 C ATOM 1610 O ILE A 105 -24.153 -19.912 -11.444 1.00 0.00 O ATOM 1611 CB ILE A 105 -22.084 -21.402 -9.547 1.00 0.00 C ATOM 1612 CG1 ILE A 105 -21.488 -21.518 -10.956 1.00 0.00 C ATOM 1613 CG2 ILE A 105 -22.914 -22.660 -9.279 1.00 0.00 C ATOM 1614 CD1 ILE A 105 -20.494 -20.388 -11.218 1.00 0.00 C ATOM 0 H ILE A 105 -23.019 -20.735 -7.381 1.00 0.00 H new ATOM 0 HA ILE A 105 -22.368 -19.278 -9.727 1.00 0.00 H new ATOM 0 HB ILE A 105 -21.275 -21.317 -8.822 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -20.989 -22.481 -11.067 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -22.286 -21.486 -11.697 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -22.285 -23.543 -9.397 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -23.306 -22.627 -8.263 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -23.742 -22.707 -9.986 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -20.084 -20.490 -12.223 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -21.003 -19.428 -11.129 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -19.685 -20.439 -10.489 1.00 0.00 H new ATOM 1626 N GLN A 106 -25.329 -20.613 -9.663 1.00 0.00 N ATOM 1627 CA GLN A 106 -26.550 -20.804 -10.426 1.00 0.00 C ATOM 1628 C GLN A 106 -27.117 -19.470 -10.909 1.00 0.00 C ATOM 1629 O GLN A 106 -27.587 -19.385 -12.044 1.00 0.00 O ATOM 1630 CB GLN A 106 -27.550 -21.602 -9.586 1.00 0.00 C ATOM 1631 CG GLN A 106 -27.885 -20.925 -8.254 1.00 0.00 C ATOM 1632 CD GLN A 106 -28.774 -21.804 -7.385 1.00 0.00 C ATOM 1633 OE1 GLN A 106 -29.262 -22.841 -7.825 1.00 0.00 O ATOM 1634 NE2 GLN A 106 -28.990 -21.393 -6.138 1.00 0.00 N ATOM 0 H GLN A 106 -25.416 -20.809 -8.666 1.00 0.00 H new ATOM 0 HA GLN A 106 -26.332 -21.378 -11.327 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -28.468 -21.741 -10.158 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -27.143 -22.594 -9.391 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -26.963 -20.698 -7.719 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -28.386 -19.976 -8.444 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -28.568 -20.526 -5.807 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -29.578 -21.945 -5.514 1.00 0.00 H new ATOM 1643 N GLU A 107 -27.083 -18.425 -10.075 1.00 0.00 N ATOM 1644 CA GLU A 107 -27.525 -17.108 -10.500 1.00 0.00 C ATOM 1645 C GLU A 107 -26.437 -16.406 -11.310 1.00 0.00 C ATOM 1646 O GLU A 107 -26.738 -15.532 -12.122 1.00 0.00 O ATOM 1647 CB GLU A 107 -27.941 -16.281 -9.283 1.00 0.00 C ATOM 1648 CG GLU A 107 -29.203 -16.879 -8.660 1.00 0.00 C ATOM 1649 CD GLU A 107 -30.343 -17.010 -9.670 1.00 0.00 C ATOM 1650 OE1 GLU A 107 -30.456 -16.118 -10.541 1.00 0.00 O ATOM 1651 OE2 GLU A 107 -31.096 -18.002 -9.565 1.00 0.00 O1- ATOM 0 H GLU A 107 -26.755 -18.472 -9.110 1.00 0.00 H new ATOM 0 HA GLU A 107 -28.393 -17.217 -11.150 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -27.135 -16.264 -8.550 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -28.124 -15.248 -9.579 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -28.971 -17.861 -8.248 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -29.527 -16.253 -7.829 1.00 0.00 H new ATOM 1658 N LEU A 108 -25.172 -16.783 -11.093 1.00 0.00 N ATOM 1659 CA LEU A 108 -24.063 -16.227 -11.848 1.00 0.00 C ATOM 1660 C LEU A 108 -24.161 -16.705 -13.297 1.00 0.00 C ATOM 1661 O LEU A 108 -23.933 -15.926 -14.221 1.00 0.00 O ATOM 1662 CB LEU A 108 -22.759 -16.651 -11.167 1.00 0.00 C ATOM 1663 CG LEU A 108 -21.508 -15.971 -11.734 1.00 0.00 C ATOM 1664 CD1 LEU A 108 -20.414 -16.007 -10.667 1.00 0.00 C ATOM 1665 CD2 LEU A 108 -20.969 -16.678 -12.978 1.00 0.00 C ATOM 0 H LEU A 108 -24.898 -17.475 -10.395 1.00 0.00 H new ATOM 0 HA LEU A 108 -24.090 -15.137 -11.867 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -22.829 -16.429 -10.102 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -22.647 -17.731 -11.261 1.00 0.00 H new ATOM 0 HG LEU A 108 -21.784 -14.954 -12.012 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -19.514 -15.527 -11.052 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -20.756 -15.477 -9.778 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -20.191 -17.042 -10.409 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -20.083 -16.155 -13.338 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -20.707 -17.706 -12.727 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -21.732 -16.677 -13.756 1.00 0.00 H new ATOM 1677 N LEU A 109 -24.499 -17.984 -13.497 1.00 0.00 N ATOM 1678 CA LEU A 109 -24.731 -18.531 -14.823 1.00 0.00 C ATOM 1679 C LEU A 109 -26.009 -17.925 -15.394 1.00 0.00 C ATOM 1680 O LEU A 109 -25.992 -17.403 -16.503 1.00 0.00 O ATOM 1681 CB LEU A 109 -24.823 -20.062 -14.760 1.00 0.00 C ATOM 1682 CG LEU A 109 -23.458 -20.685 -14.439 1.00 0.00 C ATOM 1683 CD1 LEU A 109 -23.636 -22.131 -13.986 1.00 0.00 C ATOM 1684 CD2 LEU A 109 -22.562 -20.659 -15.680 1.00 0.00 C ATOM 0 H LEU A 109 -24.617 -18.660 -12.742 1.00 0.00 H new ATOM 0 HA LEU A 109 -23.897 -18.278 -15.478 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -25.548 -20.355 -14.000 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -25.187 -20.447 -15.713 1.00 0.00 H new ATOM 0 HG LEU A 109 -22.993 -20.106 -13.641 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -22.662 -22.564 -13.761 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -24.261 -22.158 -13.093 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -24.113 -22.705 -14.780 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -21.596 -21.104 -15.441 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -23.034 -21.227 -16.482 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -22.417 -19.628 -16.003 1.00 0.00 H new ATOM 1696 N SER A 110 -27.108 -17.992 -14.641 1.00 0.00 N ATOM 1697 CA SER A 110 -28.376 -17.371 -15.011 1.00 0.00 C ATOM 1698 C SER A 110 -28.194 -15.970 -15.592 1.00 0.00 C ATOM 1699 O SER A 110 -28.759 -15.664 -16.645 1.00 0.00 O ATOM 1700 CB SER A 110 -29.270 -17.268 -13.776 1.00 0.00 C ATOM 1701 OG SER A 110 -30.527 -16.734 -14.133 1.00 0.00 O ATOM 0 H SER A 110 -27.141 -18.485 -13.748 1.00 0.00 H new ATOM 0 HA SER A 110 -28.829 -18.000 -15.777 1.00 0.00 H new ATOM 0 HB2 SER A 110 -29.398 -18.253 -13.327 1.00 0.00 H new ATOM 0 HB3 SER A 110 -28.796 -16.635 -13.026 1.00 0.00 H new ATOM 0 HG SER A 110 -31.095 -16.673 -13.336 1.00 0.00 H new ATOM 1707 N ASP A 111 -27.412 -15.123 -14.914 1.00 0.00 N ATOM 1708 CA ASP A 111 -27.159 -13.771 -15.387 1.00 0.00 C ATOM 1709 C ASP A 111 -26.328 -13.814 -16.661 1.00 0.00 C ATOM 1710 O ASP A 111 -26.582 -13.064 -17.597 1.00 0.00 O ATOM 1711 CB ASP A 111 -26.392 -12.980 -14.325 1.00 0.00 C ATOM 1712 CG ASP A 111 -26.186 -11.524 -14.735 1.00 0.00 C ATOM 1713 OD1 ASP A 111 -27.027 -11.011 -15.502 1.00 0.00 O ATOM 1714 OD2 ASP A 111 -25.184 -10.930 -14.276 1.00 0.00 O1- ATOM 0 H ASP A 111 -26.947 -15.356 -14.037 1.00 0.00 H new ATOM 0 HA ASP A 111 -28.116 -13.288 -15.586 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -26.936 -13.017 -13.381 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -25.423 -13.449 -14.153 1.00 0.00 H new ATOM 1719 N ALA A 112 -25.326 -14.698 -16.707 1.00 0.00 N ATOM 1720 CA ALA A 112 -24.446 -14.762 -17.852 1.00 0.00 C ATOM 1721 C ALA A 112 -25.197 -15.265 -19.087 1.00 0.00 C ATOM 1722 O ALA A 112 -24.882 -14.846 -20.195 1.00 0.00 O ATOM 1723 CB ALA A 112 -23.261 -15.669 -17.522 1.00 0.00 C ATOM 0 H ALA A 112 -25.115 -15.368 -15.967 1.00 0.00 H new ATOM 0 HA ALA A 112 -24.077 -13.762 -18.081 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -22.593 -15.722 -18.382 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -22.720 -15.264 -16.666 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -23.624 -16.669 -17.282 1.00 0.00 H new ATOM 1729 N ILE A 113 -26.184 -16.154 -18.916 1.00 0.00 N ATOM 1730 CA ILE A 113 -26.958 -16.655 -20.044 1.00 0.00 C ATOM 1731 C ILE A 113 -27.853 -15.551 -20.591 1.00 0.00 C ATOM 1732 O ILE A 113 -28.019 -15.440 -21.801 1.00 0.00 O ATOM 1733 CB ILE A 113 -27.839 -17.842 -19.619 1.00 0.00 C ATOM 1734 CG1 ILE A 113 -27.054 -19.048 -19.097 1.00 0.00 C ATOM 1735 CG2 ILE A 113 -28.705 -18.276 -20.805 1.00 0.00 C ATOM 1736 CD1 ILE A 113 -26.003 -19.563 -20.073 1.00 0.00 C ATOM 0 H ILE A 113 -26.459 -16.535 -18.011 1.00 0.00 H new ATOM 0 HA ILE A 113 -26.259 -16.985 -20.812 1.00 0.00 H new ATOM 0 HB ILE A 113 -28.449 -17.491 -18.787 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -26.566 -18.775 -18.161 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -27.752 -19.854 -18.869 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -29.332 -19.117 -20.509 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -29.337 -17.445 -21.117 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -28.063 -18.575 -21.634 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -25.487 -20.418 -19.635 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -26.487 -19.868 -21.001 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -25.282 -18.773 -20.282 1.00 0.00 H new ATOM 1748 N ALA A 114 -28.431 -14.733 -19.708 1.00 0.00 N ATOM 1749 CA ALA A 114 -29.297 -13.649 -20.138 1.00 0.00 C ATOM 1750 C ALA A 114 -28.495 -12.498 -20.738 1.00 0.00 C ATOM 1751 O ALA A 114 -28.833 -11.997 -21.812 1.00 0.00 O ATOM 1752 CB ALA A 114 -30.094 -13.144 -18.932 1.00 0.00 C ATOM 0 H ALA A 114 -28.312 -14.805 -18.698 1.00 0.00 H new ATOM 0 HA ALA A 114 -29.969 -14.026 -20.909 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -30.748 -12.329 -19.243 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -30.696 -13.958 -18.527 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -29.407 -12.785 -18.166 1.00 0.00 H new ATOM 1758 N LYS A 115 -27.436 -12.087 -20.039 1.00 0.00 N ATOM 1759 CA LYS A 115 -26.647 -10.912 -20.365 1.00 0.00 C ATOM 1760 C LYS A 115 -25.689 -11.124 -21.532 1.00 0.00 C ATOM 1761 O LYS A 115 -25.407 -10.172 -22.259 1.00 0.00 O ATOM 1762 CB LYS A 115 -25.885 -10.549 -19.094 1.00 0.00 C ATOM 1763 CG LYS A 115 -25.220 -9.175 -19.152 1.00 0.00 C ATOM 1764 CD LYS A 115 -24.748 -8.823 -17.740 1.00 0.00 C ATOM 1765 CE LYS A 115 -25.931 -8.473 -16.833 1.00 0.00 C ATOM 1766 NZ LYS A 115 -25.536 -8.441 -15.415 1.00 0.00 N1+ ATOM 0 H LYS A 115 -27.100 -12.579 -19.211 1.00 0.00 H new ATOM 0 HA LYS A 115 -27.307 -10.110 -20.695 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -26.572 -10.576 -18.248 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -25.122 -11.305 -18.909 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -24.378 -9.187 -19.844 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -25.922 -8.426 -19.518 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -24.198 -9.664 -17.317 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -24.058 -7.980 -17.784 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -26.336 -7.503 -17.120 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -26.727 -9.205 -16.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -26.379 -8.302 -14.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -25.079 -9.340 -15.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -24.870 -7.658 -15.258 1.00 0.00 H new ATOM 1780 N SER A 116 -25.186 -12.347 -21.721 1.00 0.00 N ATOM 1781 CA SER A 116 -24.169 -12.587 -22.740 1.00 0.00 C ATOM 1782 C SER A 116 -24.801 -12.952 -24.083 1.00 0.00 C ATOM 1783 O SER A 116 -25.888 -13.529 -24.121 1.00 0.00 O ATOM 1784 CB SER A 116 -23.138 -13.607 -22.254 1.00 0.00 C ATOM 1785 OG SER A 116 -22.860 -13.411 -20.886 1.00 0.00 O ATOM 0 H SER A 116 -25.463 -13.172 -21.190 1.00 0.00 H new ATOM 0 HA SER A 116 -23.623 -11.659 -22.912 1.00 0.00 H new ATOM 0 HB2 SER A 116 -23.513 -14.618 -22.414 1.00 0.00 H new ATOM 0 HB3 SER A 116 -22.221 -13.512 -22.835 1.00 0.00 H new ATOM 0 HG SER A 116 -23.595 -13.773 -20.348 1.00 0.00 H new ATOM 1791 N ASN A 117 -24.122 -12.617 -25.187 1.00 0.00 N ATOM 1792 CA ASN A 117 -24.662 -12.793 -26.531 1.00 0.00 C ATOM 1793 C ASN A 117 -24.718 -14.273 -26.900 1.00 0.00 C ATOM 1794 O ASN A 117 -24.159 -15.100 -26.190 1.00 0.00 O ATOM 1795 CB ASN A 117 -23.820 -12.007 -27.539 1.00 0.00 C ATOM 1796 CG ASN A 117 -24.623 -11.702 -28.796 1.00 0.00 C ATOM 1797 OD1 ASN A 117 -25.660 -11.048 -28.725 1.00 0.00 O ATOM 1798 ND2 ASN A 117 -24.162 -12.166 -29.955 1.00 0.00 N ATOM 0 H ASN A 117 -23.184 -12.217 -25.169 1.00 0.00 H new ATOM 0 HA ASN A 117 -25.681 -12.406 -26.555 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -23.478 -11.076 -27.086 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -22.930 -12.580 -27.801 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -24.673 -11.981 -30.818 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -23.297 -12.706 -29.980 1.00 0.00 H new ATOM 1805 N GLN A 118 -25.387 -14.618 -28.006 1.00 0.00 N ATOM 1806 CA GLN A 118 -25.614 -16.011 -28.369 1.00 0.00 C ATOM 1807 C GLN A 118 -24.308 -16.799 -28.454 1.00 0.00 C ATOM 1808 O GLN A 118 -24.271 -17.972 -28.091 1.00 0.00 O ATOM 1809 CB GLN A 118 -26.333 -16.064 -29.715 1.00 0.00 C ATOM 1810 CG GLN A 118 -27.594 -15.197 -29.680 1.00 0.00 C ATOM 1811 CD GLN A 118 -28.511 -15.490 -30.861 1.00 0.00 C ATOM 1812 OE1 GLN A 118 -29.728 -15.544 -30.706 1.00 0.00 O ATOM 1813 NE2 GLN A 118 -27.942 -15.679 -32.048 1.00 0.00 N ATOM 0 H GLN A 118 -25.780 -13.945 -28.664 1.00 0.00 H new ATOM 0 HA GLN A 118 -26.224 -16.469 -27.591 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -25.667 -15.716 -30.505 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -26.599 -17.094 -29.953 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -28.132 -15.374 -28.749 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -27.312 -14.144 -29.690 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -26.928 -15.627 -32.141 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -28.520 -15.876 -32.865 1.00 0.00 H new ATOM 1822 N ASP A 119 -23.240 -16.158 -28.931 1.00 0.00 N ATOM 1823 CA ASP A 119 -21.933 -16.793 -29.026 1.00 0.00 C ATOM 1824 C ASP A 119 -21.398 -17.079 -27.624 1.00 0.00 C ATOM 1825 O ASP A 119 -20.716 -18.075 -27.397 1.00 0.00 O ATOM 1826 CB ASP A 119 -20.964 -15.869 -29.772 1.00 0.00 C ATOM 1827 CG ASP A 119 -21.659 -15.004 -30.821 1.00 0.00 C ATOM 1828 OD1 ASP A 119 -22.389 -14.080 -30.396 1.00 0.00 O ATOM 1829 OD2 ASP A 119 -21.450 -15.280 -32.020 1.00 0.00 O1- ATOM 0 H ASP A 119 -23.260 -15.192 -29.259 1.00 0.00 H new ATOM 0 HA ASP A 119 -22.027 -17.731 -29.573 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -20.458 -15.224 -29.053 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -20.195 -16.471 -30.256 1.00 0.00 H new ATOM 1834 N HIS A 120 -21.716 -16.191 -26.682 1.00 0.00 N ATOM 1835 CA HIS A 120 -21.303 -16.329 -25.301 1.00 0.00 C ATOM 1836 C HIS A 120 -22.156 -17.396 -24.628 1.00 0.00 C ATOM 1837 O HIS A 120 -21.631 -18.200 -23.864 1.00 0.00 O ATOM 1838 CB HIS A 120 -21.481 -14.995 -24.582 1.00 0.00 C ATOM 1839 CG HIS A 120 -20.874 -13.798 -25.269 1.00 0.00 C ATOM 1840 ND1 HIS A 120 -21.107 -12.470 -24.894 1.00 0.00 N ATOM 1841 CD2 HIS A 120 -20.018 -13.814 -26.334 1.00 0.00 C ATOM 1842 CE1 HIS A 120 -20.381 -11.722 -25.739 1.00 0.00 C ATOM 1843 NE2 HIS A 120 -19.723 -12.501 -26.618 1.00 0.00 N ATOM 0 H HIS A 120 -22.270 -15.354 -26.865 1.00 0.00 H new ATOM 0 HA HIS A 120 -20.254 -16.622 -25.257 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -22.548 -14.813 -24.450 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -21.046 -15.079 -23.586 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -19.646 -14.686 -26.851 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -20.331 -10.643 -25.717 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -19.111 -12.174 -27.366 1.00 0.00 H new ATOM 1851 N LYS A 121 -23.465 -17.404 -24.912 1.00 0.00 N ATOM 1852 CA LYS A 121 -24.363 -18.415 -24.373 1.00 0.00 C ATOM 1853 C LYS A 121 -23.820 -19.795 -24.728 1.00 0.00 C ATOM 1854 O LYS A 121 -23.811 -20.684 -23.884 1.00 0.00 O ATOM 1855 CB LYS A 121 -25.779 -18.270 -24.941 1.00 0.00 C ATOM 1856 CG LYS A 121 -26.435 -16.917 -24.659 1.00 0.00 C ATOM 1857 CD LYS A 121 -27.883 -16.947 -25.162 1.00 0.00 C ATOM 1858 CE LYS A 121 -28.439 -15.547 -25.435 1.00 0.00 C ATOM 1859 NZ LYS A 121 -28.323 -14.658 -24.266 1.00 0.00 N1+ ATOM 0 H LYS A 121 -23.919 -16.717 -25.514 1.00 0.00 H new ATOM 0 HA LYS A 121 -24.417 -18.286 -23.292 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -25.743 -18.425 -26.019 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -26.407 -19.059 -24.526 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -26.413 -16.704 -23.590 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -25.881 -16.120 -25.155 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -27.934 -17.539 -26.076 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -28.510 -17.446 -24.423 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -27.907 -15.106 -26.278 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -29.487 -15.626 -25.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -29.204 -14.116 -24.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -28.155 -15.227 -23.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -27.528 -14.002 -24.406 1.00 0.00 H new ATOM 1873 N GLU A 122 -23.367 -19.971 -25.974 1.00 0.00 N ATOM 1874 CA GLU A 122 -22.842 -21.249 -26.426 1.00 0.00 C ATOM 1875 C GLU A 122 -21.552 -21.592 -25.687 1.00 0.00 C ATOM 1876 O GLU A 122 -21.363 -22.744 -25.295 1.00 0.00 O ATOM 1877 CB GLU A 122 -22.613 -21.193 -27.938 1.00 0.00 C ATOM 1878 CG GLU A 122 -21.982 -22.484 -28.469 1.00 0.00 C ATOM 1879 CD GLU A 122 -22.798 -23.729 -28.114 1.00 0.00 C ATOM 1880 OE1 GLU A 122 -24.023 -23.582 -27.918 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -22.179 -24.810 -28.043 1.00 0.00 O1- ATOM 0 H GLU A 122 -23.357 -19.238 -26.683 1.00 0.00 H new ATOM 0 HA GLU A 122 -23.564 -22.036 -26.207 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -23.563 -21.019 -28.443 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -21.966 -20.348 -28.176 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -21.883 -22.416 -29.552 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -20.976 -22.586 -28.062 1.00 0.00 H new ATOM 1888 N LYS A 123 -20.659 -20.619 -25.483 1.00 0.00 N ATOM 1889 CA LYS A 123 -19.433 -20.907 -24.760 1.00 0.00 C ATOM 1890 C LYS A 123 -19.722 -21.247 -23.303 1.00 0.00 C ATOM 1891 O LYS A 123 -18.967 -21.998 -22.692 1.00 0.00 O ATOM 1892 CB LYS A 123 -18.471 -19.727 -24.868 1.00 0.00 C ATOM 1893 CG LYS A 123 -17.875 -19.714 -26.274 1.00 0.00 C ATOM 1894 CD LYS A 123 -16.795 -18.641 -26.387 1.00 0.00 C ATOM 1895 CE LYS A 123 -16.062 -18.832 -27.713 1.00 0.00 C ATOM 1896 NZ LYS A 123 -14.885 -17.952 -27.801 1.00 0.00 N1+ ATOM 0 H LYS A 123 -20.762 -19.655 -25.800 1.00 0.00 H new ATOM 0 HA LYS A 123 -18.962 -21.780 -25.212 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.995 -18.792 -24.670 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -17.681 -19.813 -24.122 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -17.451 -20.691 -26.505 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -18.660 -19.527 -27.006 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -17.241 -17.648 -26.340 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -16.097 -18.717 -25.553 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -15.751 -19.872 -27.813 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -16.740 -18.621 -28.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -14.406 -18.103 -28.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -15.187 -16.960 -27.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -14.229 -18.171 -27.025 1.00 0.00 H new ATOM 1910 N ILE A 124 -20.804 -20.715 -22.726 1.00 0.00 N ATOM 1911 CA ILE A 124 -21.145 -21.047 -21.351 1.00 0.00 C ATOM 1912 C ILE A 124 -21.669 -22.478 -21.277 1.00 0.00 C ATOM 1913 O ILE A 124 -21.369 -23.192 -20.320 1.00 0.00 O ATOM 1914 CB ILE A 124 -22.177 -20.052 -20.823 1.00 0.00 C ATOM 1915 CG1 ILE A 124 -21.562 -18.650 -20.777 1.00 0.00 C ATOM 1916 CG2 ILE A 124 -22.634 -20.457 -19.417 1.00 0.00 C ATOM 1917 CD1 ILE A 124 -22.651 -17.580 -20.768 1.00 0.00 C ATOM 0 H ILE A 124 -21.444 -20.066 -23.184 1.00 0.00 H new ATOM 0 HA ILE A 124 -20.255 -20.981 -20.726 1.00 0.00 H new ATOM 0 HB ILE A 124 -23.040 -20.052 -21.489 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -20.940 -18.550 -19.887 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.911 -18.505 -21.639 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -23.369 -19.740 -19.053 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -23.082 -21.450 -19.452 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -21.776 -20.470 -18.745 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -22.191 -16.593 -20.735 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -23.256 -17.669 -21.671 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -23.285 -17.714 -19.892 1.00 0.00 H new ATOM 1929 N ARG A 125 -22.450 -22.919 -22.271 1.00 0.00 N ATOM 1930 CA ARG A 125 -22.984 -24.272 -22.253 1.00 0.00 C ATOM 1931 C ARG A 125 -21.860 -25.300 -22.346 1.00 0.00 C ATOM 1932 O ARG A 125 -21.917 -26.319 -21.662 1.00 0.00 O ATOM 1933 CB ARG A 125 -23.966 -24.487 -23.409 1.00 0.00 C ATOM 1934 CG ARG A 125 -25.229 -23.627 -23.308 1.00 0.00 C ATOM 1935 CD ARG A 125 -25.982 -23.838 -21.998 1.00 0.00 C ATOM 1936 NE ARG A 125 -27.275 -23.149 -22.050 1.00 0.00 N ATOM 1937 CZ ARG A 125 -27.921 -22.602 -21.017 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -27.435 -22.663 -19.777 1.00 0.00 N1+ ATOM 1939 NH2 ARG A 125 -29.079 -21.983 -21.240 1.00 0.00 N ATOM 0 H ARG A 125 -22.719 -22.363 -23.083 1.00 0.00 H new ATOM 0 HA ARG A 125 -23.512 -24.404 -21.309 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -23.461 -24.267 -24.350 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -24.254 -25.538 -23.440 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -24.956 -22.576 -23.400 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -25.889 -23.859 -24.143 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -26.134 -24.903 -21.823 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -25.391 -23.459 -21.164 1.00 0.00 H new ATOM 0 HE ARG A 125 -27.725 -23.081 -22.963 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -26.549 -23.136 -19.599 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -27.949 -22.237 -19.006 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -29.457 -21.933 -22.186 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -29.588 -21.559 -20.465 1.00 0.00 H new ATOM 1953 N MET A 126 -20.844 -25.052 -23.178 1.00 0.00 N ATOM 1954 CA MET A 126 -19.752 -26.008 -23.306 1.00 0.00 C ATOM 1955 C MET A 126 -18.876 -26.003 -22.054 1.00 0.00 C ATOM 1956 O MET A 126 -18.303 -27.035 -21.713 1.00 0.00 O ATOM 1957 CB MET A 126 -18.933 -25.719 -24.565 1.00 0.00 C ATOM 1958 CG MET A 126 -18.221 -24.371 -24.490 1.00 0.00 C ATOM 1959 SD MET A 126 -17.185 -23.984 -25.923 1.00 0.00 S ATOM 1960 CE MET A 126 -15.895 -25.238 -25.716 1.00 0.00 C ATOM 0 H MET A 126 -20.759 -24.217 -23.758 1.00 0.00 H new ATOM 0 HA MET A 126 -20.175 -27.008 -23.405 1.00 0.00 H new ATOM 0 HB2 MET A 126 -18.197 -26.510 -24.707 1.00 0.00 H new ATOM 0 HB3 MET A 126 -19.589 -25.734 -25.435 1.00 0.00 H new ATOM 0 HG2 MET A 126 -18.969 -23.586 -24.376 1.00 0.00 H new ATOM 0 HG3 MET A 126 -17.600 -24.352 -23.594 1.00 0.00 H new ATOM 0 HE1 MET A 126 -15.039 -24.987 -26.343 1.00 0.00 H new ATOM 0 HE2 MET A 126 -15.583 -25.270 -24.672 1.00 0.00 H new ATOM 0 HE3 MET A 126 -16.285 -26.213 -26.008 1.00 0.00 H new ATOM 1970 N LEU A 127 -18.757 -24.863 -21.366 1.00 0.00 N ATOM 1971 CA LEU A 127 -18.017 -24.830 -20.112 1.00 0.00 C ATOM 1972 C LEU A 127 -18.718 -25.694 -19.066 1.00 0.00 C ATOM 1973 O LEU A 127 -18.048 -26.331 -18.258 1.00 0.00 O ATOM 1974 CB LEU A 127 -17.880 -23.384 -19.633 1.00 0.00 C ATOM 1975 CG LEU A 127 -16.907 -22.585 -20.504 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -17.101 -21.103 -20.187 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -15.457 -22.976 -20.227 1.00 0.00 C ATOM 0 H LEU A 127 -19.157 -23.970 -21.653 1.00 0.00 H new ATOM 0 HA LEU A 127 -17.018 -25.237 -20.268 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.858 -22.903 -19.646 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -17.534 -23.375 -18.599 1.00 0.00 H new ATOM 0 HG LEU A 127 -17.112 -22.795 -21.554 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -16.419 -20.509 -20.795 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -18.129 -20.815 -20.408 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -16.894 -20.927 -19.131 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -14.794 -22.389 -20.863 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -15.221 -22.782 -19.181 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -15.319 -24.036 -20.440 1.00 0.00 H new ATOM 1989 N LEU A 128 -20.056 -25.726 -19.066 1.00 0.00 N ATOM 1990 CA LEU A 128 -20.789 -26.560 -18.123 1.00 0.00 C ATOM 1991 C LEU A 128 -20.601 -28.041 -18.454 1.00 0.00 C ATOM 1992 O LEU A 128 -20.531 -28.864 -17.543 1.00 0.00 O ATOM 1993 CB LEU A 128 -22.271 -26.187 -18.146 1.00 0.00 C ATOM 1994 CG LEU A 128 -22.515 -24.765 -17.632 1.00 0.00 C ATOM 1995 CD1 LEU A 128 -23.974 -24.378 -17.863 1.00 0.00 C ATOM 1996 CD2 LEU A 128 -22.191 -24.662 -16.143 1.00 0.00 C ATOM 0 H LEU A 128 -20.643 -25.188 -19.704 1.00 0.00 H new ATOM 0 HA LEU A 128 -20.397 -26.387 -17.121 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -22.651 -26.274 -19.164 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -22.832 -26.894 -17.535 1.00 0.00 H new ATOM 0 HG LEU A 128 -21.861 -24.085 -18.178 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -24.144 -23.366 -17.496 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -24.197 -24.420 -18.929 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -24.623 -25.072 -17.329 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -22.372 -23.643 -15.801 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -22.825 -25.350 -15.584 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -21.144 -24.919 -15.980 1.00 0.00 H new ATOM 2008 N ASP A 129 -20.518 -28.387 -19.743 1.00 0.00 N ATOM 2009 CA ASP A 129 -20.261 -29.763 -20.142 1.00 0.00 C ATOM 2010 C ASP A 129 -18.884 -30.187 -19.639 1.00 0.00 C ATOM 2011 O ASP A 129 -18.725 -31.283 -19.107 1.00 0.00 O ATOM 2012 CB ASP A 129 -20.323 -29.860 -21.664 1.00 0.00 C ATOM 2013 CG ASP A 129 -19.947 -31.254 -22.148 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -20.402 -32.227 -21.508 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -19.209 -31.325 -23.153 1.00 0.00 O1- ATOM 0 H ASP A 129 -20.625 -27.733 -20.519 1.00 0.00 H new ATOM 0 HA ASP A 129 -21.012 -30.425 -19.711 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -21.329 -29.614 -22.005 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -19.648 -29.126 -22.105 1.00 0.00 H new ATOM 2020 N ILE A 130 -17.885 -29.317 -19.806 1.00 0.00 N ATOM 2021 CA ILE A 130 -16.527 -29.601 -19.371 1.00 0.00 C ATOM 2022 C ILE A 130 -16.498 -29.821 -17.861 1.00 0.00 C ATOM 2023 O ILE A 130 -15.712 -30.634 -17.375 1.00 0.00 O ATOM 2024 CB ILE A 130 -15.625 -28.438 -19.792 1.00 0.00 C ATOM 2025 CG1 ILE A 130 -15.493 -28.416 -21.321 1.00 0.00 C ATOM 2026 CG2 ILE A 130 -14.237 -28.566 -19.160 1.00 0.00 C ATOM 2027 CD1 ILE A 130 -15.016 -27.043 -21.782 1.00 0.00 C ATOM 0 H ILE A 130 -17.999 -28.403 -20.244 1.00 0.00 H new ATOM 0 HA ILE A 130 -16.160 -30.515 -19.839 1.00 0.00 H new ATOM 0 HB ILE A 130 -16.078 -27.509 -19.446 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -14.789 -29.183 -21.645 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -16.453 -28.650 -21.781 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.615 -27.728 -19.475 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -14.330 -28.561 -18.074 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -13.776 -29.500 -19.481 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -14.925 -27.035 -22.868 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -15.736 -26.285 -21.473 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -14.046 -26.826 -21.335 1.00 0.00 H new ATOM 2039 N TRP A 131 -17.346 -29.106 -17.115 1.00 0.00 N ATOM 2040 CA TRP A 131 -17.353 -29.261 -15.671 1.00 0.00 C ATOM 2041 C TRP A 131 -18.026 -30.555 -15.223 1.00 0.00 C ATOM 2042 O TRP A 131 -17.620 -31.131 -14.215 1.00 0.00 O ATOM 2043 CB TRP A 131 -18.032 -28.061 -15.011 1.00 0.00 C ATOM 2044 CG TRP A 131 -17.411 -26.727 -15.285 1.00 0.00 C ATOM 2045 CD1 TRP A 131 -16.249 -26.518 -15.943 1.00 0.00 C ATOM 2046 CD2 TRP A 131 -17.896 -25.397 -14.920 1.00 0.00 C ATOM 2047 NE1 TRP A 131 -15.992 -25.168 -16.020 1.00 0.00 N ATOM 2048 CE2 TRP A 131 -16.971 -24.426 -15.400 1.00 0.00 C ATOM 2049 CE3 TRP A 131 -19.026 -24.910 -14.240 1.00 0.00 C ATOM 2050 CZ2 TRP A 131 -17.158 -23.051 -15.215 1.00 0.00 C ATOM 2051 CZ3 TRP A 131 -19.224 -23.533 -14.044 1.00 0.00 C ATOM 2052 CH2 TRP A 131 -18.292 -22.604 -14.527 1.00 0.00 C ATOM 0 H TRP A 131 -18.018 -28.432 -17.482 1.00 0.00 H new ATOM 0 HA TRP A 131 -16.312 -29.313 -15.353 1.00 0.00 H new ATOM 0 HB2 TRP A 131 -19.071 -28.031 -15.338 1.00 0.00 H new ATOM 0 HB3 TRP A 131 -18.042 -28.221 -13.933 1.00 0.00 H new ATOM 0 HD1 TRP A 131 -15.617 -27.294 -16.348 1.00 0.00 H new ATOM 0 HE1 TRP A 131 -15.175 -24.766 -16.481 1.00 0.00 H new ATOM 0 HE3 TRP A 131 -19.757 -25.609 -13.861 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 -16.437 -22.344 -15.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 -20.101 -23.187 -13.517 1.00 0.00 H new ATOM 0 HH2 TRP A 131 -18.448 -21.547 -14.369 1.00 0.00 H new