USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 944 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 114 THR OG1 : rot -99:sc= 0.525 USER MOD Set 1.2: A 117 GLN : amide:sc= -0.0994 X(o=0.43,f=0) USER MOD Set 2.1: A 97 GLN : amide:sc= 2.1 K(o=3.3,f=-5) USER MOD Set 2.2: A 110 LYS NZ :NH3+ -170:sc= 1.18 (180deg=-0.0653) USER MOD Set 3.1: A 47 THR OG1 : rot 45:sc= 1.14 USER MOD Set 3.2: A 48 THR OG1 : rot 80:sc= 0.847 USER MOD Set 4.1: A 15 ASN : amide:sc= -0.108 X(o=1.3,f=1.3) USER MOD Set 4.2: A 17 THR OG1 : rot 180:sc= 0.674 USER MOD Set 4.3: A 43 SER OG : rot -153:sc= 0.763 USER MOD Set 5.1: A 33 GLN : amide:sc= -0.565 X(o=-0.57,f=-1.1) USER MOD Set 5.2: A 118 MET CE :methyl 168:sc= 0 (180deg=-0.259) USER MOD Set 6.1: A 23 TYR OH : rot 180:sc= -0.5 USER MOD Set 6.2: A 115 MET CE :methyl -148:sc= -0.0633 (180deg=-1.02) USER MOD Set 7.1: A 9 LYS NZ :NH3+ 171:sc= 0.824 (180deg=-0.137) USER MOD Set 7.2: A 22 THR OG1 : rot 121:sc= 0.398 USER MOD Single : A 7 SER OG : rot -150:sc= -0.874 USER MOD Single : A 8 LYS NZ :NH3+ -167:sc= 0.969 (180deg=0.861) USER MOD Single : A 11 SER OG : rot 180:sc= -0.289 USER MOD Single : A 13 ASN : amide:sc= -0.691 K(o=-0.69,f=-0.085) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 170:sc= 2.05 (180deg=1.76) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= -0.172 USER MOD Single : A 37 THR OG1 : rot -128:sc= -1.88! USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0.419 K(o=0.42,f=-3.7!) USER MOD Single : A 49 LYS NZ :NH3+ 172:sc=-0.000234 (180deg=-0.0599) USER MOD Single : A 54 LYS NZ :NH3+ 162:sc= 2.47 (180deg=2.16) USER MOD Single : A 55 THR OG1 : rot 80:sc= 1.3 USER MOD Single : A 60 SER OG : rot 88:sc= 1.25 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.0115 X(o=-0.012,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 174:sc= -0.203 (180deg=-0.232) USER MOD Single : A 74 THR OG1 : rot 180:sc= -2.3! USER MOD Single : A 75 TYR OH : rot -151:sc= -2.14! USER MOD Single : A 76 THR OG1 : rot -177:sc= 1.19 USER MOD Single : A 78 THR OG1 : rot -36:sc= 0.693 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 0.509 K(o=0.51,f=-0.56) USER MOD Single : A 83 ASN : amide:sc= -2.56! K(o=-2.6!,f=-0.2) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl 172:sc= -0.986 (180deg=-1.1) USER MOD Single : A 90 LYS NZ :NH3+ -167:sc= -0.0468 (180deg=-0.331) USER MOD Single : A 94 LYS NZ :NH3+ -170:sc= -0.0135 (180deg=-0.141) USER MOD Single : A 111 LYS NZ :NH3+ 171:sc=-0.00235 (180deg=-0.0615) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 154:sc= 1.16 (180deg=0.878) USER MOD Single : A 128 LYS NZ :NH3+ -148:sc= -2.24! (180deg=-4.25!) USER MOD Single : A 131 LYS NZ :NH3+ 175:sc= 0.158 (180deg=0.151) USER MOD ----------------------------------------------------------------- ATOM 61 N GLU A 5 12.808 -0.440 13.088 1.00 0.00 N ATOM 62 CA GLU A 5 11.661 -0.580 12.203 1.00 0.00 C ATOM 63 C GLU A 5 11.572 0.656 11.320 1.00 0.00 C ATOM 64 O GLU A 5 11.101 1.710 11.756 1.00 0.00 O ATOM 65 CB GLU A 5 10.365 -0.738 13.000 1.00 0.00 C ATOM 66 CG GLU A 5 10.361 -1.911 13.962 1.00 0.00 C ATOM 67 CD GLU A 5 9.044 -2.035 14.701 1.00 0.00 C ATOM 68 OE1 GLU A 5 8.731 -1.142 15.520 1.00 0.00 O ATOM 69 OE2 GLU A 5 8.311 -3.014 14.455 1.00 0.00 O ATOM 0 HA GLU A 5 11.792 -1.474 11.594 1.00 0.00 H new ATOM 0 HB2 GLU A 5 10.184 0.178 13.562 1.00 0.00 H new ATOM 0 HB3 GLU A 5 9.535 -0.853 12.302 1.00 0.00 H new ATOM 0 HG2 GLU A 5 10.556 -2.832 13.412 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.171 -1.792 14.682 1.00 0.00 H new ATOM 76 N GLU A 6 12.041 0.534 10.093 1.00 0.00 N ATOM 77 CA GLU A 6 12.134 1.677 9.205 1.00 0.00 C ATOM 78 C GLU A 6 10.933 1.725 8.278 1.00 0.00 C ATOM 79 O GLU A 6 10.637 0.759 7.583 1.00 0.00 O ATOM 80 CB GLU A 6 13.432 1.615 8.401 1.00 0.00 C ATOM 81 CG GLU A 6 14.675 1.529 9.270 1.00 0.00 C ATOM 82 CD GLU A 6 15.959 1.541 8.467 1.00 0.00 C ATOM 83 OE1 GLU A 6 16.491 2.643 8.210 1.00 0.00 O ATOM 84 OE2 GLU A 6 16.452 0.454 8.104 1.00 0.00 O ATOM 0 H GLU A 6 12.364 -0.345 9.688 1.00 0.00 H new ATOM 0 HA GLU A 6 12.141 2.587 9.804 1.00 0.00 H new ATOM 0 HB2 GLU A 6 13.400 0.750 7.739 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.501 2.499 7.767 1.00 0.00 H new ATOM 0 HG2 GLU A 6 14.682 2.365 9.969 1.00 0.00 H new ATOM 0 HG3 GLU A 6 14.633 0.617 9.865 1.00 0.00 H new ATOM 91 N SER A 7 10.241 2.846 8.279 1.00 0.00 N ATOM 92 CA SER A 7 9.043 2.998 7.479 1.00 0.00 C ATOM 93 C SER A 7 9.355 3.838 6.247 1.00 0.00 C ATOM 94 O SER A 7 10.020 4.870 6.345 1.00 0.00 O ATOM 95 CB SER A 7 7.936 3.658 8.307 1.00 0.00 C ATOM 96 OG SER A 7 6.664 3.476 7.708 1.00 0.00 O ATOM 0 H SER A 7 10.489 3.669 8.828 1.00 0.00 H new ATOM 0 HA SER A 7 8.696 2.015 7.161 1.00 0.00 H new ATOM 0 HB2 SER A 7 7.930 3.236 9.312 1.00 0.00 H new ATOM 0 HB3 SER A 7 8.142 4.723 8.410 1.00 0.00 H new ATOM 0 HG SER A 7 6.086 4.236 7.930 1.00 0.00 H new ATOM 102 N LYS A 8 8.901 3.386 5.091 1.00 0.00 N ATOM 103 CA LYS A 8 9.097 4.131 3.863 1.00 0.00 C ATOM 104 C LYS A 8 7.765 4.374 3.165 1.00 0.00 C ATOM 105 O LYS A 8 7.122 3.442 2.687 1.00 0.00 O ATOM 106 CB LYS A 8 10.067 3.392 2.937 1.00 0.00 C ATOM 107 CG LYS A 8 10.399 4.165 1.673 1.00 0.00 C ATOM 108 CD LYS A 8 11.561 3.542 0.917 1.00 0.00 C ATOM 109 CE LYS A 8 11.862 4.334 -0.340 1.00 0.00 C ATOM 110 NZ LYS A 8 13.124 3.913 -1.000 1.00 0.00 N ATOM 0 H LYS A 8 8.395 2.508 4.979 1.00 0.00 H new ATOM 0 HA LYS A 8 9.532 5.099 4.113 1.00 0.00 H new ATOM 0 HB2 LYS A 8 10.989 3.184 3.480 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.635 2.430 2.663 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.522 4.199 1.027 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.644 5.195 1.931 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.444 3.512 1.555 1.00 0.00 H new ATOM 0 HD3 LYS A 8 11.322 2.511 0.656 1.00 0.00 H new ATOM 0 HE2 LYS A 8 11.036 4.220 -1.042 1.00 0.00 H new ATOM 0 HE3 LYS A 8 11.924 5.393 -0.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 13.394 4.618 -1.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 13.879 3.835 -0.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.985 2.990 -1.459 1.00 0.00 H new ATOM 124 N LYS A 9 7.347 5.633 3.134 1.00 0.00 N ATOM 125 CA LYS A 9 6.109 6.007 2.465 1.00 0.00 C ATOM 126 C LYS A 9 6.401 6.590 1.091 1.00 0.00 C ATOM 127 O LYS A 9 7.079 7.614 0.976 1.00 0.00 O ATOM 128 CB LYS A 9 5.329 7.037 3.293 1.00 0.00 C ATOM 129 CG LYS A 9 4.009 7.458 2.654 1.00 0.00 C ATOM 130 CD LYS A 9 3.401 8.673 3.344 1.00 0.00 C ATOM 131 CE LYS A 9 2.929 8.365 4.759 1.00 0.00 C ATOM 132 NZ LYS A 9 1.804 7.393 4.785 1.00 0.00 N ATOM 0 H LYS A 9 7.847 6.411 3.564 1.00 0.00 H new ATOM 0 HA LYS A 9 5.506 5.106 2.357 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.129 6.621 4.281 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.951 7.920 3.439 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.172 7.684 1.600 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.305 6.627 2.696 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.139 9.475 3.377 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.559 9.038 2.755 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.762 7.967 5.338 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.617 9.290 5.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.620 7.101 5.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 0.951 7.839 4.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.053 6.559 4.216 1.00 0.00 H new ATOM 146 N PHE A 10 5.910 5.931 0.059 1.00 0.00 N ATOM 147 CA PHE A 10 5.950 6.486 -1.282 1.00 0.00 C ATOM 148 C PHE A 10 4.517 6.686 -1.751 1.00 0.00 C ATOM 149 O PHE A 10 3.622 5.975 -1.298 1.00 0.00 O ATOM 150 CB PHE A 10 6.720 5.567 -2.248 1.00 0.00 C ATOM 151 CG PHE A 10 5.921 4.413 -2.796 1.00 0.00 C ATOM 152 CD1 PHE A 10 5.183 4.559 -3.962 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.912 3.189 -2.153 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.452 3.505 -4.474 1.00 0.00 C ATOM 155 CE2 PHE A 10 5.182 2.131 -2.661 1.00 0.00 C ATOM 156 CZ PHE A 10 4.451 2.290 -3.823 1.00 0.00 C ATOM 0 H PHE A 10 5.478 5.009 0.123 1.00 0.00 H new ATOM 0 HA PHE A 10 6.478 7.439 -1.268 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.086 6.166 -3.082 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.595 5.172 -1.731 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.180 5.509 -4.476 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.481 3.058 -1.245 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.882 3.632 -5.383 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.183 1.180 -2.150 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.880 1.464 -4.220 1.00 0.00 H new ATOM 166 N SER A 11 4.287 7.640 -2.632 1.00 0.00 N ATOM 167 CA SER A 11 2.938 7.892 -3.109 1.00 0.00 C ATOM 168 C SER A 11 2.960 8.357 -4.556 1.00 0.00 C ATOM 169 O SER A 11 3.558 9.379 -4.887 1.00 0.00 O ATOM 170 CB SER A 11 2.233 8.913 -2.205 1.00 0.00 C ATOM 171 OG SER A 11 0.871 9.082 -2.574 1.00 0.00 O ATOM 0 H SER A 11 5.005 8.247 -3.029 1.00 0.00 H new ATOM 0 HA SER A 11 2.373 6.961 -3.068 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.292 8.584 -1.168 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.749 9.871 -2.265 1.00 0.00 H new ATOM 0 HG SER A 11 0.450 9.737 -1.979 1.00 0.00 H new ATOM 177 N ALA A 12 2.325 7.578 -5.416 1.00 0.00 N ATOM 178 CA ALA A 12 2.250 7.900 -6.830 1.00 0.00 C ATOM 179 C ALA A 12 0.801 7.909 -7.295 1.00 0.00 C ATOM 180 O ALA A 12 -0.023 7.135 -6.802 1.00 0.00 O ATOM 181 CB ALA A 12 3.066 6.907 -7.645 1.00 0.00 C ATOM 0 H ALA A 12 1.851 6.713 -5.156 1.00 0.00 H new ATOM 0 HA ALA A 12 2.668 8.895 -6.982 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.999 7.162 -8.703 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.108 6.945 -7.328 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.676 5.901 -7.489 1.00 0.00 H new ATOM 187 N ASN A 13 0.492 8.786 -8.235 1.00 0.00 N ATOM 188 CA ASN A 13 -0.864 8.906 -8.749 1.00 0.00 C ATOM 189 C ASN A 13 -0.999 8.176 -10.076 1.00 0.00 C ATOM 190 O ASN A 13 -0.295 8.484 -11.038 1.00 0.00 O ATOM 191 CB ASN A 13 -1.240 10.378 -8.923 1.00 0.00 C ATOM 192 CG ASN A 13 -2.604 10.563 -9.565 1.00 0.00 C ATOM 193 OD1 ASN A 13 -2.724 10.622 -10.790 1.00 0.00 O ATOM 194 ND2 ASN A 13 -3.640 10.656 -8.747 1.00 0.00 N ATOM 0 H ASN A 13 1.162 9.427 -8.659 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.544 8.451 -8.028 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.232 10.868 -7.950 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.485 10.872 -9.535 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.579 10.781 -9.125 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.500 10.602 -7.738 1.00 0.00 H new ATOM 201 N LEU A 14 -1.889 7.201 -10.120 1.00 0.00 N ATOM 202 CA LEU A 14 -2.152 6.461 -11.344 1.00 0.00 C ATOM 203 C LEU A 14 -3.623 6.079 -11.412 1.00 0.00 C ATOM 204 O LEU A 14 -4.241 5.801 -10.382 1.00 0.00 O ATOM 205 CB LEU A 14 -1.237 5.226 -11.435 1.00 0.00 C ATOM 206 CG LEU A 14 -1.230 4.293 -10.216 1.00 0.00 C ATOM 207 CD1 LEU A 14 -2.366 3.282 -10.290 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.111 3.582 -10.103 1.00 0.00 C ATOM 0 H LEU A 14 -2.445 6.901 -9.319 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.929 7.094 -12.203 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.532 4.645 -12.309 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.217 5.568 -11.610 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.381 4.901 -9.324 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.335 2.635 -9.413 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.320 3.808 -10.319 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.257 2.678 -11.191 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.102 2.924 -9.234 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.287 2.993 -11.003 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.906 4.320 -9.991 1.00 0.00 H new ATOM 220 N ASN A 15 -4.190 6.129 -12.620 1.00 0.00 N ATOM 221 CA ASN A 15 -5.608 5.814 -12.855 1.00 0.00 C ATOM 222 C ASN A 15 -6.531 6.891 -12.263 1.00 0.00 C ATOM 223 O ASN A 15 -7.719 6.955 -12.582 1.00 0.00 O ATOM 224 CB ASN A 15 -5.950 4.426 -12.281 1.00 0.00 C ATOM 225 CG ASN A 15 -7.410 4.040 -12.451 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.809 3.524 -13.496 1.00 0.00 O ATOM 227 ND2 ASN A 15 -8.209 4.254 -11.416 1.00 0.00 N ATOM 0 H ASN A 15 -3.682 6.389 -13.465 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.774 5.798 -13.932 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -5.326 3.677 -12.768 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.700 4.409 -11.220 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -9.193 3.989 -11.468 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.841 4.684 -10.568 1.00 0.00 H new ATOM 234 N GLY A 16 -5.964 7.758 -11.439 1.00 0.00 N ATOM 235 CA GLY A 16 -6.748 8.743 -10.726 1.00 0.00 C ATOM 236 C GLY A 16 -6.688 8.510 -9.231 1.00 0.00 C ATOM 237 O GLY A 16 -7.244 9.275 -8.446 1.00 0.00 O ATOM 0 H GLY A 16 -4.962 7.796 -11.250 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.379 9.742 -10.956 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.784 8.701 -11.062 1.00 0.00 H new ATOM 241 N THR A 17 -6.005 7.440 -8.847 1.00 0.00 N ATOM 242 CA THR A 17 -5.869 7.067 -7.452 1.00 0.00 C ATOM 243 C THR A 17 -4.447 7.344 -6.961 1.00 0.00 C ATOM 244 O THR A 17 -3.475 7.098 -7.683 1.00 0.00 O ATOM 245 CB THR A 17 -6.188 5.571 -7.269 1.00 0.00 C ATOM 246 OG1 THR A 17 -7.423 5.252 -7.928 1.00 0.00 O ATOM 247 CG2 THR A 17 -6.285 5.205 -5.796 1.00 0.00 C ATOM 0 H THR A 17 -5.532 6.810 -9.495 1.00 0.00 H new ATOM 0 HA THR A 17 -6.572 7.662 -6.869 1.00 0.00 H new ATOM 0 HB THR A 17 -5.375 4.995 -7.712 1.00 0.00 H new ATOM 0 HG1 THR A 17 -7.620 4.299 -7.810 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.511 4.143 -5.699 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.336 5.420 -5.304 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.077 5.789 -5.327 1.00 0.00 H new ATOM 255 N GLU A 18 -4.324 7.867 -5.748 1.00 0.00 N ATOM 256 CA GLU A 18 -3.015 8.116 -5.163 1.00 0.00 C ATOM 257 C GLU A 18 -2.600 6.932 -4.302 1.00 0.00 C ATOM 258 O GLU A 18 -3.132 6.735 -3.215 1.00 0.00 O ATOM 259 CB GLU A 18 -3.028 9.378 -4.300 1.00 0.00 C ATOM 260 CG GLU A 18 -3.938 10.475 -4.819 1.00 0.00 C ATOM 261 CD GLU A 18 -3.727 11.783 -4.090 1.00 0.00 C ATOM 262 OE1 GLU A 18 -2.578 12.266 -4.051 1.00 0.00 O ATOM 263 OE2 GLU A 18 -4.708 12.339 -3.557 1.00 0.00 O ATOM 0 H GLU A 18 -5.111 8.126 -5.153 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.304 8.254 -5.978 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.339 9.111 -3.290 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.012 9.767 -4.229 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.758 10.621 -5.884 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.977 10.164 -4.711 1.00 0.00 H new ATOM 270 N ILE A 19 -1.659 6.143 -4.778 1.00 0.00 N ATOM 271 CA ILE A 19 -1.218 4.978 -4.031 1.00 0.00 C ATOM 272 C ILE A 19 -0.052 5.337 -3.125 1.00 0.00 C ATOM 273 O ILE A 19 1.072 5.532 -3.593 1.00 0.00 O ATOM 274 CB ILE A 19 -0.814 3.816 -4.960 1.00 0.00 C ATOM 275 CG1 ILE A 19 -1.995 3.417 -5.848 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.333 2.622 -4.143 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.700 2.248 -6.760 1.00 0.00 C ATOM 0 H ILE A 19 -1.187 6.283 -5.671 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.062 4.647 -3.426 1.00 0.00 H new ATOM 0 HB ILE A 19 0.006 4.147 -5.597 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.846 3.167 -5.215 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.289 4.274 -6.454 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.052 1.811 -4.815 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.531 2.914 -3.546 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.133 2.286 -3.484 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.582 2.022 -7.359 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.869 2.501 -7.419 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.435 1.377 -6.161 1.00 0.00 H new ATOM 289 N ALA A 20 -0.330 5.457 -1.837 1.00 0.00 N ATOM 290 CA ALA A 20 0.698 5.763 -0.863 1.00 0.00 C ATOM 291 C ALA A 20 0.970 4.550 0.011 1.00 0.00 C ATOM 292 O ALA A 20 0.274 4.302 0.997 1.00 0.00 O ATOM 293 CB ALA A 20 0.304 6.967 -0.019 1.00 0.00 C ATOM 0 H ALA A 20 -1.264 5.346 -1.443 1.00 0.00 H new ATOM 0 HA ALA A 20 1.615 6.017 -1.394 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.091 7.177 0.705 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.164 7.834 -0.665 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.626 6.753 0.508 1.00 0.00 H new ATOM 299 N ILE A 21 1.974 3.784 -0.369 1.00 0.00 N ATOM 300 CA ILE A 21 2.345 2.602 0.379 1.00 0.00 C ATOM 301 C ILE A 21 3.442 2.942 1.373 1.00 0.00 C ATOM 302 O ILE A 21 4.534 3.365 0.999 1.00 0.00 O ATOM 303 CB ILE A 21 2.810 1.451 -0.537 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.678 1.032 -1.480 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.278 0.262 0.294 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.058 -0.082 -2.434 1.00 0.00 C ATOM 0 H ILE A 21 2.548 3.961 -1.194 1.00 0.00 H new ATOM 0 HA ILE A 21 1.455 2.260 0.908 1.00 0.00 H new ATOM 0 HB ILE A 21 3.650 1.803 -1.136 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.822 0.713 -0.886 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.359 1.900 -2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.602 -0.540 -0.369 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.110 0.567 0.929 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.457 -0.092 0.917 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.206 -0.324 -3.069 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.894 0.240 -3.055 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.348 -0.965 -1.865 1.00 0.00 H new ATOM 318 N THR A 22 3.117 2.785 2.637 1.00 0.00 N ATOM 319 CA THR A 22 4.052 3.024 3.711 1.00 0.00 C ATOM 320 C THR A 22 4.501 1.695 4.297 1.00 0.00 C ATOM 321 O THR A 22 3.862 1.152 5.196 1.00 0.00 O ATOM 322 CB THR A 22 3.388 3.877 4.802 1.00 0.00 C ATOM 323 OG1 THR A 22 2.644 4.934 4.180 1.00 0.00 O ATOM 324 CG2 THR A 22 4.421 4.464 5.748 1.00 0.00 C ATOM 0 H THR A 22 2.193 2.487 2.949 1.00 0.00 H new ATOM 0 HA THR A 22 4.919 3.559 3.322 1.00 0.00 H new ATOM 0 HB THR A 22 2.723 3.241 5.386 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.701 4.867 4.440 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.919 5.062 6.509 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.975 3.657 6.228 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.111 5.094 5.187 1.00 0.00 H new ATOM 332 N TYR A 23 5.573 1.144 3.757 1.00 0.00 N ATOM 333 CA TYR A 23 6.017 -0.171 4.175 1.00 0.00 C ATOM 334 C TYR A 23 7.162 -0.078 5.171 1.00 0.00 C ATOM 335 O TYR A 23 8.116 0.676 4.984 1.00 0.00 O ATOM 336 CB TYR A 23 6.381 -1.050 2.966 1.00 0.00 C ATOM 337 CG TYR A 23 7.374 -0.450 1.989 1.00 0.00 C ATOM 338 CD1 TYR A 23 6.999 0.565 1.115 1.00 0.00 C ATOM 339 CD2 TYR A 23 8.677 -0.923 1.918 1.00 0.00 C ATOM 340 CE1 TYR A 23 7.895 1.091 0.202 1.00 0.00 C ATOM 341 CE2 TYR A 23 9.579 -0.400 1.012 1.00 0.00 C ATOM 342 CZ TYR A 23 9.183 0.605 0.156 1.00 0.00 C ATOM 343 OH TYR A 23 10.078 1.125 -0.752 1.00 0.00 O ATOM 0 H TYR A 23 6.146 1.582 3.036 1.00 0.00 H new ATOM 0 HA TYR A 23 5.184 -0.655 4.686 1.00 0.00 H new ATOM 0 HB2 TYR A 23 6.787 -1.992 3.335 1.00 0.00 H new ATOM 0 HB3 TYR A 23 5.465 -1.287 2.424 1.00 0.00 H new ATOM 0 HD1 TYR A 23 5.990 0.949 1.150 1.00 0.00 H new ATOM 0 HD2 TYR A 23 8.991 -1.714 2.583 1.00 0.00 H new ATOM 0 HE1 TYR A 23 7.587 1.878 -0.471 1.00 0.00 H new ATOM 0 HE2 TYR A 23 10.590 -0.777 0.975 1.00 0.00 H new ATOM 0 HH TYR A 23 10.943 0.674 -0.654 1.00 0.00 H new ATOM 353 N VAL A 24 7.024 -0.833 6.248 1.00 0.00 N ATOM 354 CA VAL A 24 8.003 -0.877 7.313 1.00 0.00 C ATOM 355 C VAL A 24 8.898 -2.094 7.154 1.00 0.00 C ATOM 356 O VAL A 24 8.432 -3.239 7.185 1.00 0.00 O ATOM 357 CB VAL A 24 7.321 -0.925 8.699 1.00 0.00 C ATOM 358 CG1 VAL A 24 8.343 -1.109 9.812 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.506 0.334 8.935 1.00 0.00 C ATOM 0 H VAL A 24 6.218 -1.438 6.406 1.00 0.00 H new ATOM 0 HA VAL A 24 8.602 0.032 7.249 1.00 0.00 H new ATOM 0 HB VAL A 24 6.651 -1.785 8.711 1.00 0.00 H new ATOM 0 HG11 VAL A 24 7.832 -1.139 10.774 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.883 -2.043 9.659 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.047 -0.277 9.801 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.033 0.283 9.916 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.161 1.204 8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.738 0.420 8.166 1.00 0.00 H new ATOM 369 N TYR A 25 10.176 -1.846 6.974 1.00 0.00 N ATOM 370 CA TYR A 25 11.140 -2.911 6.849 1.00 0.00 C ATOM 371 C TYR A 25 12.025 -2.966 8.079 1.00 0.00 C ATOM 372 O TYR A 25 12.476 -1.939 8.588 1.00 0.00 O ATOM 373 CB TYR A 25 11.966 -2.762 5.563 1.00 0.00 C ATOM 374 CG TYR A 25 12.545 -1.379 5.322 1.00 0.00 C ATOM 375 CD1 TYR A 25 11.760 -0.356 4.798 1.00 0.00 C ATOM 376 CD2 TYR A 25 13.878 -1.103 5.598 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.287 0.901 4.560 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.412 0.149 5.358 1.00 0.00 C ATOM 379 CZ TYR A 25 13.613 1.147 4.841 1.00 0.00 C ATOM 380 OH TYR A 25 14.149 2.392 4.593 1.00 0.00 O ATOM 0 H TYR A 25 10.572 -0.908 6.911 1.00 0.00 H new ATOM 0 HA TYR A 25 10.604 -3.857 6.777 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.785 -3.481 5.591 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.337 -3.028 4.713 1.00 0.00 H new ATOM 0 HD1 TYR A 25 10.721 -0.547 4.573 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.508 -1.879 6.007 1.00 0.00 H new ATOM 0 HE1 TYR A 25 11.663 1.684 4.156 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.452 0.345 5.575 1.00 0.00 H new ATOM 0 HH TYR A 25 15.095 2.398 4.848 1.00 0.00 H new ATOM 390 N LYS A 26 12.230 -4.171 8.572 1.00 0.00 N ATOM 391 CA LYS A 26 13.018 -4.380 9.765 1.00 0.00 C ATOM 392 C LYS A 26 14.267 -5.155 9.386 1.00 0.00 C ATOM 393 O LYS A 26 14.208 -6.358 9.120 1.00 0.00 O ATOM 394 CB LYS A 26 12.188 -5.135 10.808 1.00 0.00 C ATOM 395 CG LYS A 26 12.723 -5.026 12.224 1.00 0.00 C ATOM 396 CD LYS A 26 11.767 -5.663 13.223 1.00 0.00 C ATOM 397 CE LYS A 26 12.226 -5.435 14.650 1.00 0.00 C ATOM 398 NZ LYS A 26 11.316 -6.061 15.645 1.00 0.00 N ATOM 0 H LYS A 26 11.857 -5.026 8.159 1.00 0.00 H new ATOM 0 HA LYS A 26 13.312 -3.426 10.203 1.00 0.00 H new ATOM 0 HB2 LYS A 26 11.166 -4.756 10.787 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.143 -6.188 10.528 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.696 -5.513 12.287 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.874 -3.977 12.479 1.00 0.00 H new ATOM 0 HD2 LYS A 26 10.768 -5.247 13.089 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.695 -6.733 13.029 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.230 -5.840 14.775 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.288 -4.364 14.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.672 -5.877 16.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.363 -5.657 15.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.276 -7.087 15.481 1.00 0.00 H new ATOM 412 N GLY A 27 15.387 -4.453 9.334 1.00 0.00 N ATOM 413 CA GLY A 27 16.597 -5.037 8.802 1.00 0.00 C ATOM 414 C GLY A 27 16.635 -4.935 7.291 1.00 0.00 C ATOM 415 O GLY A 27 16.661 -3.832 6.740 1.00 0.00 O ATOM 0 H GLY A 27 15.479 -3.488 9.651 1.00 0.00 H new ATOM 0 HA2 GLY A 27 17.465 -4.531 9.225 1.00 0.00 H new ATOM 0 HA3 GLY A 27 16.661 -6.083 9.100 1.00 0.00 H new ATOM 419 N ASP A 28 16.625 -6.075 6.617 1.00 0.00 N ATOM 420 CA ASP A 28 16.669 -6.098 5.157 1.00 0.00 C ATOM 421 C ASP A 28 15.339 -6.567 4.575 1.00 0.00 C ATOM 422 O ASP A 28 15.112 -6.490 3.364 1.00 0.00 O ATOM 423 CB ASP A 28 17.796 -7.013 4.664 1.00 0.00 C ATOM 424 CG ASP A 28 17.493 -8.489 4.860 1.00 0.00 C ATOM 425 OD1 ASP A 28 17.708 -9.006 5.981 1.00 0.00 O ATOM 426 OD2 ASP A 28 17.045 -9.140 3.893 1.00 0.00 O ATOM 0 H ASP A 28 16.587 -6.996 7.054 1.00 0.00 H new ATOM 0 HA ASP A 28 16.860 -5.080 4.817 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.974 -6.822 3.606 1.00 0.00 H new ATOM 0 HB3 ASP A 28 18.716 -6.764 5.193 1.00 0.00 H new ATOM 431 N LYS A 29 14.457 -7.040 5.441 1.00 0.00 N ATOM 432 CA LYS A 29 13.193 -7.604 4.998 1.00 0.00 C ATOM 433 C LYS A 29 12.031 -6.711 5.410 1.00 0.00 C ATOM 434 O LYS A 29 11.977 -6.226 6.543 1.00 0.00 O ATOM 435 CB LYS A 29 13.016 -9.006 5.584 1.00 0.00 C ATOM 436 CG LYS A 29 11.869 -9.797 4.972 1.00 0.00 C ATOM 437 CD LYS A 29 11.775 -11.186 5.583 1.00 0.00 C ATOM 438 CE LYS A 29 13.079 -11.949 5.415 1.00 0.00 C ATOM 439 NZ LYS A 29 13.092 -13.217 6.188 1.00 0.00 N ATOM 0 H LYS A 29 14.593 -7.045 6.452 1.00 0.00 H new ATOM 0 HA LYS A 29 13.204 -7.670 3.910 1.00 0.00 H new ATOM 0 HB2 LYS A 29 13.942 -9.565 5.447 1.00 0.00 H new ATOM 0 HB3 LYS A 29 12.851 -8.921 6.658 1.00 0.00 H new ATOM 0 HG2 LYS A 29 10.931 -9.264 5.128 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.014 -9.879 3.895 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.532 -11.105 6.642 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.963 -11.740 5.111 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.236 -12.168 4.359 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.909 -11.321 5.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 14.000 -13.703 6.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 12.969 -13.008 7.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 12.316 -13.829 5.864 1.00 0.00 H new ATOM 453 N VAL A 30 11.108 -6.488 4.486 1.00 0.00 N ATOM 454 CA VAL A 30 9.913 -5.716 4.778 1.00 0.00 C ATOM 455 C VAL A 30 8.923 -6.603 5.523 1.00 0.00 C ATOM 456 O VAL A 30 8.490 -7.626 4.998 1.00 0.00 O ATOM 457 CB VAL A 30 9.263 -5.162 3.491 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.260 -4.070 3.824 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.323 -4.640 2.531 1.00 0.00 C ATOM 0 H VAL A 30 11.165 -6.832 3.527 1.00 0.00 H new ATOM 0 HA VAL A 30 10.193 -4.862 5.395 1.00 0.00 H new ATOM 0 HB VAL A 30 8.732 -5.978 3.001 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.814 -3.693 2.904 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.479 -4.477 4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.767 -3.256 4.341 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.842 -4.255 1.632 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.887 -3.841 3.011 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.000 -5.450 2.261 1.00 0.00 H new ATOM 469 N LEU A 31 8.587 -6.229 6.749 1.00 0.00 N ATOM 470 CA LEU A 31 7.798 -7.102 7.613 1.00 0.00 C ATOM 471 C LEU A 31 6.394 -6.560 7.847 1.00 0.00 C ATOM 472 O LEU A 31 5.569 -7.210 8.487 1.00 0.00 O ATOM 473 CB LEU A 31 8.518 -7.317 8.946 1.00 0.00 C ATOM 474 CG LEU A 31 9.857 -8.053 8.839 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.470 -8.258 10.213 1.00 0.00 C ATOM 476 CD2 LEU A 31 9.678 -9.388 8.133 1.00 0.00 C ATOM 0 H LEU A 31 8.845 -5.335 7.167 1.00 0.00 H new ATOM 0 HA LEU A 31 7.693 -8.060 7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.689 -6.346 9.412 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.862 -7.879 9.611 1.00 0.00 H new ATOM 0 HG LEU A 31 10.537 -7.438 8.249 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.420 -8.783 10.113 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.638 -7.290 10.685 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.792 -8.849 10.829 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.640 -9.896 8.066 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.979 -10.006 8.696 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.287 -9.219 7.130 1.00 0.00 H new ATOM 488 N LYS A 32 6.120 -5.380 7.317 1.00 0.00 N ATOM 489 CA LYS A 32 4.797 -4.777 7.422 1.00 0.00 C ATOM 490 C LYS A 32 4.576 -3.803 6.277 1.00 0.00 C ATOM 491 O LYS A 32 5.436 -2.986 5.982 1.00 0.00 O ATOM 492 CB LYS A 32 4.630 -4.060 8.768 1.00 0.00 C ATOM 493 CG LYS A 32 4.160 -4.967 9.898 1.00 0.00 C ATOM 494 CD LYS A 32 4.387 -4.329 11.258 1.00 0.00 C ATOM 495 CE LYS A 32 3.707 -5.110 12.375 1.00 0.00 C ATOM 496 NZ LYS A 32 4.081 -6.552 12.385 1.00 0.00 N ATOM 0 H LYS A 32 6.799 -4.816 6.806 1.00 0.00 H new ATOM 0 HA LYS A 32 4.051 -5.570 7.363 1.00 0.00 H new ATOM 0 HB2 LYS A 32 5.582 -3.610 9.049 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.915 -3.246 8.648 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.100 -5.188 9.771 1.00 0.00 H new ATOM 0 HG3 LYS A 32 4.692 -5.917 9.848 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.457 -4.270 11.457 1.00 0.00 H new ATOM 0 HD3 LYS A 32 4.008 -3.307 11.247 1.00 0.00 H new ATOM 0 HE2 LYS A 32 3.970 -4.665 13.335 1.00 0.00 H new ATOM 0 HE3 LYS A 32 2.626 -5.021 12.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.728 -6.996 13.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.660 -7.026 11.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 5.116 -6.642 12.345 1.00 0.00 H new ATOM 510 N GLN A 33 3.439 -3.905 5.620 1.00 0.00 N ATOM 511 CA GLN A 33 3.136 -3.028 4.505 1.00 0.00 C ATOM 512 C GLN A 33 1.820 -2.297 4.733 1.00 0.00 C ATOM 513 O GLN A 33 0.744 -2.882 4.607 1.00 0.00 O ATOM 514 CB GLN A 33 3.063 -3.836 3.207 1.00 0.00 C ATOM 515 CG GLN A 33 3.006 -2.986 1.951 1.00 0.00 C ATOM 516 CD GLN A 33 2.952 -3.825 0.688 1.00 0.00 C ATOM 517 OE1 GLN A 33 2.403 -4.923 0.682 1.00 0.00 O ATOM 518 NE2 GLN A 33 3.534 -3.317 -0.387 1.00 0.00 N ATOM 0 H GLN A 33 2.710 -4.585 5.837 1.00 0.00 H new ATOM 0 HA GLN A 33 3.933 -2.289 4.425 1.00 0.00 H new ATOM 0 HB2 GLN A 33 3.932 -4.491 3.150 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.182 -4.477 3.240 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.129 -2.339 1.992 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.880 -2.336 1.915 1.00 0.00 H new ATOM 0 HE21 GLN A 33 3.980 -2.401 -0.341 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.537 -3.842 -1.262 1.00 0.00 H new ATOM 527 N SER A 34 1.906 -1.028 5.092 1.00 0.00 N ATOM 528 CA SER A 34 0.719 -0.204 5.194 1.00 0.00 C ATOM 529 C SER A 34 0.397 0.371 3.821 1.00 0.00 C ATOM 530 O SER A 34 0.895 1.426 3.447 1.00 0.00 O ATOM 531 CB SER A 34 0.913 0.924 6.211 1.00 0.00 C ATOM 532 OG SER A 34 1.227 0.415 7.498 1.00 0.00 O ATOM 0 H SER A 34 2.779 -0.551 5.316 1.00 0.00 H new ATOM 0 HA SER A 34 -0.111 -0.820 5.541 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.712 1.585 5.875 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.005 1.525 6.268 1.00 0.00 H new ATOM 0 HG SER A 34 1.346 1.159 8.124 1.00 0.00 H new ATOM 538 N SER A 35 -0.420 -0.339 3.071 1.00 0.00 N ATOM 539 CA SER A 35 -0.751 0.068 1.720 1.00 0.00 C ATOM 540 C SER A 35 -2.074 0.808 1.738 1.00 0.00 C ATOM 541 O SER A 35 -3.125 0.216 1.970 1.00 0.00 O ATOM 542 CB SER A 35 -0.830 -1.154 0.800 1.00 0.00 C ATOM 543 OG SER A 35 -1.070 -0.771 -0.544 1.00 0.00 O ATOM 0 H SER A 35 -0.869 -1.203 3.375 1.00 0.00 H new ATOM 0 HA SER A 35 0.027 0.728 1.336 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.101 -1.718 0.859 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.626 -1.817 1.139 1.00 0.00 H new ATOM 0 HG SER A 35 -1.114 -1.570 -1.109 1.00 0.00 H new ATOM 549 N GLU A 36 -2.004 2.107 1.528 1.00 0.00 N ATOM 550 CA GLU A 36 -3.178 2.949 1.601 1.00 0.00 C ATOM 551 C GLU A 36 -3.386 3.691 0.290 1.00 0.00 C ATOM 552 O GLU A 36 -2.549 4.496 -0.129 1.00 0.00 O ATOM 553 CB GLU A 36 -3.035 3.923 2.769 1.00 0.00 C ATOM 554 CG GLU A 36 -4.139 4.961 2.855 1.00 0.00 C ATOM 555 CD GLU A 36 -3.929 5.929 3.998 1.00 0.00 C ATOM 556 OE1 GLU A 36 -2.903 6.647 3.997 1.00 0.00 O ATOM 557 OE2 GLU A 36 -4.777 5.973 4.910 1.00 0.00 O ATOM 0 H GLU A 36 -1.141 2.603 1.304 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.057 2.327 1.770 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.012 3.356 3.699 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.076 4.435 2.685 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.188 5.515 1.917 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -5.098 4.458 2.979 1.00 0.00 H new ATOM 564 N THR A 37 -4.489 3.396 -0.372 1.00 0.00 N ATOM 565 CA THR A 37 -4.819 4.057 -1.619 1.00 0.00 C ATOM 566 C THR A 37 -5.801 5.200 -1.370 1.00 0.00 C ATOM 567 O THR A 37 -6.895 4.998 -0.840 1.00 0.00 O ATOM 568 CB THR A 37 -5.409 3.068 -2.648 1.00 0.00 C ATOM 569 OG1 THR A 37 -6.541 2.396 -2.097 1.00 0.00 O ATOM 570 CG2 THR A 37 -4.367 2.046 -3.080 1.00 0.00 C ATOM 0 H THR A 37 -5.172 2.702 -0.066 1.00 0.00 H new ATOM 0 HA THR A 37 -3.895 4.460 -2.033 1.00 0.00 H new ATOM 0 HB THR A 37 -5.720 3.639 -3.523 1.00 0.00 H new ATOM 0 HG1 THR A 37 -6.430 1.428 -2.202 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.808 1.361 -3.805 1.00 0.00 H new ATOM 0 HG22 THR A 37 -3.520 2.560 -3.535 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.026 1.484 -2.210 1.00 0.00 H new ATOM 578 N LYS A 38 -5.386 6.407 -1.710 1.00 0.00 N ATOM 579 CA LYS A 38 -6.245 7.571 -1.594 1.00 0.00 C ATOM 580 C LYS A 38 -7.126 7.668 -2.829 1.00 0.00 C ATOM 581 O LYS A 38 -6.696 8.146 -3.882 1.00 0.00 O ATOM 582 CB LYS A 38 -5.405 8.836 -1.411 1.00 0.00 C ATOM 583 CG LYS A 38 -6.210 10.078 -1.065 1.00 0.00 C ATOM 584 CD LYS A 38 -5.290 11.232 -0.705 1.00 0.00 C ATOM 585 CE LYS A 38 -6.058 12.510 -0.421 1.00 0.00 C ATOM 586 NZ LYS A 38 -5.154 13.616 -0.009 1.00 0.00 N ATOM 0 H LYS A 38 -4.453 6.607 -2.071 1.00 0.00 H new ATOM 0 HA LYS A 38 -6.883 7.470 -0.716 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -4.673 8.661 -0.623 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -4.847 9.023 -2.328 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -6.838 10.358 -1.911 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -6.877 9.864 -0.230 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.698 10.963 0.170 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.590 11.405 -1.522 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.613 12.806 -1.311 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.791 12.327 0.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -5.715 14.472 0.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.643 13.343 0.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.471 13.808 -0.769 1.00 0.00 H new ATOM 600 N ILE A 39 -8.344 7.171 -2.700 1.00 0.00 N ATOM 601 CA ILE A 39 -9.262 7.088 -3.820 1.00 0.00 C ATOM 602 C ILE A 39 -10.277 8.220 -3.778 1.00 0.00 C ATOM 603 O ILE A 39 -11.206 8.205 -2.969 1.00 0.00 O ATOM 604 CB ILE A 39 -10.021 5.742 -3.824 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.042 4.570 -3.694 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.847 5.606 -5.097 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.721 3.220 -3.585 1.00 0.00 C ATOM 0 H ILE A 39 -8.722 6.816 -1.821 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.664 7.167 -4.728 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.694 5.722 -2.967 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.378 4.565 -4.559 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.418 4.725 -2.814 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.377 4.653 -5.087 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.568 6.422 -5.152 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.188 5.646 -5.964 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.966 2.439 -3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.363 3.206 -2.704 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.323 3.043 -4.476 1.00 0.00 H new ATOM 619 N GLN A 40 -10.083 9.215 -4.627 1.00 0.00 N ATOM 620 CA GLN A 40 -11.083 10.254 -4.809 1.00 0.00 C ATOM 621 C GLN A 40 -12.335 9.635 -5.413 1.00 0.00 C ATOM 622 O GLN A 40 -12.244 8.686 -6.195 1.00 0.00 O ATOM 623 CB GLN A 40 -10.563 11.376 -5.717 1.00 0.00 C ATOM 624 CG GLN A 40 -9.517 12.279 -5.073 1.00 0.00 C ATOM 625 CD GLN A 40 -8.198 11.582 -4.795 1.00 0.00 C ATOM 626 OE1 GLN A 40 -7.814 10.645 -5.492 1.00 0.00 O ATOM 627 NE2 GLN A 40 -7.489 12.049 -3.780 1.00 0.00 N ATOM 0 H GLN A 40 -9.246 9.326 -5.199 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.313 10.693 -3.838 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.136 10.930 -6.615 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.407 11.989 -6.035 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -9.336 13.133 -5.725 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -9.915 12.671 -4.137 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -7.844 12.829 -3.226 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -6.588 11.629 -3.552 1.00 0.00 H new ATOM 636 N PHE A 41 -13.500 10.162 -5.061 1.00 0.00 N ATOM 637 CA PHE A 41 -14.761 9.599 -5.537 1.00 0.00 C ATOM 638 C PHE A 41 -14.861 9.647 -7.059 1.00 0.00 C ATOM 639 O PHE A 41 -15.579 8.855 -7.664 1.00 0.00 O ATOM 640 CB PHE A 41 -15.951 10.315 -4.899 1.00 0.00 C ATOM 641 CG PHE A 41 -16.122 10.006 -3.438 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.525 8.885 -2.878 1.00 0.00 C ATOM 643 CD2 PHE A 41 -16.883 10.829 -2.628 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.683 8.596 -1.537 1.00 0.00 C ATOM 645 CE2 PHE A 41 -17.048 10.543 -1.287 1.00 0.00 C ATOM 646 CZ PHE A 41 -16.446 9.426 -0.742 1.00 0.00 C ATOM 0 H PHE A 41 -13.601 10.974 -4.451 1.00 0.00 H new ATOM 0 HA PHE A 41 -14.784 8.552 -5.236 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.827 11.391 -5.023 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.861 10.036 -5.430 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.930 8.231 -3.498 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -17.354 11.705 -3.049 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.211 7.723 -1.112 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -17.647 11.192 -0.665 1.00 0.00 H new ATOM 0 HZ PHE A 41 -16.573 9.202 0.307 1.00 0.00 H new ATOM 656 N ALA A 42 -14.113 10.554 -7.674 1.00 0.00 N ATOM 657 CA ALA A 42 -14.094 10.672 -9.127 1.00 0.00 C ATOM 658 C ALA A 42 -13.305 9.527 -9.767 1.00 0.00 C ATOM 659 O ALA A 42 -13.474 9.228 -10.948 1.00 0.00 O ATOM 660 CB ALA A 42 -13.506 12.013 -9.534 1.00 0.00 C ATOM 0 H ALA A 42 -13.511 11.219 -7.189 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.121 10.610 -9.486 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.496 12.091 -10.621 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.112 12.818 -9.118 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.487 12.093 -9.155 1.00 0.00 H new ATOM 666 N SER A 43 -12.453 8.883 -8.978 1.00 0.00 N ATOM 667 CA SER A 43 -11.621 7.793 -9.474 1.00 0.00 C ATOM 668 C SER A 43 -12.366 6.463 -9.381 1.00 0.00 C ATOM 669 O SER A 43 -11.961 5.466 -9.984 1.00 0.00 O ATOM 670 CB SER A 43 -10.310 7.730 -8.680 1.00 0.00 C ATOM 671 OG SER A 43 -9.439 6.733 -9.189 1.00 0.00 O ATOM 0 H SER A 43 -12.320 9.097 -7.990 1.00 0.00 H new ATOM 0 HA SER A 43 -11.389 7.981 -10.522 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.815 8.700 -8.717 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.528 7.523 -7.632 1.00 0.00 H new ATOM 0 HG SER A 43 -8.848 6.418 -8.473 1.00 0.00 H new ATOM 677 N ILE A 44 -13.452 6.454 -8.620 1.00 0.00 N ATOM 678 CA ILE A 44 -14.270 5.258 -8.466 1.00 0.00 C ATOM 679 C ILE A 44 -15.631 5.441 -9.141 1.00 0.00 C ATOM 680 O ILE A 44 -16.255 4.475 -9.584 1.00 0.00 O ATOM 681 CB ILE A 44 -14.456 4.890 -6.970 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.430 3.717 -6.811 1.00 0.00 C ATOM 683 CG2 ILE A 44 -14.930 6.093 -6.169 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.695 3.337 -5.370 1.00 0.00 C ATOM 0 H ILE A 44 -13.788 7.264 -8.098 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.746 4.436 -8.954 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.486 4.582 -6.579 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.375 3.974 -7.289 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -15.031 2.851 -7.338 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.053 5.809 -5.124 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.193 6.893 -6.243 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.884 6.441 -6.565 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -16.393 2.500 -5.337 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.759 3.048 -4.892 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -16.124 4.189 -4.842 1.00 0.00 H new ATOM 696 N GLY A 45 -16.073 6.687 -9.238 1.00 0.00 N ATOM 697 CA GLY A 45 -17.365 6.973 -9.826 1.00 0.00 C ATOM 698 C GLY A 45 -18.471 6.911 -8.796 1.00 0.00 C ATOM 699 O GLY A 45 -19.598 6.515 -9.099 1.00 0.00 O ATOM 0 H GLY A 45 -15.557 7.507 -8.919 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.347 7.963 -10.282 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.569 6.258 -10.623 1.00 0.00 H new ATOM 703 N ALA A 46 -18.146 7.304 -7.574 1.00 0.00 N ATOM 704 CA ALA A 46 -19.091 7.235 -6.471 1.00 0.00 C ATOM 705 C ALA A 46 -19.704 8.598 -6.202 1.00 0.00 C ATOM 706 O ALA A 46 -18.998 9.559 -5.904 1.00 0.00 O ATOM 707 CB ALA A 46 -18.410 6.705 -5.217 1.00 0.00 C ATOM 0 H ALA A 46 -17.230 7.676 -7.321 1.00 0.00 H new ATOM 0 HA ALA A 46 -19.890 6.548 -6.750 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.132 6.660 -4.402 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.018 5.706 -5.410 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.591 7.369 -4.940 1.00 0.00 H new ATOM 713 N THR A 47 -21.019 8.677 -6.315 1.00 0.00 N ATOM 714 CA THR A 47 -21.736 9.915 -6.062 1.00 0.00 C ATOM 715 C THR A 47 -21.840 10.197 -4.566 1.00 0.00 C ATOM 716 O THR A 47 -21.850 11.352 -4.137 1.00 0.00 O ATOM 717 CB THR A 47 -23.142 9.858 -6.683 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.678 8.529 -6.555 1.00 0.00 O ATOM 719 CG2 THR A 47 -23.099 10.256 -8.150 1.00 0.00 C ATOM 0 H THR A 47 -21.615 7.893 -6.582 1.00 0.00 H new ATOM 0 HA THR A 47 -21.174 10.726 -6.525 1.00 0.00 H new ATOM 0 HB THR A 47 -23.783 10.561 -6.152 1.00 0.00 H new ATOM 0 HG1 THR A 47 -23.513 8.196 -5.648 1.00 0.00 H new ATOM 0 HG21 THR A 47 -24.104 10.209 -8.569 1.00 0.00 H new ATOM 0 HG22 THR A 47 -22.716 11.272 -8.240 1.00 0.00 H new ATOM 0 HG23 THR A 47 -22.447 9.573 -8.693 1.00 0.00 H new ATOM 727 N THR A 48 -21.907 9.132 -3.782 1.00 0.00 N ATOM 728 CA THR A 48 -22.003 9.243 -2.338 1.00 0.00 C ATOM 729 C THR A 48 -20.948 8.351 -1.689 1.00 0.00 C ATOM 730 O THR A 48 -20.492 7.381 -2.302 1.00 0.00 O ATOM 731 CB THR A 48 -23.401 8.803 -1.850 1.00 0.00 C ATOM 732 OG1 THR A 48 -24.393 9.156 -2.822 1.00 0.00 O ATOM 733 CG2 THR A 48 -23.748 9.449 -0.517 1.00 0.00 C ATOM 0 H THR A 48 -21.896 8.173 -4.128 1.00 0.00 H new ATOM 0 HA THR A 48 -21.840 10.284 -2.059 1.00 0.00 H new ATOM 0 HB THR A 48 -23.384 7.721 -1.716 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.393 8.494 -3.545 1.00 0.00 H new ATOM 0 HG21 THR A 48 -24.738 9.120 -0.200 1.00 0.00 H new ATOM 0 HG22 THR A 48 -23.011 9.157 0.231 1.00 0.00 H new ATOM 0 HG23 THR A 48 -23.744 10.534 -0.626 1.00 0.00 H new ATOM 741 N LYS A 49 -20.554 8.668 -0.459 1.00 0.00 N ATOM 742 CA LYS A 49 -19.635 7.811 0.283 1.00 0.00 C ATOM 743 C LYS A 49 -20.285 6.456 0.560 1.00 0.00 C ATOM 744 O LYS A 49 -19.597 5.450 0.735 1.00 0.00 O ATOM 745 CB LYS A 49 -19.188 8.483 1.587 1.00 0.00 C ATOM 746 CG LYS A 49 -20.331 8.920 2.486 1.00 0.00 C ATOM 747 CD LYS A 49 -19.820 9.622 3.734 1.00 0.00 C ATOM 748 CE LYS A 49 -20.966 10.153 4.577 1.00 0.00 C ATOM 749 NZ LYS A 49 -21.817 9.060 5.116 1.00 0.00 N ATOM 0 H LYS A 49 -20.854 9.505 0.042 1.00 0.00 H new ATOM 0 HA LYS A 49 -18.746 7.649 -0.326 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -18.551 7.792 2.139 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -18.579 9.354 1.344 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -20.993 9.589 1.936 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -20.923 8.051 2.773 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -19.222 8.928 4.325 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.164 10.445 3.448 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -20.566 10.741 5.403 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -21.578 10.825 3.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -22.502 9.455 5.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -22.327 8.600 4.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -21.218 8.360 5.599 1.00 0.00 H new ATOM 763 N GLU A 50 -21.616 6.442 0.579 1.00 0.00 N ATOM 764 CA GLU A 50 -22.373 5.200 0.662 1.00 0.00 C ATOM 765 C GLU A 50 -22.093 4.342 -0.568 1.00 0.00 C ATOM 766 O GLU A 50 -21.814 3.149 -0.455 1.00 0.00 O ATOM 767 CB GLU A 50 -23.873 5.502 0.779 1.00 0.00 C ATOM 768 CG GLU A 50 -24.752 4.263 0.895 1.00 0.00 C ATOM 769 CD GLU A 50 -25.577 4.016 -0.353 1.00 0.00 C ATOM 770 OE1 GLU A 50 -25.089 3.335 -1.275 1.00 0.00 O ATOM 771 OE2 GLU A 50 -26.719 4.514 -0.424 1.00 0.00 O ATOM 0 H GLU A 50 -22.193 7.282 0.538 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.063 4.650 1.551 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.038 6.134 1.652 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.186 6.075 -0.094 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.124 3.393 1.089 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -25.418 4.373 1.751 1.00 0.00 H new ATOM 778 N ASP A 51 -22.135 4.973 -1.742 1.00 0.00 N ATOM 779 CA ASP A 51 -21.836 4.289 -2.996 1.00 0.00 C ATOM 780 C ASP A 51 -20.407 3.769 -2.979 1.00 0.00 C ATOM 781 O ASP A 51 -20.125 2.678 -3.479 1.00 0.00 O ATOM 782 CB ASP A 51 -22.016 5.224 -4.199 1.00 0.00 C ATOM 783 CG ASP A 51 -23.439 5.707 -4.375 1.00 0.00 C ATOM 784 OD1 ASP A 51 -24.342 4.866 -4.570 1.00 0.00 O ATOM 785 OD2 ASP A 51 -23.661 6.936 -4.336 1.00 0.00 O ATOM 0 H ASP A 51 -22.374 5.959 -1.848 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.534 3.457 -3.094 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -21.359 6.086 -4.082 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.702 4.704 -5.104 1.00 0.00 H new ATOM 790 N ALA A 52 -19.513 4.560 -2.397 1.00 0.00 N ATOM 791 CA ALA A 52 -18.116 4.177 -2.271 1.00 0.00 C ATOM 792 C ALA A 52 -17.977 2.904 -1.447 1.00 0.00 C ATOM 793 O ALA A 52 -17.348 1.947 -1.886 1.00 0.00 O ATOM 794 CB ALA A 52 -17.307 5.305 -1.652 1.00 0.00 C ATOM 0 H ALA A 52 -19.735 5.475 -2.004 1.00 0.00 H new ATOM 0 HA ALA A 52 -17.725 3.981 -3.269 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.264 5.000 -1.566 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.375 6.191 -2.284 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.701 5.535 -0.662 1.00 0.00 H new ATOM 800 N ALA A 53 -18.585 2.887 -0.264 1.00 0.00 N ATOM 801 CA ALA A 53 -18.543 1.707 0.598 1.00 0.00 C ATOM 802 C ALA A 53 -19.198 0.513 -0.086 1.00 0.00 C ATOM 803 O ALA A 53 -18.675 -0.600 -0.061 1.00 0.00 O ATOM 804 CB ALA A 53 -19.223 1.988 1.928 1.00 0.00 C ATOM 0 H ALA A 53 -19.111 3.673 0.119 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.497 1.466 0.787 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.180 1.097 2.554 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -18.713 2.809 2.431 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.264 2.260 1.754 1.00 0.00 H new ATOM 810 N LYS A 54 -20.330 0.769 -0.719 1.00 0.00 N ATOM 811 CA LYS A 54 -21.074 -0.251 -1.450 1.00 0.00 C ATOM 812 C LYS A 54 -20.205 -0.888 -2.542 1.00 0.00 C ATOM 813 O LYS A 54 -20.462 -2.008 -2.988 1.00 0.00 O ATOM 814 CB LYS A 54 -22.325 0.403 -2.046 1.00 0.00 C ATOM 815 CG LYS A 54 -23.278 -0.538 -2.762 1.00 0.00 C ATOM 816 CD LYS A 54 -24.570 0.187 -3.112 1.00 0.00 C ATOM 817 CE LYS A 54 -24.297 1.424 -3.955 1.00 0.00 C ATOM 818 NZ LYS A 54 -25.321 2.480 -3.749 1.00 0.00 N ATOM 0 H LYS A 54 -20.763 1.692 -0.742 1.00 0.00 H new ATOM 0 HA LYS A 54 -21.368 -1.053 -0.773 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.869 0.902 -1.244 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.010 1.176 -2.747 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -22.810 -0.920 -3.669 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -23.495 -1.398 -2.129 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -25.233 -0.487 -3.655 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -25.088 0.475 -2.197 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -23.313 1.821 -3.706 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -24.272 1.145 -5.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -24.952 3.392 -4.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -26.182 2.237 -4.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.547 2.551 -2.736 1.00 0.00 H new ATOM 832 N THR A 55 -19.172 -0.171 -2.962 1.00 0.00 N ATOM 833 CA THR A 55 -18.252 -0.665 -3.972 1.00 0.00 C ATOM 834 C THR A 55 -16.970 -1.240 -3.351 1.00 0.00 C ATOM 835 O THR A 55 -16.494 -2.299 -3.754 1.00 0.00 O ATOM 836 CB THR A 55 -17.884 0.454 -4.964 1.00 0.00 C ATOM 837 OG1 THR A 55 -19.076 1.127 -5.399 1.00 0.00 O ATOM 838 CG2 THR A 55 -17.146 -0.104 -6.171 1.00 0.00 C ATOM 0 H THR A 55 -18.951 0.762 -2.614 1.00 0.00 H new ATOM 0 HA THR A 55 -18.763 -1.469 -4.501 1.00 0.00 H new ATOM 0 HB THR A 55 -17.226 1.158 -4.454 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.353 1.774 -4.717 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.899 0.709 -6.854 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.229 -0.593 -5.843 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.780 -0.828 -6.683 1.00 0.00 H new ATOM 846 N LEU A 56 -16.427 -0.544 -2.354 1.00 0.00 N ATOM 847 CA LEU A 56 -15.089 -0.851 -1.849 1.00 0.00 C ATOM 848 C LEU A 56 -15.091 -1.864 -0.704 1.00 0.00 C ATOM 849 O LEU A 56 -14.084 -2.526 -0.475 1.00 0.00 O ATOM 850 CB LEU A 56 -14.382 0.427 -1.395 1.00 0.00 C ATOM 851 CG LEU A 56 -14.256 1.520 -2.459 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.624 2.768 -1.867 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.440 1.023 -3.642 1.00 0.00 C ATOM 0 H LEU A 56 -16.890 0.233 -1.881 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.550 -1.305 -2.681 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.920 0.836 -0.540 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.383 0.165 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.256 1.772 -2.812 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.542 3.535 -2.637 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.245 3.138 -1.051 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.631 2.528 -1.487 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.361 1.814 -4.388 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.442 0.743 -3.304 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.930 0.155 -4.083 1.00 0.00 H new ATOM 865 N GLU A 57 -16.194 -1.989 0.025 1.00 0.00 N ATOM 866 CA GLU A 57 -16.247 -2.957 1.125 1.00 0.00 C ATOM 867 C GLU A 57 -16.030 -4.393 0.619 1.00 0.00 C ATOM 868 O GLU A 57 -15.217 -5.128 1.179 1.00 0.00 O ATOM 869 CB GLU A 57 -17.552 -2.849 1.918 1.00 0.00 C ATOM 870 CG GLU A 57 -17.668 -1.552 2.701 1.00 0.00 C ATOM 871 CD GLU A 57 -18.776 -1.579 3.734 1.00 0.00 C ATOM 872 OE1 GLU A 57 -19.963 -1.612 3.342 1.00 0.00 O ATOM 873 OE2 GLU A 57 -18.464 -1.551 4.943 1.00 0.00 O ATOM 0 H GLU A 57 -17.047 -1.448 -0.117 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.430 -2.711 1.804 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.395 -2.929 1.232 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.622 -3.690 2.608 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.720 -1.349 3.199 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -17.846 -0.730 2.007 1.00 0.00 H new ATOM 880 N PRO A 58 -16.737 -4.824 -0.451 1.00 0.00 N ATOM 881 CA PRO A 58 -16.489 -6.134 -1.070 1.00 0.00 C ATOM 882 C PRO A 58 -15.143 -6.189 -1.802 1.00 0.00 C ATOM 883 O PRO A 58 -14.726 -7.245 -2.284 1.00 0.00 O ATOM 884 CB PRO A 58 -17.647 -6.289 -2.062 1.00 0.00 C ATOM 885 CG PRO A 58 -18.088 -4.900 -2.363 1.00 0.00 C ATOM 886 CD PRO A 58 -17.847 -4.108 -1.108 1.00 0.00 C ATOM 0 HA PRO A 58 -16.440 -6.930 -0.327 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -17.325 -6.805 -2.966 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.459 -6.876 -1.632 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.527 -4.485 -3.200 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -19.141 -4.877 -2.643 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.581 -3.075 -1.331 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.735 -4.079 -0.476 1.00 0.00 H new ATOM 894 N LEU A 59 -14.465 -5.047 -1.870 1.00 0.00 N ATOM 895 CA LEU A 59 -13.173 -4.953 -2.535 1.00 0.00 C ATOM 896 C LEU A 59 -12.055 -5.374 -1.584 1.00 0.00 C ATOM 897 O LEU A 59 -11.160 -6.133 -1.961 1.00 0.00 O ATOM 898 CB LEU A 59 -12.926 -3.522 -3.021 1.00 0.00 C ATOM 899 CG LEU A 59 -11.675 -3.323 -3.874 1.00 0.00 C ATOM 900 CD1 LEU A 59 -11.888 -3.886 -5.266 1.00 0.00 C ATOM 901 CD2 LEU A 59 -11.305 -1.850 -3.944 1.00 0.00 C ATOM 0 H LEU A 59 -14.794 -4.169 -1.469 1.00 0.00 H new ATOM 0 HA LEU A 59 -13.180 -5.623 -3.395 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.793 -3.198 -3.597 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.859 -2.868 -2.151 1.00 0.00 H new ATOM 0 HG LEU A 59 -10.850 -3.861 -3.407 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -10.987 -3.736 -5.861 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -12.105 -4.952 -5.198 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -12.726 -3.375 -5.741 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -10.411 -1.728 -4.556 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -12.128 -1.289 -4.387 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.110 -1.476 -2.939 1.00 0.00 H new ATOM 913 N SER A 60 -12.117 -4.888 -0.348 1.00 0.00 N ATOM 914 CA SER A 60 -11.103 -5.206 0.652 1.00 0.00 C ATOM 915 C SER A 60 -11.314 -6.617 1.195 1.00 0.00 C ATOM 916 O SER A 60 -10.412 -7.208 1.792 1.00 0.00 O ATOM 917 CB SER A 60 -11.143 -4.183 1.789 1.00 0.00 C ATOM 918 OG SER A 60 -12.418 -4.150 2.407 1.00 0.00 O ATOM 0 H SER A 60 -12.859 -4.272 -0.015 1.00 0.00 H new ATOM 0 HA SER A 60 -10.122 -5.163 0.180 1.00 0.00 H new ATOM 0 HB2 SER A 60 -10.383 -4.430 2.531 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.899 -3.194 1.400 1.00 0.00 H new ATOM 0 HG SER A 60 -12.450 -4.814 3.127 1.00 0.00 H new ATOM 924 N ALA A 61 -12.501 -7.161 0.936 1.00 0.00 N ATOM 925 CA ALA A 61 -12.891 -8.492 1.399 1.00 0.00 C ATOM 926 C ALA A 61 -12.028 -9.596 0.784 1.00 0.00 C ATOM 927 O ALA A 61 -12.263 -10.781 1.018 1.00 0.00 O ATOM 928 CB ALA A 61 -14.358 -8.745 1.097 1.00 0.00 C ATOM 0 H ALA A 61 -13.225 -6.688 0.395 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.732 -8.518 2.477 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.635 -9.739 1.447 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.968 -7.998 1.605 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.525 -8.679 0.022 1.00 0.00 H new ATOM 934 N LYS A 62 -11.049 -9.214 -0.018 1.00 0.00 N ATOM 935 CA LYS A 62 -10.136 -10.177 -0.607 1.00 0.00 C ATOM 936 C LYS A 62 -9.104 -10.635 0.419 1.00 0.00 C ATOM 937 O LYS A 62 -8.595 -11.749 0.337 1.00 0.00 O ATOM 938 CB LYS A 62 -9.428 -9.572 -1.821 1.00 0.00 C ATOM 939 CG LYS A 62 -10.369 -9.073 -2.906 1.00 0.00 C ATOM 940 CD LYS A 62 -9.607 -8.351 -4.007 1.00 0.00 C ATOM 941 CE LYS A 62 -10.546 -7.718 -5.023 1.00 0.00 C ATOM 942 NZ LYS A 62 -9.807 -6.911 -6.031 1.00 0.00 N ATOM 0 H LYS A 62 -10.866 -8.244 -0.276 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.717 -11.040 -0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.804 -8.743 -1.488 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.762 -10.321 -2.250 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.917 -9.914 -3.331 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.107 -8.400 -2.470 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -8.975 -7.580 -3.566 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.945 -9.054 -4.513 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.114 -8.499 -5.528 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -11.266 -7.083 -4.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -10.481 -6.496 -6.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -9.285 -6.150 -5.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -9.138 -7.522 -6.542 1.00 0.00 H new ATOM 956 N TYR A 63 -8.815 -9.777 1.389 1.00 0.00 N ATOM 957 CA TYR A 63 -7.795 -10.071 2.387 1.00 0.00 C ATOM 958 C TYR A 63 -8.373 -10.901 3.528 1.00 0.00 C ATOM 959 O TYR A 63 -7.864 -11.976 3.845 1.00 0.00 O ATOM 960 CB TYR A 63 -7.197 -8.772 2.932 1.00 0.00 C ATOM 961 CG TYR A 63 -6.459 -7.960 1.891 1.00 0.00 C ATOM 962 CD1 TYR A 63 -5.105 -8.165 1.659 1.00 0.00 C ATOM 963 CD2 TYR A 63 -7.116 -6.996 1.135 1.00 0.00 C ATOM 964 CE1 TYR A 63 -4.426 -7.433 0.705 1.00 0.00 C ATOM 965 CE2 TYR A 63 -6.442 -6.259 0.179 1.00 0.00 C ATOM 966 CZ TYR A 63 -5.098 -6.482 -0.033 1.00 0.00 C ATOM 967 OH TYR A 63 -4.424 -5.754 -0.987 1.00 0.00 O ATOM 0 H TYR A 63 -9.272 -8.873 1.506 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.007 -10.651 1.907 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.996 -8.164 3.355 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.513 -9.011 3.746 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -4.574 -8.909 2.234 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.169 -6.820 1.297 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -3.373 -7.605 0.538 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.966 -5.512 -0.399 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.042 -5.127 -1.418 1.00 0.00 H new ATOM 977 N LYS A 64 -9.446 -10.392 4.122 1.00 0.00 N ATOM 978 CA LYS A 64 -10.132 -11.046 5.240 1.00 0.00 C ATOM 979 C LYS A 64 -9.218 -11.323 6.437 1.00 0.00 C ATOM 980 O LYS A 64 -9.127 -10.516 7.360 1.00 0.00 O ATOM 981 CB LYS A 64 -10.820 -12.337 4.784 1.00 0.00 C ATOM 982 CG LYS A 64 -11.968 -12.099 3.820 1.00 0.00 C ATOM 983 CD LYS A 64 -12.649 -13.395 3.417 1.00 0.00 C ATOM 984 CE LYS A 64 -13.789 -13.136 2.443 1.00 0.00 C ATOM 985 NZ LYS A 64 -14.482 -14.391 2.046 1.00 0.00 N ATOM 0 H LYS A 64 -9.871 -9.508 3.843 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.887 -10.338 5.582 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.083 -12.984 4.308 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -11.194 -12.869 5.659 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -12.698 -11.434 4.282 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -11.595 -11.593 2.929 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.921 -14.065 2.959 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.032 -13.899 4.304 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.507 -12.455 2.899 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.400 -12.640 1.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.251 -14.168 1.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -13.804 -15.032 1.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -14.877 -14.852 2.891 1.00 0.00 H new ATOM 999 N ASN A 65 -8.537 -12.456 6.410 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.832 -12.957 7.593 1.00 0.00 C ATOM 1001 C ASN A 65 -6.378 -13.346 7.309 1.00 0.00 C ATOM 1002 O ASN A 65 -5.814 -14.176 8.020 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.578 -14.172 8.162 1.00 0.00 C ATOM 1004 CG ASN A 65 -8.611 -15.347 7.196 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -9.505 -15.449 6.355 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -7.651 -16.250 7.317 1.00 0.00 N ATOM 0 H ASN A 65 -8.453 -13.051 5.586 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.811 -12.141 8.315 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -8.100 -14.484 9.091 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -9.599 -13.882 8.410 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -7.636 -17.063 6.702 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -6.927 -16.132 8.025 1.00 0.00 H new ATOM 1013 N ILE A 66 -5.762 -12.745 6.295 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.358 -13.044 5.982 1.00 0.00 C ATOM 1015 C ILE A 66 -3.430 -12.563 7.100 1.00 0.00 C ATOM 1016 O ILE A 66 -3.040 -11.398 7.119 1.00 0.00 O ATOM 1017 CB ILE A 66 -3.896 -12.383 4.664 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -4.861 -12.700 3.526 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -2.488 -12.848 4.306 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -4.521 -11.982 2.241 1.00 0.00 C ATOM 0 H ILE A 66 -6.200 -12.058 5.681 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.300 -14.128 5.878 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.886 -11.303 4.811 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.859 -13.775 3.346 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.872 -12.429 3.830 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.174 -12.375 3.375 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.799 -12.571 5.104 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.483 -13.931 4.182 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.245 -12.250 1.472 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.550 -10.905 2.407 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.522 -12.272 1.916 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.105 -13.463 8.028 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.187 -13.177 9.134 1.00 0.00 C ATOM 1034 C ALA A 67 -2.661 -12.006 9.994 1.00 0.00 C ATOM 1035 O ALA A 67 -3.340 -12.195 11.003 1.00 0.00 O ATOM 1036 CB ALA A 67 -0.776 -12.927 8.614 1.00 0.00 C ATOM 0 H ALA A 67 -3.472 -14.415 8.035 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.174 -14.059 9.774 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.111 -12.717 9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.422 -13.811 8.083 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.784 -12.075 7.935 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.299 -10.802 9.588 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.685 -9.618 10.320 1.00 0.00 C ATOM 1044 C GLY A 68 -3.002 -8.472 9.392 1.00 0.00 C ATOM 1045 O GLY A 68 -2.573 -7.343 9.621 1.00 0.00 O ATOM 0 H GLY A 68 -1.738 -10.623 8.755 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.556 -9.839 10.938 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.880 -9.328 10.996 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.741 -8.766 8.330 1.00 0.00 N ATOM 1050 CA VAL A 69 -4.114 -7.744 7.364 1.00 0.00 C ATOM 1051 C VAL A 69 -5.327 -6.953 7.842 1.00 0.00 C ATOM 1052 O VAL A 69 -6.440 -7.471 7.936 1.00 0.00 O ATOM 1053 CB VAL A 69 -4.387 -8.329 5.958 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -3.087 -8.776 5.307 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -5.377 -9.482 6.024 1.00 0.00 C ATOM 0 H VAL A 69 -4.092 -9.700 8.117 1.00 0.00 H new ATOM 0 HA VAL A 69 -3.259 -7.073 7.282 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.831 -7.543 5.347 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.297 -9.185 4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.416 -7.923 5.211 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -2.616 -9.541 5.924 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.549 -9.872 5.021 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.973 -10.273 6.657 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.320 -9.129 6.442 1.00 0.00 H new ATOM 1065 N GLU A 70 -5.087 -5.698 8.174 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.142 -4.803 8.605 1.00 0.00 C ATOM 1067 C GLU A 70 -6.680 -4.008 7.428 1.00 0.00 C ATOM 1068 O GLU A 70 -6.000 -3.125 6.901 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.627 -3.859 9.688 1.00 0.00 C ATOM 1070 CG GLU A 70 -5.372 -4.550 11.014 1.00 0.00 C ATOM 1071 CD GLU A 70 -6.658 -4.945 11.705 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -7.180 -6.045 11.435 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -7.162 -4.145 12.518 1.00 0.00 O ATOM 0 H GLU A 70 -4.160 -5.273 8.152 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.954 -5.401 9.019 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.703 -3.393 9.345 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.351 -3.058 9.837 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.762 -5.438 10.848 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.800 -3.887 11.664 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.887 -4.343 7.008 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.544 -3.649 5.912 1.00 0.00 C ATOM 1082 C GLU A 71 -9.459 -2.548 6.451 1.00 0.00 C ATOM 1083 O GLU A 71 -10.590 -2.805 6.858 1.00 0.00 O ATOM 1084 CB GLU A 71 -9.338 -4.647 5.057 1.00 0.00 C ATOM 1085 CG GLU A 71 -10.207 -5.593 5.876 1.00 0.00 C ATOM 1086 CD GLU A 71 -11.121 -6.450 5.026 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -12.108 -5.910 4.481 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -10.886 -7.676 4.937 1.00 0.00 O ATOM 0 H GLU A 71 -8.438 -5.100 7.414 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.785 -3.183 5.284 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.971 -4.095 4.362 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.642 -5.233 4.457 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.565 -6.240 6.474 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.810 -5.011 6.573 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.958 -1.322 6.486 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.738 -0.208 7.007 1.00 0.00 C ATOM 1097 C LYS A 72 -10.007 0.835 5.932 1.00 0.00 C ATOM 1098 O LYS A 72 -9.087 1.466 5.414 1.00 0.00 O ATOM 1099 CB LYS A 72 -9.043 0.426 8.213 1.00 0.00 C ATOM 1100 CG LYS A 72 -9.234 -0.368 9.495 1.00 0.00 C ATOM 1101 CD LYS A 72 -8.521 0.275 10.672 1.00 0.00 C ATOM 1102 CE LYS A 72 -8.937 -0.367 11.989 1.00 0.00 C ATOM 1103 NZ LYS A 72 -8.667 -1.831 12.011 1.00 0.00 N ATOM 0 H LYS A 72 -8.023 -1.074 6.163 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.700 -0.604 7.333 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.977 0.517 8.004 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.427 1.436 8.357 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -10.298 -0.450 9.716 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -8.859 -1.382 9.353 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.443 0.180 10.543 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.746 1.341 10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -8.402 0.112 12.809 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -10.000 -0.193 12.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -8.870 -2.207 12.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.273 -2.306 11.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.668 -2.003 11.777 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.277 0.997 5.604 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.701 1.968 4.610 1.00 0.00 C ATOM 1119 C LEU A 73 -12.226 3.222 5.296 1.00 0.00 C ATOM 1120 O LEU A 73 -13.313 3.213 5.873 1.00 0.00 O ATOM 1121 CB LEU A 73 -12.791 1.360 3.725 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.327 0.227 2.810 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.520 -0.544 2.272 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.499 0.785 1.665 1.00 0.00 C ATOM 0 H LEU A 73 -12.041 0.462 6.017 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.847 2.238 3.989 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.590 0.985 4.365 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.220 2.150 3.109 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.708 -0.457 3.390 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.171 -1.347 1.622 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.084 -0.968 3.103 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.162 0.129 1.704 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.174 -0.031 1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.102 1.486 1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.626 1.301 2.065 1.00 0.00 H new ATOM 1136 N THR A 74 -11.451 4.292 5.244 1.00 0.00 N ATOM 1137 CA THR A 74 -11.836 5.529 5.897 1.00 0.00 C ATOM 1138 C THR A 74 -12.385 6.532 4.887 1.00 0.00 C ATOM 1139 O THR A 74 -11.658 7.059 4.043 1.00 0.00 O ATOM 1140 CB THR A 74 -10.654 6.146 6.670 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.479 6.149 5.852 1.00 0.00 O ATOM 1142 CG2 THR A 74 -10.380 5.372 7.952 1.00 0.00 C ATOM 0 H THR A 74 -10.555 4.328 4.758 1.00 0.00 H new ATOM 0 HA THR A 74 -12.623 5.289 6.612 1.00 0.00 H new ATOM 0 HB THR A 74 -10.918 7.171 6.931 1.00 0.00 H new ATOM 0 HG1 THR A 74 -8.734 6.544 6.351 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.542 5.827 8.480 1.00 0.00 H new ATOM 0 HG22 THR A 74 -11.265 5.396 8.588 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.137 4.338 7.708 1.00 0.00 H new ATOM 1150 N TYR A 75 -13.684 6.768 4.965 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.349 7.701 4.071 1.00 0.00 C ATOM 1152 C TYR A 75 -14.429 9.071 4.731 1.00 0.00 C ATOM 1153 O TYR A 75 -15.177 9.264 5.685 1.00 0.00 O ATOM 1154 CB TYR A 75 -15.753 7.194 3.723 1.00 0.00 C ATOM 1155 CG TYR A 75 -15.772 5.754 3.258 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.523 5.426 1.932 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.028 4.722 4.152 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.530 4.111 1.511 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.035 3.405 3.738 1.00 0.00 C ATOM 1160 CZ TYR A 75 -15.784 3.105 2.417 1.00 0.00 C ATOM 1161 OH TYR A 75 -15.790 1.796 2.002 1.00 0.00 O ATOM 0 H TYR A 75 -14.302 6.323 5.643 1.00 0.00 H new ATOM 0 HA TYR A 75 -13.775 7.783 3.148 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.395 7.294 4.598 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.177 7.826 2.943 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -15.321 6.212 1.219 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.225 4.954 5.188 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.337 3.872 0.476 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.236 2.614 4.446 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.400 1.277 2.566 1.00 0.00 H new ATOM 1171 N THR A 76 -13.644 10.012 4.233 1.00 0.00 N ATOM 1172 CA THR A 76 -13.571 11.334 4.838 1.00 0.00 C ATOM 1173 C THR A 76 -14.731 12.215 4.393 1.00 0.00 C ATOM 1174 O THR A 76 -15.693 12.424 5.136 1.00 0.00 O ATOM 1175 CB THR A 76 -12.234 12.024 4.503 1.00 0.00 C ATOM 1176 OG1 THR A 76 -12.010 12.001 3.086 1.00 0.00 O ATOM 1177 CG2 THR A 76 -11.077 11.340 5.218 1.00 0.00 C ATOM 0 H THR A 76 -13.049 9.887 3.414 1.00 0.00 H new ATOM 0 HA THR A 76 -13.636 11.196 5.917 1.00 0.00 H new ATOM 0 HB THR A 76 -12.289 13.058 4.843 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.135 12.396 2.887 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.144 11.845 4.966 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.236 11.388 6.295 1.00 0.00 H new ATOM 0 HG23 THR A 76 -11.021 10.297 4.905 1.00 0.00 H new ATOM 1185 N ASP A 77 -14.633 12.719 3.177 1.00 0.00 N ATOM 1186 CA ASP A 77 -15.654 13.594 2.620 1.00 0.00 C ATOM 1187 C ASP A 77 -15.808 13.372 1.121 1.00 0.00 C ATOM 1188 O ASP A 77 -16.875 12.980 0.651 1.00 0.00 O ATOM 1189 CB ASP A 77 -15.308 15.060 2.891 1.00 0.00 C ATOM 1190 CG ASP A 77 -16.308 16.011 2.264 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -17.337 16.307 2.903 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -16.066 16.469 1.128 1.00 0.00 O ATOM 0 H ASP A 77 -13.850 12.537 2.549 1.00 0.00 H new ATOM 0 HA ASP A 77 -16.600 13.353 3.106 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -15.273 15.230 3.967 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -14.313 15.274 2.502 1.00 0.00 H new ATOM 1197 N THR A 78 -14.742 13.627 0.374 1.00 0.00 N ATOM 1198 CA THR A 78 -14.777 13.492 -1.076 1.00 0.00 C ATOM 1199 C THR A 78 -13.754 12.460 -1.557 1.00 0.00 C ATOM 1200 O THR A 78 -13.579 12.247 -2.760 1.00 0.00 O ATOM 1201 CB THR A 78 -14.525 14.855 -1.765 1.00 0.00 C ATOM 1202 OG1 THR A 78 -14.692 14.736 -3.183 1.00 0.00 O ATOM 1203 CG2 THR A 78 -13.131 15.381 -1.458 1.00 0.00 C ATOM 0 H THR A 78 -13.842 13.928 0.748 1.00 0.00 H new ATOM 0 HA THR A 78 -15.773 13.144 -1.351 1.00 0.00 H new ATOM 0 HB THR A 78 -15.255 15.563 -1.372 1.00 0.00 H new ATOM 0 HG1 THR A 78 -14.367 13.860 -3.478 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.986 16.339 -1.957 1.00 0.00 H new ATOM 0 HG22 THR A 78 -13.020 15.512 -0.382 1.00 0.00 H new ATOM 0 HG23 THR A 78 -12.387 14.669 -1.816 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.091 11.812 -0.610 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.100 10.798 -0.932 1.00 0.00 C ATOM 1213 C TYR A 79 -12.077 9.718 0.142 1.00 0.00 C ATOM 1214 O TYR A 79 -12.326 9.991 1.320 1.00 0.00 O ATOM 1215 CB TYR A 79 -10.705 11.424 -1.104 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.231 12.244 0.079 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -10.647 13.560 0.246 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -9.364 11.708 1.024 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -10.217 14.315 1.318 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -8.928 12.459 2.100 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.359 13.762 2.241 1.00 0.00 C ATOM 1222 OH TYR A 79 -8.930 14.514 3.312 1.00 0.00 O ATOM 0 H TYR A 79 -13.222 11.971 0.389 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.379 10.338 -1.880 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -9.984 10.628 -1.289 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -10.713 12.059 -1.990 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -11.319 13.999 -0.476 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -9.025 10.688 0.916 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -10.552 15.335 1.432 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -8.254 12.028 2.826 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.330 13.976 3.870 1.00 0.00 H new ATOM 1232 N ALA A 80 -11.806 8.498 -0.274 1.00 0.00 N ATOM 1233 CA ALA A 80 -11.737 7.373 0.636 1.00 0.00 C ATOM 1234 C ALA A 80 -10.313 6.855 0.722 1.00 0.00 C ATOM 1235 O ALA A 80 -9.638 6.705 -0.296 1.00 0.00 O ATOM 1236 CB ALA A 80 -12.674 6.267 0.179 1.00 0.00 C ATOM 0 H ALA A 80 -11.628 8.259 -1.249 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.048 7.705 1.626 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.612 5.428 0.872 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.697 6.643 0.155 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.386 5.936 -0.819 1.00 0.00 H new ATOM 1242 N GLN A 81 -9.850 6.608 1.932 1.00 0.00 N ATOM 1243 CA GLN A 81 -8.520 6.069 2.134 1.00 0.00 C ATOM 1244 C GLN A 81 -8.602 4.575 2.412 1.00 0.00 C ATOM 1245 O GLN A 81 -9.101 4.154 3.462 1.00 0.00 O ATOM 1246 CB GLN A 81 -7.811 6.791 3.288 1.00 0.00 C ATOM 1247 CG GLN A 81 -7.619 8.281 3.049 1.00 0.00 C ATOM 1248 CD GLN A 81 -6.979 9.001 4.226 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -7.244 10.181 4.462 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -6.123 8.312 4.965 1.00 0.00 N ATOM 0 H GLN A 81 -10.376 6.772 2.790 1.00 0.00 H new ATOM 0 HA GLN A 81 -7.938 6.228 1.226 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.387 6.650 4.202 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -6.837 6.329 3.450 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.999 8.423 2.164 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -8.587 8.736 2.836 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -5.927 7.336 4.742 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -5.660 8.757 5.758 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.141 3.780 1.458 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.093 2.337 1.625 1.00 0.00 C ATOM 1261 C GLU A 82 -6.820 1.973 2.371 1.00 0.00 C ATOM 1262 O GLU A 82 -5.783 1.710 1.765 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.128 1.633 0.262 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.005 0.119 0.343 1.00 0.00 C ATOM 1265 CD GLU A 82 -7.679 -0.514 -0.998 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -6.592 -0.218 -1.549 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -8.504 -1.308 -1.501 1.00 0.00 O ATOM 0 H GLU A 82 -7.794 4.112 0.558 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.963 2.009 2.195 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.061 1.885 -0.241 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.318 2.020 -0.356 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.227 -0.141 1.061 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.939 -0.298 0.720 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.885 2.007 3.690 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.715 1.749 4.504 1.00 0.00 C ATOM 1276 C ASN A 83 -5.627 0.264 4.815 1.00 0.00 C ATOM 1277 O ASN A 83 -6.281 -0.231 5.733 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.772 2.565 5.803 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.433 2.668 6.528 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -4.185 3.634 7.246 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -3.557 1.690 6.347 1.00 0.00 N ATOM 0 H ASN A 83 -7.734 2.210 4.217 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.825 2.051 3.951 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.128 3.569 5.574 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.503 2.112 6.473 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.649 1.727 6.810 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.791 0.901 5.745 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.834 -0.447 4.035 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.654 -1.874 4.239 1.00 0.00 C ATOM 1290 C VAL A 84 -3.319 -2.138 4.919 1.00 0.00 C ATOM 1291 O VAL A 84 -2.264 -1.806 4.385 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.719 -2.661 2.911 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.593 -4.156 3.163 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -6.009 -2.355 2.167 1.00 0.00 C ATOM 0 H VAL A 84 -4.304 -0.060 3.254 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.471 -2.218 4.874 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.880 -2.346 2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.641 -4.690 2.214 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.639 -4.364 3.648 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.408 -4.486 3.807 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -6.034 -2.920 1.235 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.861 -2.637 2.785 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -6.058 -1.289 1.947 1.00 0.00 H new ATOM 1304 N THR A 85 -3.365 -2.723 6.098 1.00 0.00 N ATOM 1305 CA THR A 85 -2.155 -3.004 6.845 1.00 0.00 C ATOM 1306 C THR A 85 -1.805 -4.476 6.710 1.00 0.00 C ATOM 1307 O THR A 85 -2.389 -5.325 7.376 1.00 0.00 O ATOM 1308 CB THR A 85 -2.314 -2.635 8.332 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.847 -1.307 8.446 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.978 -2.712 9.058 1.00 0.00 C ATOM 0 H THR A 85 -4.227 -3.013 6.560 1.00 0.00 H new ATOM 0 HA THR A 85 -1.350 -2.395 6.434 1.00 0.00 H new ATOM 0 HB THR A 85 -2.998 -3.348 8.791 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.949 -1.076 9.393 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.118 -2.447 10.106 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.585 -3.726 8.990 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.274 -2.018 8.599 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.872 -4.771 5.823 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.501 -6.145 5.538 1.00 0.00 C ATOM 1320 C ILE A 86 0.684 -6.563 6.399 1.00 0.00 C ATOM 1321 O ILE A 86 1.781 -6.027 6.260 1.00 0.00 O ATOM 1322 CB ILE A 86 -0.128 -6.319 4.048 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -1.269 -5.826 3.153 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.190 -7.778 3.747 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.942 -5.858 1.675 1.00 0.00 C ATOM 0 H ILE A 86 -0.356 -4.074 5.286 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.361 -6.775 5.766 1.00 0.00 H new ATOM 0 HB ILE A 86 0.760 -5.721 3.840 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.152 -6.440 3.334 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.526 -4.806 3.437 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.451 -7.884 2.694 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.029 -8.102 4.363 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.682 -8.394 3.969 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.797 -5.495 1.105 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.079 -5.222 1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.714 -6.881 1.375 1.00 0.00 H new ATOM 1337 N ASP A 87 0.454 -7.496 7.314 1.00 0.00 N ATOM 1338 CA ASP A 87 1.541 -8.029 8.120 1.00 0.00 C ATOM 1339 C ASP A 87 2.399 -8.946 7.270 1.00 0.00 C ATOM 1340 O ASP A 87 1.982 -10.045 6.902 1.00 0.00 O ATOM 1341 CB ASP A 87 1.023 -8.785 9.342 1.00 0.00 C ATOM 1342 CG ASP A 87 2.152 -9.186 10.269 1.00 0.00 C ATOM 1343 OD1 ASP A 87 2.651 -8.314 11.013 1.00 0.00 O ATOM 1344 OD2 ASP A 87 2.545 -10.369 10.259 1.00 0.00 O ATOM 0 H ASP A 87 -0.464 -7.894 7.514 1.00 0.00 H new ATOM 0 HA ASP A 87 2.137 -7.190 8.480 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.312 -8.160 9.883 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.484 -9.675 9.018 1.00 0.00 H new ATOM 1349 N MET A 88 3.592 -8.484 6.947 1.00 0.00 N ATOM 1350 CA MET A 88 4.473 -9.214 6.052 1.00 0.00 C ATOM 1351 C MET A 88 5.391 -10.133 6.839 1.00 0.00 C ATOM 1352 O MET A 88 6.251 -10.805 6.271 1.00 0.00 O ATOM 1353 CB MET A 88 5.289 -8.246 5.202 1.00 0.00 C ATOM 1354 CG MET A 88 4.434 -7.273 4.409 1.00 0.00 C ATOM 1355 SD MET A 88 5.422 -6.085 3.487 1.00 0.00 S ATOM 1356 CE MET A 88 6.337 -7.188 2.424 1.00 0.00 C ATOM 0 H MET A 88 3.975 -7.604 7.292 1.00 0.00 H new ATOM 0 HA MET A 88 3.861 -9.825 5.389 1.00 0.00 H new ATOM 0 HB2 MET A 88 5.961 -7.683 5.849 1.00 0.00 H new ATOM 0 HB3 MET A 88 5.913 -8.816 4.513 1.00 0.00 H new ATOM 0 HG2 MET A 88 3.801 -7.830 3.718 1.00 0.00 H new ATOM 0 HG3 MET A 88 3.770 -6.739 5.089 1.00 0.00 H new ATOM 0 HE1 MET A 88 6.893 -6.607 1.689 1.00 0.00 H new ATOM 0 HE2 MET A 88 7.032 -7.777 3.023 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.645 -7.855 1.910 1.00 0.00 H new ATOM 1366 N GLU A 89 5.196 -10.164 8.148 1.00 0.00 N ATOM 1367 CA GLU A 89 5.913 -11.100 8.993 1.00 0.00 C ATOM 1368 C GLU A 89 5.408 -12.505 8.720 1.00 0.00 C ATOM 1369 O GLU A 89 6.169 -13.471 8.747 1.00 0.00 O ATOM 1370 CB GLU A 89 5.729 -10.762 10.472 1.00 0.00 C ATOM 1371 CG GLU A 89 6.351 -9.440 10.893 1.00 0.00 C ATOM 1372 CD GLU A 89 6.172 -9.171 12.373 1.00 0.00 C ATOM 1373 OE1 GLU A 89 5.893 -10.133 13.123 1.00 0.00 O ATOM 1374 OE2 GLU A 89 6.298 -7.999 12.793 1.00 0.00 O ATOM 0 H GLU A 89 4.548 -9.553 8.645 1.00 0.00 H new ATOM 0 HA GLU A 89 6.976 -11.033 8.763 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.663 -10.737 10.697 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.163 -11.562 11.072 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.414 -9.447 10.652 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.900 -8.629 10.321 1.00 0.00 H new ATOM 1381 N LYS A 90 4.114 -12.610 8.443 1.00 0.00 N ATOM 1382 CA LYS A 90 3.508 -13.895 8.156 1.00 0.00 C ATOM 1383 C LYS A 90 2.612 -13.812 6.919 1.00 0.00 C ATOM 1384 O LYS A 90 1.558 -14.447 6.864 1.00 0.00 O ATOM 1385 CB LYS A 90 2.694 -14.376 9.358 1.00 0.00 C ATOM 1386 CG LYS A 90 2.618 -15.890 9.448 1.00 0.00 C ATOM 1387 CD LYS A 90 1.690 -16.357 10.554 1.00 0.00 C ATOM 1388 CE LYS A 90 1.712 -17.872 10.674 1.00 0.00 C ATOM 1389 NZ LYS A 90 1.390 -18.537 9.381 1.00 0.00 N ATOM 0 H LYS A 90 3.469 -11.820 8.412 1.00 0.00 H new ATOM 0 HA LYS A 90 4.306 -14.609 7.956 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.139 -13.984 10.273 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.685 -13.969 9.294 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.274 -16.291 8.495 1.00 0.00 H new ATOM 0 HG3 LYS A 90 3.616 -16.292 9.621 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.991 -15.908 11.501 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.674 -16.019 10.350 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.696 -18.195 11.013 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.995 -18.186 11.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.199 -19.546 9.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.550 -18.090 8.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.196 -18.440 8.731 1.00 0.00 H new ATOM 1403 N VAL A 91 3.036 -13.034 5.925 1.00 0.00 N ATOM 1404 CA VAL A 91 2.303 -12.947 4.661 1.00 0.00 C ATOM 1405 C VAL A 91 2.128 -14.318 4.041 1.00 0.00 C ATOM 1406 O VAL A 91 3.092 -15.077 3.914 1.00 0.00 O ATOM 1407 CB VAL A 91 2.999 -12.051 3.613 1.00 0.00 C ATOM 1408 CG1 VAL A 91 2.336 -10.691 3.540 1.00 0.00 C ATOM 1409 CG2 VAL A 91 4.486 -11.920 3.903 1.00 0.00 C ATOM 0 H VAL A 91 3.877 -12.458 5.968 1.00 0.00 H new ATOM 0 HA VAL A 91 1.341 -12.505 4.919 1.00 0.00 H new ATOM 0 HB VAL A 91 2.893 -12.530 2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.844 -10.078 2.795 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.290 -10.811 3.259 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.397 -10.204 4.513 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.949 -11.284 3.149 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.627 -11.476 4.888 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.949 -12.906 3.880 1.00 0.00 H new ATOM 1419 N ASP A 92 0.905 -14.640 3.663 1.00 0.00 N ATOM 1420 CA ASP A 92 0.654 -15.883 2.965 1.00 0.00 C ATOM 1421 C ASP A 92 0.829 -15.669 1.471 1.00 0.00 C ATOM 1422 O ASP A 92 -0.054 -15.131 0.803 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.743 -16.416 3.260 1.00 0.00 C ATOM 1424 CG ASP A 92 -0.989 -17.744 2.578 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -0.423 -18.758 3.028 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -1.747 -17.780 1.587 1.00 0.00 O ATOM 0 H ASP A 92 0.079 -14.064 3.826 1.00 0.00 H new ATOM 0 HA ASP A 92 1.371 -16.625 3.316 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.869 -16.531 4.337 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.487 -15.692 2.927 1.00 0.00 H new ATOM 1431 N PHE A 93 1.980 -16.078 0.955 1.00 0.00 N ATOM 1432 CA PHE A 93 2.321 -15.846 -0.444 1.00 0.00 C ATOM 1433 C PHE A 93 1.535 -16.763 -1.380 1.00 0.00 C ATOM 1434 O PHE A 93 1.725 -16.722 -2.593 1.00 0.00 O ATOM 1435 CB PHE A 93 3.819 -16.052 -0.680 1.00 0.00 C ATOM 1436 CG PHE A 93 4.690 -14.974 -0.101 1.00 0.00 C ATOM 1437 CD1 PHE A 93 4.860 -13.774 -0.770 1.00 0.00 C ATOM 1438 CD2 PHE A 93 5.348 -15.167 1.103 1.00 0.00 C ATOM 1439 CE1 PHE A 93 5.670 -12.784 -0.249 1.00 0.00 C ATOM 1440 CE2 PHE A 93 6.158 -14.179 1.629 1.00 0.00 C ATOM 1441 CZ PHE A 93 6.320 -12.986 0.952 1.00 0.00 C ATOM 0 H PHE A 93 2.696 -16.574 1.485 1.00 0.00 H new ATOM 0 HA PHE A 93 2.054 -14.813 -0.666 1.00 0.00 H new ATOM 0 HB2 PHE A 93 4.114 -17.010 -0.252 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.001 -16.113 -1.753 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.354 -13.610 -1.710 1.00 0.00 H new ATOM 0 HD2 PHE A 93 5.227 -16.099 1.635 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.795 -11.852 -0.781 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.664 -14.339 2.569 1.00 0.00 H new ATOM 0 HZ PHE A 93 6.954 -12.213 1.361 1.00 0.00 H new ATOM 1451 N LYS A 94 0.665 -17.594 -0.824 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.133 -18.499 -1.634 1.00 0.00 C ATOM 1453 C LYS A 94 -1.444 -17.827 -2.038 1.00 0.00 C ATOM 1454 O LYS A 94 -1.770 -17.741 -3.222 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.402 -19.800 -0.876 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.108 -20.859 -1.708 1.00 0.00 C ATOM 1457 CD LYS A 94 -1.254 -22.160 -0.939 1.00 0.00 C ATOM 1458 CE LYS A 94 -1.939 -23.231 -1.772 1.00 0.00 C ATOM 1459 NZ LYS A 94 -3.332 -22.853 -2.130 1.00 0.00 N ATOM 0 H LYS A 94 0.495 -17.659 0.180 1.00 0.00 H new ATOM 0 HA LYS A 94 0.424 -18.742 -2.539 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.545 -20.204 -0.518 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.007 -19.579 0.003 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.093 -20.496 -2.002 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.547 -21.038 -2.625 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -0.270 -22.513 -0.630 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.829 -21.983 -0.030 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.365 -23.404 -2.682 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.949 -24.170 -1.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.817 -23.672 -2.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.840 -22.549 -1.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.314 -22.073 -2.818 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.182 -17.335 -1.051 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.425 -16.622 -1.310 1.00 0.00 C ATOM 1475 C ALA A 95 -3.141 -15.250 -1.912 1.00 0.00 C ATOM 1476 O ALA A 95 -3.915 -14.742 -2.720 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.235 -16.486 -0.030 1.00 0.00 C ATOM 0 H ALA A 95 -1.941 -17.417 -0.063 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.009 -17.197 -2.029 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.161 -15.951 -0.241 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.469 -17.477 0.359 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.656 -15.933 0.710 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.007 -14.673 -1.526 1.00 0.00 N ATOM 1484 CA LEU A 96 -1.599 -13.351 -1.996 1.00 0.00 C ATOM 1485 C LEU A 96 -1.554 -13.288 -3.524 1.00 0.00 C ATOM 1486 O LEU A 96 -1.826 -12.239 -4.116 1.00 0.00 O ATOM 1487 CB LEU A 96 -0.230 -12.990 -1.394 1.00 0.00 C ATOM 1488 CG LEU A 96 0.354 -11.631 -1.798 1.00 0.00 C ATOM 1489 CD1 LEU A 96 1.150 -11.041 -0.645 1.00 0.00 C ATOM 1490 CD2 LEU A 96 1.249 -11.774 -3.022 1.00 0.00 C ATOM 0 H LEU A 96 -1.346 -15.106 -0.881 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.340 -12.623 -1.665 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.317 -13.016 -0.308 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.482 -13.766 -1.675 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.471 -10.962 -2.044 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.560 -10.076 -0.942 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.497 -10.907 0.217 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.964 -11.716 -0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.654 -10.799 -3.293 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.068 -12.457 -2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 96 0.667 -12.169 -3.854 1.00 0.00 H new ATOM 1502 N GLN A 97 -1.244 -14.419 -4.154 1.00 0.00 N ATOM 1503 CA GLN A 97 -1.116 -14.485 -5.608 1.00 0.00 C ATOM 1504 C GLN A 97 -2.435 -14.139 -6.295 1.00 0.00 C ATOM 1505 O GLN A 97 -2.447 -13.482 -7.334 1.00 0.00 O ATOM 1506 CB GLN A 97 -0.666 -15.883 -6.046 1.00 0.00 C ATOM 1507 CG GLN A 97 0.631 -16.342 -5.404 1.00 0.00 C ATOM 1508 CD GLN A 97 1.823 -15.482 -5.780 1.00 0.00 C ATOM 1509 OE1 GLN A 97 1.894 -14.939 -6.883 1.00 0.00 O ATOM 1510 NE2 GLN A 97 2.768 -15.358 -4.862 1.00 0.00 N ATOM 0 H GLN A 97 -1.076 -15.305 -3.678 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.364 -13.753 -5.904 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -1.452 -16.599 -5.805 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -0.547 -15.893 -7.129 1.00 0.00 H new ATOM 0 HG2 GLN A 97 0.514 -16.335 -4.320 1.00 0.00 H new ATOM 0 HG3 GLN A 97 0.829 -17.373 -5.697 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.668 -15.826 -3.961 1.00 0.00 H new ATOM 0 HE22 GLN A 97 3.596 -14.795 -5.055 1.00 0.00 H new ATOM 1519 N GLY A 98 -3.542 -14.581 -5.711 1.00 0.00 N ATOM 1520 CA GLY A 98 -4.839 -14.343 -6.315 1.00 0.00 C ATOM 1521 C GLY A 98 -5.529 -13.116 -5.757 1.00 0.00 C ATOM 1522 O GLY A 98 -6.591 -12.717 -6.240 1.00 0.00 O ATOM 0 H GLY A 98 -3.565 -15.099 -4.832 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -4.718 -14.228 -7.392 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -5.474 -15.215 -6.157 1.00 0.00 H new ATOM 1526 N ILE A 99 -4.926 -12.513 -4.746 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.515 -11.356 -4.092 1.00 0.00 C ATOM 1528 C ILE A 99 -4.876 -10.066 -4.579 1.00 0.00 C ATOM 1529 O ILE A 99 -5.424 -9.378 -5.440 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.406 -11.471 -2.555 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -6.168 -12.710 -2.084 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -5.946 -10.219 -1.873 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -5.949 -13.051 -0.629 1.00 0.00 C ATOM 0 H ILE A 99 -4.028 -12.806 -4.360 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.572 -11.331 -4.357 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.355 -11.568 -2.283 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.233 -12.555 -2.254 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.869 -13.562 -2.695 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.857 -10.327 -0.792 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.373 -9.351 -2.200 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.994 -10.083 -2.139 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.523 -13.941 -0.374 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.890 -13.240 -0.455 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -6.276 -12.218 -0.007 1.00 0.00 H new ATOM 1648 N ASP A 108 8.358 -11.095 -8.591 1.00 0.00 N ATOM 1649 CA ASP A 108 8.800 -10.631 -7.277 1.00 0.00 C ATOM 1650 C ASP A 108 7.951 -11.251 -6.173 1.00 0.00 C ATOM 1651 O ASP A 108 8.475 -11.813 -5.208 1.00 0.00 O ATOM 1652 CB ASP A 108 8.731 -9.103 -7.205 1.00 0.00 C ATOM 1653 CG ASP A 108 9.152 -8.558 -5.853 1.00 0.00 C ATOM 1654 OD1 ASP A 108 10.027 -9.170 -5.210 1.00 0.00 O ATOM 1655 OD2 ASP A 108 8.619 -7.506 -5.448 1.00 0.00 O ATOM 0 HA ASP A 108 9.834 -10.944 -7.131 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.371 -8.678 -7.978 1.00 0.00 H new ATOM 0 HB3 ASP A 108 7.713 -8.779 -7.421 1.00 0.00 H new ATOM 1660 N ALA A 109 6.637 -11.187 -6.346 1.00 0.00 N ATOM 1661 CA ALA A 109 5.704 -11.733 -5.366 1.00 0.00 C ATOM 1662 C ALA A 109 5.826 -13.251 -5.265 1.00 0.00 C ATOM 1663 O ALA A 109 5.381 -13.859 -4.291 1.00 0.00 O ATOM 1664 CB ALA A 109 4.278 -11.338 -5.722 1.00 0.00 C ATOM 0 H ALA A 109 6.191 -10.761 -7.158 1.00 0.00 H new ATOM 0 HA ALA A 109 5.957 -11.314 -4.392 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.591 -11.751 -4.984 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.192 -10.251 -5.729 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.028 -11.728 -6.709 1.00 0.00 H new ATOM 1670 N LYS A 110 6.415 -13.862 -6.283 1.00 0.00 N ATOM 1671 CA LYS A 110 6.625 -15.303 -6.294 1.00 0.00 C ATOM 1672 C LYS A 110 8.046 -15.640 -5.839 1.00 0.00 C ATOM 1673 O LYS A 110 8.370 -16.798 -5.574 1.00 0.00 O ATOM 1674 CB LYS A 110 6.363 -15.862 -7.695 1.00 0.00 C ATOM 1675 CG LYS A 110 5.008 -15.459 -8.262 1.00 0.00 C ATOM 1676 CD LYS A 110 4.772 -16.051 -9.642 1.00 0.00 C ATOM 1677 CE LYS A 110 3.498 -15.503 -10.270 1.00 0.00 C ATOM 1678 NZ LYS A 110 2.291 -15.815 -9.459 1.00 0.00 N ATOM 0 H LYS A 110 6.757 -13.381 -7.115 1.00 0.00 H new ATOM 0 HA LYS A 110 5.925 -15.764 -5.598 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.148 -15.517 -8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 110 6.426 -16.950 -7.662 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.219 -15.789 -7.586 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.947 -14.372 -8.318 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.622 -15.827 -10.286 1.00 0.00 H new ATOM 0 HD3 LYS A 110 4.705 -17.136 -9.568 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.587 -14.423 -10.384 1.00 0.00 H new ATOM 0 HE3 LYS A 110 3.379 -15.921 -11.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 1.437 -15.575 -10.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 2.281 -16.829 -9.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 2.310 -15.259 -8.580 1.00 0.00 H new ATOM 1692 N LYS A 111 8.883 -14.614 -5.747 1.00 0.00 N ATOM 1693 CA LYS A 111 10.282 -14.779 -5.372 1.00 0.00 C ATOM 1694 C LYS A 111 10.459 -14.560 -3.874 1.00 0.00 C ATOM 1695 O LYS A 111 10.952 -15.438 -3.161 1.00 0.00 O ATOM 1696 CB LYS A 111 11.153 -13.790 -6.164 1.00 0.00 C ATOM 1697 CG LYS A 111 12.637 -13.824 -5.817 1.00 0.00 C ATOM 1698 CD LYS A 111 13.251 -15.188 -6.084 1.00 0.00 C ATOM 1699 CE LYS A 111 14.771 -15.146 -5.996 1.00 0.00 C ATOM 1700 NZ LYS A 111 15.251 -14.585 -4.704 1.00 0.00 N ATOM 0 H LYS A 111 8.613 -13.648 -5.929 1.00 0.00 H new ATOM 0 HA LYS A 111 10.595 -15.796 -5.610 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.038 -13.998 -7.228 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.778 -12.781 -5.994 1.00 0.00 H new ATOM 0 HG2 LYS A 111 13.163 -13.069 -6.400 1.00 0.00 H new ATOM 0 HG3 LYS A 111 12.770 -13.565 -4.766 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.864 -15.909 -5.364 1.00 0.00 H new ATOM 0 HD3 LYS A 111 12.953 -15.534 -7.074 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.167 -16.154 -6.120 1.00 0.00 H new ATOM 0 HE3 LYS A 111 15.163 -14.546 -6.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 16.280 -14.717 -4.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.028 -13.570 -4.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.781 -15.075 -3.917 1.00 0.00 H new ATOM 1714 N GLY A 112 10.039 -13.398 -3.404 1.00 0.00 N ATOM 1715 CA GLY A 112 10.203 -13.055 -2.009 1.00 0.00 C ATOM 1716 C GLY A 112 10.357 -11.564 -1.816 1.00 0.00 C ATOM 1717 O GLY A 112 11.412 -11.000 -2.112 1.00 0.00 O ATOM 0 H GLY A 112 9.584 -12.681 -3.969 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.341 -13.408 -1.443 1.00 0.00 H new ATOM 0 HA3 GLY A 112 11.078 -13.566 -1.609 1.00 0.00 H new ATOM 1721 N ILE A 113 9.303 -10.932 -1.321 1.00 0.00 N ATOM 1722 CA ILE A 113 9.278 -9.485 -1.162 1.00 0.00 C ATOM 1723 C ILE A 113 10.300 -9.026 -0.124 1.00 0.00 C ATOM 1724 O ILE A 113 10.106 -9.196 1.082 1.00 0.00 O ATOM 1725 CB ILE A 113 7.876 -8.987 -0.745 1.00 0.00 C ATOM 1726 CG1 ILE A 113 6.798 -9.536 -1.690 1.00 0.00 C ATOM 1727 CG2 ILE A 113 7.844 -7.466 -0.724 1.00 0.00 C ATOM 1728 CD1 ILE A 113 6.952 -9.096 -3.131 1.00 0.00 C ATOM 0 H ILE A 113 8.449 -11.402 -1.021 1.00 0.00 H new ATOM 0 HA ILE A 113 9.533 -9.057 -2.131 1.00 0.00 H new ATOM 0 HB ILE A 113 7.664 -9.355 0.259 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.817 -10.625 -1.651 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.819 -9.221 -1.328 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.851 -7.127 -0.429 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.581 -7.096 -0.011 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.077 -7.083 -1.718 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.151 -9.528 -3.731 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.902 -8.009 -3.187 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.915 -9.435 -3.514 1.00 0.00 H new ATOM 1740 N THR A 114 11.394 -8.460 -0.603 1.00 0.00 N ATOM 1741 CA THR A 114 12.435 -7.936 0.265 1.00 0.00 C ATOM 1742 C THR A 114 12.612 -6.443 0.021 1.00 0.00 C ATOM 1743 O THR A 114 12.010 -5.889 -0.902 1.00 0.00 O ATOM 1744 CB THR A 114 13.772 -8.661 0.032 1.00 0.00 C ATOM 1745 OG1 THR A 114 14.103 -8.634 -1.362 1.00 0.00 O ATOM 1746 CG2 THR A 114 13.698 -10.103 0.515 1.00 0.00 C ATOM 0 H THR A 114 11.586 -8.351 -1.599 1.00 0.00 H new ATOM 0 HA THR A 114 12.130 -8.105 1.298 1.00 0.00 H new ATOM 0 HB THR A 114 14.546 -8.146 0.600 1.00 0.00 H new ATOM 0 HG1 THR A 114 13.854 -9.488 -1.774 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.655 -10.595 0.340 1.00 0.00 H new ATOM 0 HG22 THR A 114 13.472 -10.118 1.581 1.00 0.00 H new ATOM 0 HG23 THR A 114 12.914 -10.629 -0.030 1.00 0.00 H new ATOM 1754 N MET A 115 13.434 -5.789 0.834 1.00 0.00 N ATOM 1755 CA MET A 115 13.628 -4.354 0.691 1.00 0.00 C ATOM 1756 C MET A 115 14.402 -4.034 -0.581 1.00 0.00 C ATOM 1757 O MET A 115 14.118 -3.049 -1.251 1.00 0.00 O ATOM 1758 CB MET A 115 14.344 -3.760 1.905 1.00 0.00 C ATOM 1759 CG MET A 115 14.441 -2.246 1.840 1.00 0.00 C ATOM 1760 SD MET A 115 12.827 -1.480 1.593 1.00 0.00 S ATOM 1761 CE MET A 115 13.292 0.223 1.302 1.00 0.00 C ATOM 0 H MET A 115 13.968 -6.222 1.587 1.00 0.00 H new ATOM 0 HA MET A 115 12.640 -3.899 0.624 1.00 0.00 H new ATOM 0 HB2 MET A 115 13.813 -4.048 2.813 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.346 -4.182 1.974 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.884 -1.870 2.762 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.107 -1.959 1.027 1.00 0.00 H new ATOM 0 HE1 MET A 115 12.513 0.883 1.683 1.00 0.00 H new ATOM 0 HE2 MET A 115 14.231 0.436 1.813 1.00 0.00 H new ATOM 0 HE3 MET A 115 13.416 0.389 0.232 1.00 0.00 H new ATOM 1771 N ALA A 116 15.368 -4.882 -0.918 1.00 0.00 N ATOM 1772 CA ALA A 116 16.167 -4.688 -2.127 1.00 0.00 C ATOM 1773 C ALA A 116 15.277 -4.693 -3.366 1.00 0.00 C ATOM 1774 O ALA A 116 15.474 -3.900 -4.286 1.00 0.00 O ATOM 1775 CB ALA A 116 17.240 -5.762 -2.232 1.00 0.00 C ATOM 0 H ALA A 116 15.618 -5.708 -0.374 1.00 0.00 H new ATOM 0 HA ALA A 116 16.657 -3.717 -2.064 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.826 -5.604 -3.137 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.895 -5.709 -1.362 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.769 -6.744 -2.272 1.00 0.00 H new ATOM 1781 N GLN A 117 14.294 -5.586 -3.374 1.00 0.00 N ATOM 1782 CA GLN A 117 13.307 -5.621 -4.442 1.00 0.00 C ATOM 1783 C GLN A 117 12.458 -4.368 -4.407 1.00 0.00 C ATOM 1784 O GLN A 117 12.505 -3.598 -5.338 1.00 0.00 O ATOM 1785 CB GLN A 117 12.441 -6.880 -4.351 1.00 0.00 C ATOM 1786 CG GLN A 117 12.751 -7.905 -5.438 1.00 0.00 C ATOM 1787 CD GLN A 117 14.158 -8.473 -5.362 1.00 0.00 C ATOM 1788 OE1 GLN A 117 14.768 -8.781 -6.388 1.00 0.00 O ATOM 1789 NE2 GLN A 117 14.672 -8.650 -4.155 1.00 0.00 N ATOM 0 H GLN A 117 14.161 -6.294 -2.652 1.00 0.00 H new ATOM 0 HA GLN A 117 13.831 -5.655 -5.397 1.00 0.00 H new ATOM 0 HB2 GLN A 117 12.585 -7.342 -3.374 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.391 -6.596 -4.418 1.00 0.00 H new ATOM 0 HG2 GLN A 117 12.035 -8.723 -5.368 1.00 0.00 H new ATOM 0 HG3 GLN A 117 12.609 -7.440 -6.414 1.00 0.00 H new ATOM 0 HE21 GLN A 117 14.137 -8.383 -3.329 1.00 0.00 H new ATOM 0 HE22 GLN A 117 15.603 -9.054 -4.051 1.00 0.00 H new ATOM 1798 N MET A 118 11.728 -4.144 -3.323 1.00 0.00 N ATOM 1799 CA MET A 118 10.899 -2.940 -3.175 1.00 0.00 C ATOM 1800 C MET A 118 11.642 -1.659 -3.567 1.00 0.00 C ATOM 1801 O MET A 118 11.072 -0.773 -4.198 1.00 0.00 O ATOM 1802 CB MET A 118 10.391 -2.824 -1.738 1.00 0.00 C ATOM 1803 CG MET A 118 9.182 -3.695 -1.464 1.00 0.00 C ATOM 1804 SD MET A 118 7.714 -3.104 -2.323 1.00 0.00 S ATOM 1805 CE MET A 118 6.654 -4.533 -2.186 1.00 0.00 C ATOM 0 H MET A 118 11.688 -4.779 -2.526 1.00 0.00 H new ATOM 0 HA MET A 118 10.058 -3.049 -3.860 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.192 -3.099 -1.052 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.137 -1.784 -1.531 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.395 -4.718 -1.773 1.00 0.00 H new ATOM 0 HG3 MET A 118 8.989 -3.720 -0.392 1.00 0.00 H new ATOM 0 HE1 MET A 118 5.639 -4.262 -2.476 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.021 -5.322 -2.842 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.654 -4.889 -1.156 1.00 0.00 H new ATOM 1815 N GLU A 119 12.912 -1.572 -3.200 1.00 0.00 N ATOM 1816 CA GLU A 119 13.725 -0.397 -3.498 1.00 0.00 C ATOM 1817 C GLU A 119 13.913 -0.214 -5.011 1.00 0.00 C ATOM 1818 O GLU A 119 13.497 0.797 -5.585 1.00 0.00 O ATOM 1819 CB GLU A 119 15.082 -0.533 -2.801 1.00 0.00 C ATOM 1820 CG GLU A 119 15.963 0.697 -2.906 1.00 0.00 C ATOM 1821 CD GLU A 119 15.321 1.927 -2.296 1.00 0.00 C ATOM 1822 OE1 GLU A 119 14.609 2.653 -3.017 1.00 0.00 O ATOM 1823 OE2 GLU A 119 15.527 2.177 -1.090 1.00 0.00 O ATOM 0 H GLU A 119 13.407 -2.305 -2.692 1.00 0.00 H new ATOM 0 HA GLU A 119 13.209 0.488 -3.125 1.00 0.00 H new ATOM 0 HB2 GLU A 119 14.915 -0.757 -1.747 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.613 -1.384 -3.228 1.00 0.00 H new ATOM 0 HG2 GLU A 119 16.913 0.503 -2.408 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.187 0.891 -3.955 1.00 0.00 H new ATOM 1830 N LEU A 120 14.520 -1.207 -5.651 1.00 0.00 N ATOM 1831 CA LEU A 120 14.841 -1.138 -7.078 1.00 0.00 C ATOM 1832 C LEU A 120 13.582 -1.205 -7.941 1.00 0.00 C ATOM 1833 O LEU A 120 13.502 -0.600 -9.009 1.00 0.00 O ATOM 1834 CB LEU A 120 15.780 -2.291 -7.446 1.00 0.00 C ATOM 1835 CG LEU A 120 17.169 -2.233 -6.804 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.985 -3.454 -7.195 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.895 -0.957 -7.209 1.00 0.00 C ATOM 0 H LEU A 120 14.803 -2.078 -5.202 1.00 0.00 H new ATOM 0 HA LEU A 120 15.328 -0.182 -7.270 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.305 -3.230 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.899 -2.310 -8.529 1.00 0.00 H new ATOM 0 HG LEU A 120 17.047 -2.229 -5.721 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.970 -3.398 -6.731 1.00 0.00 H new ATOM 0 HD12 LEU A 120 17.475 -4.356 -6.856 1.00 0.00 H new ATOM 0 HD13 LEU A 120 18.096 -3.485 -8.279 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.880 -0.935 -6.742 1.00 0.00 H new ATOM 0 HD22 LEU A 120 18.006 -0.930 -8.293 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.319 -0.091 -6.882 1.00 0.00 H new ATOM 1849 N VAL A 121 12.606 -1.936 -7.445 1.00 0.00 N ATOM 1850 CA VAL A 121 11.361 -2.202 -8.146 1.00 0.00 C ATOM 1851 C VAL A 121 10.486 -0.949 -8.209 1.00 0.00 C ATOM 1852 O VAL A 121 9.956 -0.607 -9.267 1.00 0.00 O ATOM 1853 CB VAL A 121 10.613 -3.369 -7.449 1.00 0.00 C ATOM 1854 CG1 VAL A 121 9.131 -3.356 -7.721 1.00 0.00 C ATOM 1855 CG2 VAL A 121 11.190 -4.713 -7.868 1.00 0.00 C ATOM 0 H VAL A 121 12.654 -2.372 -6.524 1.00 0.00 H new ATOM 0 HA VAL A 121 11.589 -2.490 -9.172 1.00 0.00 H new ATOM 0 HB VAL A 121 10.758 -3.224 -6.378 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.660 -4.195 -7.208 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.703 -2.422 -7.358 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.957 -3.442 -8.794 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.648 -5.514 -7.365 1.00 0.00 H new ATOM 0 HG22 VAL A 121 11.092 -4.830 -8.947 1.00 0.00 H new ATOM 0 HG23 VAL A 121 12.243 -4.759 -7.592 1.00 0.00 H new ATOM 1865 N MET A 122 10.359 -0.254 -7.085 1.00 0.00 N ATOM 1866 CA MET A 122 9.579 0.978 -7.041 1.00 0.00 C ATOM 1867 C MET A 122 10.248 2.071 -7.860 1.00 0.00 C ATOM 1868 O MET A 122 9.576 2.863 -8.522 1.00 0.00 O ATOM 1869 CB MET A 122 9.366 1.434 -5.596 1.00 0.00 C ATOM 1870 CG MET A 122 8.057 0.936 -5.004 1.00 0.00 C ATOM 1871 SD MET A 122 7.822 -0.837 -5.235 1.00 0.00 S ATOM 1872 CE MET A 122 6.101 -1.015 -4.780 1.00 0.00 C ATOM 0 H MET A 122 10.783 -0.520 -6.196 1.00 0.00 H new ATOM 0 HA MET A 122 8.602 0.777 -7.480 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.194 1.079 -4.983 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.385 2.523 -5.558 1.00 0.00 H new ATOM 0 HG2 MET A 122 8.033 1.166 -3.939 1.00 0.00 H new ATOM 0 HG3 MET A 122 7.227 1.472 -5.464 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.807 -2.060 -4.872 1.00 0.00 H new ATOM 0 HE2 MET A 122 5.961 -0.688 -3.750 1.00 0.00 H new ATOM 0 HE3 MET A 122 5.485 -0.405 -5.441 1.00 0.00 H new ATOM 1882 N LYS A 123 11.574 2.097 -7.833 1.00 0.00 N ATOM 1883 CA LYS A 123 12.328 3.039 -8.647 1.00 0.00 C ATOM 1884 C LYS A 123 12.185 2.707 -10.132 1.00 0.00 C ATOM 1885 O LYS A 123 12.214 3.596 -10.979 1.00 0.00 O ATOM 1886 CB LYS A 123 13.802 3.047 -8.241 1.00 0.00 C ATOM 1887 CG LYS A 123 14.083 3.864 -6.989 1.00 0.00 C ATOM 1888 CD LYS A 123 15.531 3.731 -6.551 1.00 0.00 C ATOM 1889 CE LYS A 123 15.916 4.804 -5.543 1.00 0.00 C ATOM 1890 NZ LYS A 123 15.010 4.831 -4.363 1.00 0.00 N ATOM 0 H LYS A 123 12.147 1.479 -7.259 1.00 0.00 H new ATOM 0 HA LYS A 123 11.919 4.035 -8.477 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.131 2.021 -8.077 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.395 3.444 -9.065 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.854 4.913 -7.179 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.426 3.535 -6.184 1.00 0.00 H new ATOM 0 HD2 LYS A 123 15.689 2.746 -6.112 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.182 3.800 -7.422 1.00 0.00 H new ATOM 0 HE2 LYS A 123 16.939 4.632 -5.207 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.900 5.778 -6.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 15.518 5.222 -3.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 14.183 5.425 -4.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.695 3.864 -4.145 1.00 0.00 H new ATOM 1904 N ALA A 124 12.016 1.425 -10.436 1.00 0.00 N ATOM 1905 CA ALA A 124 11.827 0.981 -11.813 1.00 0.00 C ATOM 1906 C ALA A 124 10.429 1.330 -12.313 1.00 0.00 C ATOM 1907 O ALA A 124 10.224 1.595 -13.499 1.00 0.00 O ATOM 1908 CB ALA A 124 12.065 -0.518 -11.926 1.00 0.00 C ATOM 0 H ALA A 124 12.006 0.673 -9.746 1.00 0.00 H new ATOM 0 HA ALA A 124 12.554 1.501 -12.437 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.920 -0.833 -12.959 1.00 0.00 H new ATOM 0 HB2 ALA A 124 13.084 -0.749 -11.616 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.362 -1.048 -11.283 1.00 0.00 H new ATOM 1914 N ALA A 125 9.468 1.328 -11.397 1.00 0.00 N ATOM 1915 CA ALA A 125 8.082 1.629 -11.733 1.00 0.00 C ATOM 1916 C ALA A 125 7.862 3.131 -11.866 1.00 0.00 C ATOM 1917 O ALA A 125 6.830 3.574 -12.370 1.00 0.00 O ATOM 1918 CB ALA A 125 7.148 1.055 -10.681 1.00 0.00 C ATOM 0 H ALA A 125 9.625 1.120 -10.411 1.00 0.00 H new ATOM 0 HA ALA A 125 7.861 1.167 -12.695 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.116 1.287 -10.945 1.00 0.00 H new ATOM 0 HB2 ALA A 125 7.275 -0.026 -10.632 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.381 1.492 -9.710 1.00 0.00 H new ATOM 1924 N GLY A 126 8.834 3.908 -11.410 1.00 0.00 N ATOM 1925 CA GLY A 126 8.721 5.349 -11.474 1.00 0.00 C ATOM 1926 C GLY A 126 7.953 5.912 -10.297 1.00 0.00 C ATOM 1927 O GLY A 126 7.321 6.966 -10.400 1.00 0.00 O ATOM 0 H GLY A 126 9.701 3.564 -10.996 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.718 5.790 -11.500 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.222 5.632 -12.401 1.00 0.00 H new ATOM 1931 N PHE A 127 8.002 5.210 -9.173 1.00 0.00 N ATOM 1932 CA PHE A 127 7.318 5.655 -7.972 1.00 0.00 C ATOM 1933 C PHE A 127 8.177 6.657 -7.213 1.00 0.00 C ATOM 1934 O PHE A 127 9.402 6.537 -7.175 1.00 0.00 O ATOM 1935 CB PHE A 127 6.965 4.469 -7.072 1.00 0.00 C ATOM 1936 CG PHE A 127 5.928 3.547 -7.654 1.00 0.00 C ATOM 1937 CD1 PHE A 127 4.862 4.054 -8.381 1.00 0.00 C ATOM 1938 CD2 PHE A 127 6.014 2.178 -7.467 1.00 0.00 C ATOM 1939 CE1 PHE A 127 3.904 3.211 -8.911 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.057 1.331 -7.993 1.00 0.00 C ATOM 1941 CZ PHE A 127 4.001 1.848 -8.717 1.00 0.00 C ATOM 0 H PHE A 127 8.509 4.331 -9.070 1.00 0.00 H new ATOM 0 HA PHE A 127 6.390 6.143 -8.271 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.871 3.898 -6.869 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.605 4.847 -6.115 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.779 5.120 -8.535 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.839 1.767 -6.903 1.00 0.00 H new ATOM 0 HE1 PHE A 127 3.079 3.619 -9.477 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.135 0.265 -7.838 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.253 1.188 -9.130 1.00 0.00 H new ATOM 1951 N LYS A 128 7.531 7.644 -6.614 1.00 0.00 N ATOM 1952 CA LYS A 128 8.239 8.693 -5.900 1.00 0.00 C ATOM 1953 C LYS A 128 8.059 8.539 -4.395 1.00 0.00 C ATOM 1954 O LYS A 128 6.940 8.399 -3.894 1.00 0.00 O ATOM 1955 CB LYS A 128 7.769 10.068 -6.383 1.00 0.00 C ATOM 1956 CG LYS A 128 6.259 10.239 -6.380 1.00 0.00 C ATOM 1957 CD LYS A 128 5.811 11.400 -7.258 1.00 0.00 C ATOM 1958 CE LYS A 128 5.884 11.062 -8.747 1.00 0.00 C ATOM 1959 NZ LYS A 128 7.279 11.041 -9.270 1.00 0.00 N ATOM 0 H LYS A 128 6.516 7.740 -6.608 1.00 0.00 H new ATOM 0 HA LYS A 128 9.305 8.605 -6.111 1.00 0.00 H new ATOM 0 HB2 LYS A 128 8.213 10.836 -5.750 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.142 10.234 -7.394 1.00 0.00 H new ATOM 0 HG2 LYS A 128 5.790 9.319 -6.729 1.00 0.00 H new ATOM 0 HG3 LYS A 128 5.916 10.404 -5.359 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.788 11.675 -7.000 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.436 12.269 -7.054 1.00 0.00 H new ATOM 0 HE2 LYS A 128 5.423 10.089 -8.916 1.00 0.00 H new ATOM 0 HE3 LYS A 128 5.302 11.792 -9.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 7.282 11.347 -10.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 7.870 11.686 -8.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 7.660 10.076 -9.204 1.00 0.00 H new ATOM 1973 N GLU A 129 9.176 8.553 -3.688 1.00 0.00 N ATOM 1974 CA GLU A 129 9.190 8.327 -2.252 1.00 0.00 C ATOM 1975 C GLU A 129 9.066 9.638 -1.480 1.00 0.00 C ATOM 1976 O GLU A 129 9.814 10.587 -1.713 1.00 0.00 O ATOM 1977 CB GLU A 129 10.471 7.581 -1.863 1.00 0.00 C ATOM 1978 CG GLU A 129 11.704 8.056 -2.621 1.00 0.00 C ATOM 1979 CD GLU A 129 12.944 7.240 -2.313 1.00 0.00 C ATOM 1980 OE1 GLU A 129 13.012 6.063 -2.730 1.00 0.00 O ATOM 1981 OE2 GLU A 129 13.868 7.781 -1.671 1.00 0.00 O ATOM 0 H GLU A 129 10.097 8.721 -4.092 1.00 0.00 H new ATOM 0 HA GLU A 129 8.327 7.716 -1.988 1.00 0.00 H new ATOM 0 HB2 GLU A 129 10.642 7.703 -0.793 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.331 6.515 -2.044 1.00 0.00 H new ATOM 0 HG2 GLU A 129 11.504 8.012 -3.692 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.894 9.101 -2.375 1.00 0.00 H new ATOM 1988 N VAL A 130 8.104 9.677 -0.565 1.00 0.00 N ATOM 1989 CA VAL A 130 7.871 10.850 0.270 1.00 0.00 C ATOM 1990 C VAL A 130 8.806 10.819 1.478 1.00 0.00 C ATOM 1991 O VAL A 130 9.237 11.857 1.978 1.00 0.00 O ATOM 1992 CB VAL A 130 6.396 10.909 0.739 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.133 12.144 1.588 1.00 0.00 C ATOM 1994 CG2 VAL A 130 5.457 10.875 -0.458 1.00 0.00 C ATOM 0 H VAL A 130 7.467 8.902 -0.382 1.00 0.00 H new ATOM 0 HA VAL A 130 8.076 11.742 -0.321 1.00 0.00 H new ATOM 0 HB VAL A 130 6.207 10.033 1.359 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.089 12.155 1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 130 6.775 12.124 2.468 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.346 13.039 1.004 1.00 0.00 H new ATOM 0 HG21 VAL A 130 4.424 10.917 -0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.659 11.730 -1.103 1.00 0.00 H new ATOM 0 HG23 VAL A 130 5.615 9.953 -1.018 1.00 0.00 H new ATOM 2004 N LYS A 131 9.091 9.602 1.941 1.00 0.00 N ATOM 2005 CA LYS A 131 10.109 9.345 2.967 1.00 0.00 C ATOM 2006 C LYS A 131 9.668 9.803 4.365 1.00 0.00 C ATOM 2007 O LYS A 131 10.460 9.783 5.307 1.00 0.00 O ATOM 2008 CB LYS A 131 11.446 9.986 2.565 1.00 0.00 C ATOM 2009 CG LYS A 131 12.651 9.421 3.307 1.00 0.00 C ATOM 2010 CD LYS A 131 13.951 9.752 2.591 1.00 0.00 C ATOM 2011 CE LYS A 131 13.956 9.191 1.177 1.00 0.00 C ATOM 2012 NZ LYS A 131 15.246 9.432 0.479 1.00 0.00 N ATOM 0 H LYS A 131 8.620 8.758 1.614 1.00 0.00 H new ATOM 0 HA LYS A 131 10.243 8.265 3.028 1.00 0.00 H new ATOM 0 HB2 LYS A 131 11.595 9.850 1.494 1.00 0.00 H new ATOM 0 HB3 LYS A 131 11.392 11.060 2.745 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.679 9.825 4.319 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.549 8.340 3.398 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.086 10.833 2.557 1.00 0.00 H new ATOM 0 HD3 LYS A 131 14.792 9.343 3.151 1.00 0.00 H new ATOM 0 HE2 LYS A 131 13.760 8.119 1.213 1.00 0.00 H new ATOM 0 HE3 LYS A 131 13.146 9.645 0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.233 8.960 -0.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 15.382 10.454 0.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 16.027 9.051 1.051 1.00 0.00 H new