USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1104 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 10 MET CE :methyl -121:sc= -1.79 (180deg=-0.432) USER MOD Set 1.2: A 51 HIS : no HD1:sc= -0.886 K(o=-2.7,f=-1.6) USER MOD Set 2.1: A 39 THR OG1 : rot 76:sc= 0.386 USER MOD Set 2.2: A 77 SER OG : rot -110:sc= 0.338 USER MOD Set 3.1: A 37 GLN : amide:sc= -0.238 X(o=-0.24,f=0.19) USER MOD Set 3.2: A 40 LYS NZ :NH3+ -129:sc= 0 (180deg=0) USER MOD Set 4.1: A 22 SER OG : rot 180:sc= -0.171 USER MOD Set 4.2: A 34 LYS NZ :NH3+ 148:sc= -1.06 (180deg=-3.12) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 74:sc= 0.351 USER MOD Single : A 17 ASN : amide:sc= -0.719 K(o=-0.72,f=-0.027) USER MOD Single : A 18 SER OG : rot 68:sc= 0.0555 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.339 X(o=-0.34,f=-0.36) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 174:sc= 0.5 (180deg=0.479) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl -168:sc= -3.48! (180deg=-3.91!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 150:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 150:sc= -1.21 (180deg=-2.16!) USER MOD Single : A 54 GLN : amide:sc= -0.112 K(o=-0.11,f=-1) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.17) USER MOD Single : A 62 LYS NZ :NH3+ 160:sc= -0.0141 (180deg=-0.157) USER MOD Single : A 63 CYS SG : rot -46:sc= 0.606 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 8:sc= 1.27 USER MOD Single : A 68 LYS NZ :NH3+ 171:sc= 1.96 (180deg=1.94) USER MOD Single : A 73 TYR OH : rot 180:sc= -0.0289 USER MOD Single : A 81 GLN : amide:sc= -2.17 K(o=-2.2,f=-0.85) USER MOD Single : A 82 SER OG : rot 130:sc= 0.803 USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 GLN : amide:sc= -4.4! C(o=-4.4!,f=-2.8!) USER MOD Single : A 98 SER OG : rot 1:sc= 0.145 USER MOD Single : A 99 ASN : amide:sc= -1.58 K(o=-1.6,f=-2.5) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 160:sc= -0.75 USER MOD Single : A 106 GLN : amide:sc= -0.595 K(o=-0.59,f=-1.6!) USER MOD Single : A 107 ASN : amide:sc= -0.378 K(o=-0.38,f=-1.3) USER MOD Single : A 109 TYR OH : rot -100:sc= 0.306 USER MOD Single : A 111 CYS SG : rot -86:sc= -0.178 USER MOD Single : A 116 LYS NZ :NH3+ 168:sc= -1.82 (180deg=-2.23) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 0.534 K(o=0.53,f=0) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 158:sc= -0.114 (180deg=-0.541) USER MOD Single : A 129 ASN : amide:sc= 0.446 X(o=0.45,f=0) USER MOD Single : A 130 ASN : amide:sc= -2.45! C(o=-2.4!,f=-4.4!) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0.331 K(o=0.33,f=-0.29) USER MOD Single : A 143 MET CE :methyl -147:sc= -3.38 (180deg=-7.25!) USER MOD ----------------------------------------------------------------- ATOM 92 N MET A 10 -17.010 11.704 2.458 1.00 0.00 N ATOM 93 CA MET A 10 -15.803 10.994 2.052 1.00 0.00 C ATOM 94 C MET A 10 -16.152 9.735 1.264 1.00 0.00 C ATOM 95 O MET A 10 -15.678 8.644 1.579 1.00 0.00 O ATOM 96 CB MET A 10 -14.966 10.626 3.278 1.00 0.00 C ATOM 97 CG MET A 10 -14.630 11.815 4.164 1.00 0.00 C ATOM 98 SD MET A 10 -13.775 11.335 5.677 1.00 0.00 S ATOM 99 CE MET A 10 -12.251 10.672 5.008 1.00 0.00 C ATOM 0 HA MET A 10 -15.222 11.655 1.409 1.00 0.00 H new ATOM 0 HB2 MET A 10 -15.506 9.885 3.868 1.00 0.00 H new ATOM 0 HB3 MET A 10 -14.040 10.156 2.948 1.00 0.00 H new ATOM 0 HG2 MET A 10 -14.008 12.514 3.606 1.00 0.00 H new ATOM 0 HG3 MET A 10 -15.549 12.342 4.422 1.00 0.00 H new ATOM 0 HE1 MET A 10 -12.140 9.632 5.316 1.00 0.00 H new ATOM 0 HE2 MET A 10 -12.277 10.727 3.920 1.00 0.00 H new ATOM 0 HE3 MET A 10 -11.407 11.253 5.380 1.00 0.00 H new ATOM 109 N GLU A 11 -16.983 9.896 0.239 1.00 0.00 N ATOM 110 CA GLU A 11 -17.396 8.771 -0.592 1.00 0.00 C ATOM 111 C GLU A 11 -16.221 8.237 -1.407 1.00 0.00 C ATOM 112 O GLU A 11 -16.032 7.026 -1.523 1.00 0.00 O ATOM 113 CB GLU A 11 -18.531 9.189 -1.529 1.00 0.00 C ATOM 114 CG GLU A 11 -18.842 8.163 -2.605 1.00 0.00 C ATOM 115 CD GLU A 11 -19.824 8.680 -3.638 1.00 0.00 C ATOM 116 OE1 GLU A 11 -19.382 9.353 -4.592 1.00 0.00 O ATOM 117 OE2 GLU A 11 -21.035 8.411 -3.493 1.00 0.00 O ATOM 0 H GLU A 11 -17.383 10.793 -0.036 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.751 7.978 0.066 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -19.430 9.368 -0.939 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -18.268 10.134 -2.005 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -17.917 7.872 -3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.249 7.266 -2.139 1.00 0.00 H new ATOM 124 N ALA A 12 -15.435 9.149 -1.969 1.00 0.00 N ATOM 125 CA ALA A 12 -14.278 8.771 -2.771 1.00 0.00 C ATOM 126 C ALA A 12 -13.384 7.792 -2.018 1.00 0.00 C ATOM 127 O ALA A 12 -12.958 6.775 -2.567 1.00 0.00 O ATOM 128 CB ALA A 12 -13.487 10.008 -3.173 1.00 0.00 C ATOM 0 H ALA A 12 -15.578 10.155 -1.884 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.639 8.275 -3.672 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.626 9.711 -3.771 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.123 10.673 -3.758 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.145 10.528 -2.278 1.00 0.00 H new ATOM 134 N VAL A 13 -13.102 8.104 -0.757 1.00 0.00 N ATOM 135 CA VAL A 13 -12.259 7.251 0.072 1.00 0.00 C ATOM 136 C VAL A 13 -12.838 5.845 0.181 1.00 0.00 C ATOM 137 O VAL A 13 -12.288 4.890 -0.368 1.00 0.00 O ATOM 138 CB VAL A 13 -12.089 7.835 1.487 1.00 0.00 C ATOM 139 CG1 VAL A 13 -11.300 6.878 2.368 1.00 0.00 C ATOM 140 CG2 VAL A 13 -11.411 9.195 1.423 1.00 0.00 C ATOM 0 H VAL A 13 -13.445 8.942 -0.287 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.284 7.203 -0.413 1.00 0.00 H new ATOM 0 HB VAL A 13 -13.077 7.967 1.929 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -11.190 7.307 3.364 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -11.830 5.928 2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.314 6.712 1.933 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -11.299 9.593 2.431 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.429 9.090 0.963 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -12.019 9.877 0.829 1.00 0.00 H new ATOM 150 N LYS A 14 -13.954 5.724 0.892 1.00 0.00 N ATOM 151 CA LYS A 14 -14.611 4.435 1.072 1.00 0.00 C ATOM 152 C LYS A 14 -14.447 3.562 -0.168 1.00 0.00 C ATOM 153 O LYS A 14 -14.166 2.367 -0.067 1.00 0.00 O ATOM 154 CB LYS A 14 -16.098 4.635 1.375 1.00 0.00 C ATOM 155 CG LYS A 14 -16.359 5.459 2.624 1.00 0.00 C ATOM 156 CD LYS A 14 -17.771 6.021 2.636 1.00 0.00 C ATOM 157 CE LYS A 14 -17.865 7.272 3.496 1.00 0.00 C ATOM 158 NZ LYS A 14 -17.862 6.947 4.949 1.00 0.00 N ATOM 0 H LYS A 14 -14.423 6.504 1.353 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.139 3.930 1.915 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.571 5.123 0.523 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.572 3.660 1.488 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.205 4.840 3.508 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.640 6.277 2.678 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -18.080 6.255 1.617 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -18.461 5.266 3.013 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -17.028 7.932 3.270 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.776 7.816 3.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -17.927 7.826 5.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.675 6.338 5.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -16.981 6.450 5.192 1.00 0.00 H new ATOM 172 N THR A 15 -14.622 4.166 -1.339 1.00 0.00 N ATOM 173 CA THR A 15 -14.493 3.445 -2.598 1.00 0.00 C ATOM 174 C THR A 15 -13.099 2.846 -2.749 1.00 0.00 C ATOM 175 O THR A 15 -12.951 1.661 -3.050 1.00 0.00 O ATOM 176 CB THR A 15 -14.778 4.362 -3.803 1.00 0.00 C ATOM 177 OG1 THR A 15 -16.103 4.896 -3.709 1.00 0.00 O ATOM 178 CG2 THR A 15 -14.624 3.600 -5.111 1.00 0.00 C ATOM 0 H THR A 15 -14.854 5.154 -1.441 1.00 0.00 H new ATOM 0 HA THR A 15 -15.230 2.643 -2.579 1.00 0.00 H new ATOM 0 HB THR A 15 -14.056 5.178 -3.790 1.00 0.00 H new ATOM 0 HG1 THR A 15 -16.129 5.587 -3.014 1.00 0.00 H new ATOM 0 HG21 THR A 15 -14.830 4.268 -5.948 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.606 3.220 -5.193 1.00 0.00 H new ATOM 0 HG23 THR A 15 -15.326 2.766 -5.131 1.00 0.00 H new ATOM 186 N PHE A 16 -12.080 3.671 -2.536 1.00 0.00 N ATOM 187 CA PHE A 16 -10.697 3.222 -2.648 1.00 0.00 C ATOM 188 C PHE A 16 -10.364 2.208 -1.557 1.00 0.00 C ATOM 189 O PHE A 16 -9.606 1.266 -1.782 1.00 0.00 O ATOM 190 CB PHE A 16 -9.743 4.415 -2.559 1.00 0.00 C ATOM 191 CG PHE A 16 -8.297 4.020 -2.455 1.00 0.00 C ATOM 192 CD1 PHE A 16 -7.737 3.709 -1.227 1.00 0.00 C ATOM 193 CD2 PHE A 16 -7.499 3.960 -3.586 1.00 0.00 C ATOM 194 CE1 PHE A 16 -6.407 3.345 -1.128 1.00 0.00 C ATOM 195 CE2 PHE A 16 -6.169 3.596 -3.493 1.00 0.00 C ATOM 196 CZ PHE A 16 -5.622 3.289 -2.263 1.00 0.00 C ATOM 0 H PHE A 16 -12.185 4.654 -2.285 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.575 2.739 -3.618 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.877 5.044 -3.439 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -10.010 5.019 -1.692 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -8.346 3.751 -0.336 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -7.921 4.200 -4.551 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.982 3.105 -0.164 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.558 3.552 -4.382 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.582 3.006 -2.189 1.00 0.00 H new ATOM 206 N ASN A 17 -10.938 2.410 -0.375 1.00 0.00 N ATOM 207 CA ASN A 17 -10.701 1.514 0.751 1.00 0.00 C ATOM 208 C ASN A 17 -11.076 0.079 0.393 1.00 0.00 C ATOM 209 O ASN A 17 -10.619 -0.870 1.030 1.00 0.00 O ATOM 210 CB ASN A 17 -11.503 1.973 1.971 1.00 0.00 C ATOM 211 CG ASN A 17 -10.719 2.924 2.854 1.00 0.00 C ATOM 212 OD1 ASN A 17 -10.568 2.693 4.054 1.00 0.00 O ATOM 213 ND2 ASN A 17 -10.215 4.001 2.263 1.00 0.00 N ATOM 0 H ASN A 17 -11.570 3.185 -0.172 1.00 0.00 H new ATOM 0 HA ASN A 17 -9.638 1.544 0.990 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -12.418 2.462 1.638 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -11.801 1.102 2.555 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.678 4.677 2.807 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.365 4.153 1.266 1.00 0.00 H new ATOM 220 N SER A 18 -11.910 -0.071 -0.631 1.00 0.00 N ATOM 221 CA SER A 18 -12.348 -1.390 -1.072 1.00 0.00 C ATOM 222 C SER A 18 -11.382 -1.967 -2.102 1.00 0.00 C ATOM 223 O SER A 18 -11.029 -3.145 -2.045 1.00 0.00 O ATOM 224 CB SER A 18 -13.756 -1.310 -1.666 1.00 0.00 C ATOM 225 OG SER A 18 -14.673 -0.768 -0.732 1.00 0.00 O ATOM 0 H SER A 18 -12.296 0.704 -1.170 1.00 0.00 H new ATOM 0 HA SER A 18 -12.363 -2.050 -0.204 1.00 0.00 H new ATOM 0 HB2 SER A 18 -13.740 -0.694 -2.565 1.00 0.00 H new ATOM 0 HB3 SER A 18 -14.084 -2.305 -1.967 1.00 0.00 H new ATOM 0 HG SER A 18 -14.462 0.176 -0.577 1.00 0.00 H new ATOM 231 N GLU A 19 -10.958 -1.129 -3.042 1.00 0.00 N ATOM 232 CA GLU A 19 -10.033 -1.556 -4.086 1.00 0.00 C ATOM 233 C GLU A 19 -8.658 -1.866 -3.500 1.00 0.00 C ATOM 234 O GLU A 19 -8.000 -2.825 -3.906 1.00 0.00 O ATOM 235 CB GLU A 19 -9.909 -0.475 -5.162 1.00 0.00 C ATOM 236 CG GLU A 19 -11.244 0.104 -5.599 1.00 0.00 C ATOM 237 CD GLU A 19 -12.208 -0.958 -6.092 1.00 0.00 C ATOM 238 OE1 GLU A 19 -12.632 -1.800 -5.273 1.00 0.00 O ATOM 239 OE2 GLU A 19 -12.537 -0.947 -7.297 1.00 0.00 O ATOM 0 H GLU A 19 -11.240 -0.151 -3.103 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.430 -2.465 -4.539 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.279 0.331 -4.785 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -9.403 -0.895 -6.031 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -11.695 0.639 -4.763 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -11.077 0.834 -6.391 1.00 0.00 H new ATOM 246 N LEU A 20 -8.230 -1.048 -2.545 1.00 0.00 N ATOM 247 CA LEU A 20 -6.934 -1.233 -1.903 1.00 0.00 C ATOM 248 C LEU A 20 -6.829 -2.621 -1.279 1.00 0.00 C ATOM 249 O LEU A 20 -5.928 -3.394 -1.607 1.00 0.00 O ATOM 250 CB LEU A 20 -6.714 -0.162 -0.833 1.00 0.00 C ATOM 251 CG LEU A 20 -5.294 -0.049 -0.278 1.00 0.00 C ATOM 252 CD1 LEU A 20 -5.041 -1.127 0.764 1.00 0.00 C ATOM 253 CD2 LEU A 20 -4.273 -0.140 -1.403 1.00 0.00 C ATOM 0 H LEU A 20 -8.762 -0.250 -2.198 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.162 -1.138 -2.666 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -6.997 0.804 -1.251 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.392 -0.361 -0.003 1.00 0.00 H new ATOM 0 HG LEU A 20 -5.188 0.923 0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -4.025 -1.031 1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -5.751 -1.015 1.584 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.165 -2.110 0.309 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.268 -0.058 -0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.378 -1.097 -1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -4.441 0.670 -2.113 1.00 0.00 H new ATOM 265 N TYR A 21 -7.756 -2.931 -0.379 1.00 0.00 N ATOM 266 CA TYR A 21 -7.767 -4.225 0.291 1.00 0.00 C ATOM 267 C TYR A 21 -8.271 -5.319 -0.645 1.00 0.00 C ATOM 268 O TYR A 21 -7.884 -6.482 -0.525 1.00 0.00 O ATOM 269 CB TYR A 21 -8.644 -4.167 1.543 1.00 0.00 C ATOM 270 CG TYR A 21 -8.066 -3.311 2.648 1.00 0.00 C ATOM 271 CD1 TYR A 21 -8.000 -1.929 2.520 1.00 0.00 C ATOM 272 CD2 TYR A 21 -7.585 -3.884 3.818 1.00 0.00 C ATOM 273 CE1 TYR A 21 -7.471 -1.143 3.526 1.00 0.00 C ATOM 274 CE2 TYR A 21 -7.056 -3.106 4.830 1.00 0.00 C ATOM 275 CZ TYR A 21 -7.002 -1.736 4.679 1.00 0.00 C ATOM 276 OH TYR A 21 -6.475 -0.957 5.684 1.00 0.00 O ATOM 0 H TYR A 21 -8.509 -2.304 -0.097 1.00 0.00 H new ATOM 0 HA TYR A 21 -6.744 -4.463 0.582 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -9.626 -3.780 1.271 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -8.793 -5.179 1.919 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.368 -1.461 1.619 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -7.625 -4.956 3.939 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.425 -0.070 3.410 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.687 -3.568 5.734 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.191 -1.530 6.427 1.00 0.00 H new ATOM 286 N SER A 22 -9.137 -4.938 -1.579 1.00 0.00 N ATOM 287 CA SER A 22 -9.698 -5.885 -2.535 1.00 0.00 C ATOM 288 C SER A 22 -8.617 -6.819 -3.072 1.00 0.00 C ATOM 289 O SER A 22 -8.889 -7.970 -3.416 1.00 0.00 O ATOM 290 CB SER A 22 -10.365 -5.140 -3.692 1.00 0.00 C ATOM 291 OG SER A 22 -10.456 -5.962 -4.843 1.00 0.00 O ATOM 0 H SER A 22 -9.465 -3.979 -1.694 1.00 0.00 H new ATOM 0 HA SER A 22 -10.448 -6.484 -2.018 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.362 -4.816 -3.393 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.794 -4.241 -3.927 1.00 0.00 H new ATOM 0 HG SER A 22 -10.887 -5.463 -5.568 1.00 0.00 H new ATOM 297 N LEU A 23 -7.390 -6.315 -3.140 1.00 0.00 N ATOM 298 CA LEU A 23 -6.266 -7.102 -3.635 1.00 0.00 C ATOM 299 C LEU A 23 -6.334 -8.535 -3.115 1.00 0.00 C ATOM 300 O LEU A 23 -6.026 -9.482 -3.837 1.00 0.00 O ATOM 301 CB LEU A 23 -4.943 -6.458 -3.217 1.00 0.00 C ATOM 302 CG LEU A 23 -4.432 -5.330 -4.114 1.00 0.00 C ATOM 303 CD1 LEU A 23 -3.088 -4.821 -3.618 1.00 0.00 C ATOM 304 CD2 LEU A 23 -4.327 -5.803 -5.557 1.00 0.00 C ATOM 0 H LEU A 23 -7.148 -5.365 -2.859 1.00 0.00 H new ATOM 0 HA LEU A 23 -6.323 -7.126 -4.723 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.056 -6.068 -2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.181 -7.236 -3.176 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.146 -4.507 -4.073 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.740 -4.019 -4.269 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.195 -4.443 -2.601 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.364 -5.636 -3.628 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.962 -4.988 -6.181 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.635 -6.643 -5.615 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.309 -6.118 -5.909 1.00 0.00 H new ATOM 316 N ASN A 24 -6.742 -8.684 -1.859 1.00 0.00 N ATOM 317 CA ASN A 24 -6.852 -10.002 -1.243 1.00 0.00 C ATOM 318 C ASN A 24 -7.560 -10.980 -2.175 1.00 0.00 C ATOM 319 O ASN A 24 -7.136 -12.126 -2.328 1.00 0.00 O ATOM 320 CB ASN A 24 -7.608 -9.905 0.084 1.00 0.00 C ATOM 321 CG ASN A 24 -6.957 -8.935 1.051 1.00 0.00 C ATOM 322 OD1 ASN A 24 -5.734 -8.896 1.179 1.00 0.00 O ATOM 323 ND2 ASN A 24 -7.776 -8.145 1.736 1.00 0.00 N ATOM 0 H ASN A 24 -7.002 -7.910 -1.248 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.845 -10.373 -1.053 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.634 -9.589 -0.108 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.659 -10.892 0.543 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -7.397 -7.471 2.401 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.784 -8.212 1.597 1.00 0.00 H new ATOM 330 N ASP A 25 -8.641 -10.521 -2.795 1.00 0.00 N ATOM 331 CA ASP A 25 -9.408 -11.354 -3.713 1.00 0.00 C ATOM 332 C ASP A 25 -8.499 -11.985 -4.763 1.00 0.00 C ATOM 333 O ASP A 25 -8.670 -13.148 -5.130 1.00 0.00 O ATOM 334 CB ASP A 25 -10.500 -10.528 -4.395 1.00 0.00 C ATOM 335 CG ASP A 25 -11.743 -10.392 -3.539 1.00 0.00 C ATOM 336 OD1 ASP A 25 -12.468 -11.396 -3.381 1.00 0.00 O ATOM 337 OD2 ASP A 25 -11.992 -9.280 -3.027 1.00 0.00 O ATOM 0 H ASP A 25 -9.006 -9.576 -2.678 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.875 -12.152 -3.136 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -10.111 -9.536 -4.625 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -10.765 -10.995 -5.344 1.00 0.00 H new ATOM 342 N TYR A 26 -7.534 -11.210 -5.244 1.00 0.00 N ATOM 343 CA TYR A 26 -6.599 -11.691 -6.255 1.00 0.00 C ATOM 344 C TYR A 26 -5.246 -12.020 -5.633 1.00 0.00 C ATOM 345 O TYR A 26 -4.806 -11.364 -4.689 1.00 0.00 O ATOM 346 CB TYR A 26 -6.425 -10.645 -7.358 1.00 0.00 C ATOM 347 CG TYR A 26 -7.684 -9.860 -7.652 1.00 0.00 C ATOM 348 CD1 TYR A 26 -8.118 -8.857 -6.794 1.00 0.00 C ATOM 349 CD2 TYR A 26 -8.438 -10.121 -8.790 1.00 0.00 C ATOM 350 CE1 TYR A 26 -9.268 -8.139 -7.059 1.00 0.00 C ATOM 351 CE2 TYR A 26 -9.588 -9.406 -9.064 1.00 0.00 C ATOM 352 CZ TYR A 26 -9.999 -8.417 -8.195 1.00 0.00 C ATOM 353 OH TYR A 26 -11.144 -7.702 -8.463 1.00 0.00 O ATOM 0 H TYR A 26 -7.378 -10.246 -4.950 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.010 -12.602 -6.689 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.634 -9.953 -7.069 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.096 -11.142 -8.270 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -7.547 -8.635 -5.905 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.120 -10.896 -9.472 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.593 -7.364 -6.380 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -10.162 -9.620 -9.954 1.00 0.00 H new ATOM 0 HH TYR A 26 -11.540 -8.020 -9.301 1.00 0.00 H new ATOM 363 N LYS A 27 -4.589 -13.043 -6.171 1.00 0.00 N ATOM 364 CA LYS A 27 -3.284 -13.461 -5.672 1.00 0.00 C ATOM 365 C LYS A 27 -2.175 -13.038 -6.629 1.00 0.00 C ATOM 366 O LYS A 27 -2.283 -13.186 -7.847 1.00 0.00 O ATOM 367 CB LYS A 27 -3.253 -14.979 -5.476 1.00 0.00 C ATOM 368 CG LYS A 27 -4.442 -15.516 -4.699 1.00 0.00 C ATOM 369 CD LYS A 27 -5.622 -15.803 -5.612 1.00 0.00 C ATOM 370 CE LYS A 27 -6.719 -16.563 -4.883 1.00 0.00 C ATOM 371 NZ LYS A 27 -7.477 -15.683 -3.950 1.00 0.00 N ATOM 0 H LYS A 27 -4.939 -13.597 -6.952 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.116 -12.973 -4.712 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.219 -15.462 -6.452 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.336 -15.251 -4.954 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.154 -16.429 -4.177 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -4.737 -14.793 -3.938 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -6.022 -14.865 -5.997 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -5.286 -16.383 -6.472 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.405 -16.998 -5.610 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.279 -17.390 -4.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.278 -16.211 -3.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.850 -15.369 -3.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -7.833 -14.854 -4.467 1.00 0.00 H new ATOM 385 N PRO A 28 -1.081 -12.501 -6.069 1.00 0.00 N ATOM 386 CA PRO A 28 0.070 -12.048 -6.855 1.00 0.00 C ATOM 387 C PRO A 28 0.515 -13.084 -7.882 1.00 0.00 C ATOM 388 O PRO A 28 0.623 -14.276 -7.590 1.00 0.00 O ATOM 389 CB PRO A 28 1.160 -11.838 -5.801 1.00 0.00 C ATOM 390 CG PRO A 28 0.418 -11.558 -4.540 1.00 0.00 C ATOM 391 CD PRO A 28 -0.884 -12.294 -4.624 1.00 0.00 C ATOM 0 HA PRO A 28 -0.160 -11.154 -7.434 1.00 0.00 H new ATOM 0 HB2 PRO A 28 1.790 -12.722 -5.702 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.814 -11.008 -6.068 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.992 -11.888 -3.674 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.249 -10.488 -4.422 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.843 -13.241 -4.087 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.699 -11.716 -4.188 1.00 0.00 H new ATOM 399 N PRO A 29 0.780 -12.623 -9.113 1.00 0.00 N ATOM 400 CA PRO A 29 0.655 -11.207 -9.472 1.00 0.00 C ATOM 401 C PRO A 29 -0.797 -10.743 -9.505 1.00 0.00 C ATOM 402 O PRO A 29 -1.718 -11.560 -9.522 1.00 0.00 O ATOM 403 CB PRO A 29 1.270 -11.140 -10.872 1.00 0.00 C ATOM 404 CG PRO A 29 1.107 -12.514 -11.423 1.00 0.00 C ATOM 405 CD PRO A 29 1.223 -13.448 -10.250 1.00 0.00 C ATOM 0 HA PRO A 29 1.144 -10.558 -8.745 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.762 -10.402 -11.493 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.321 -10.852 -10.830 1.00 0.00 H new ATOM 0 HG2 PRO A 29 0.141 -12.625 -11.916 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.872 -12.728 -12.169 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.595 -14.330 -10.375 1.00 0.00 H new ATOM 0 HD3 PRO A 29 2.246 -13.801 -10.116 1.00 0.00 H new ATOM 413 N ILE A 30 -0.994 -9.429 -9.514 1.00 0.00 N ATOM 414 CA ILE A 30 -2.334 -8.858 -9.547 1.00 0.00 C ATOM 415 C ILE A 30 -2.733 -8.471 -10.967 1.00 0.00 C ATOM 416 O ILE A 30 -1.975 -7.810 -11.677 1.00 0.00 O ATOM 417 CB ILE A 30 -2.440 -7.618 -8.640 1.00 0.00 C ATOM 418 CG1 ILE A 30 -2.145 -7.995 -7.187 1.00 0.00 C ATOM 419 CG2 ILE A 30 -3.821 -6.991 -8.759 1.00 0.00 C ATOM 420 CD1 ILE A 30 -3.147 -8.963 -6.597 1.00 0.00 C ATOM 0 H ILE A 30 -0.242 -8.740 -9.499 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.013 -9.627 -9.179 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.700 -6.886 -8.964 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.150 -8.436 -7.130 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.128 -7.089 -6.582 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.880 -6.116 -8.112 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.997 -6.691 -9.792 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.577 -7.716 -8.458 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.874 -9.185 -5.565 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.141 -8.517 -6.622 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.148 -9.885 -7.178 1.00 0.00 H new ATOM 432 N SER A 31 -3.928 -8.886 -11.374 1.00 0.00 N ATOM 433 CA SER A 31 -4.427 -8.585 -12.711 1.00 0.00 C ATOM 434 C SER A 31 -4.120 -7.140 -13.092 1.00 0.00 C ATOM 435 O SER A 31 -4.563 -6.202 -12.428 1.00 0.00 O ATOM 436 CB SER A 31 -5.934 -8.835 -12.784 1.00 0.00 C ATOM 437 OG SER A 31 -6.221 -10.222 -12.814 1.00 0.00 O ATOM 0 H SER A 31 -4.569 -9.431 -10.797 1.00 0.00 H new ATOM 0 HA SER A 31 -3.923 -9.244 -13.418 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.423 -8.378 -11.924 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.342 -8.357 -13.674 1.00 0.00 H new ATOM 0 HG SER A 31 -7.191 -10.354 -12.859 1.00 0.00 H new ATOM 443 N LYS A 32 -3.359 -6.967 -14.168 1.00 0.00 N ATOM 444 CA LYS A 32 -2.993 -5.637 -14.641 1.00 0.00 C ATOM 445 C LYS A 32 -4.180 -4.684 -14.556 1.00 0.00 C ATOM 446 O LYS A 32 -4.028 -3.520 -14.186 1.00 0.00 O ATOM 447 CB LYS A 32 -2.484 -5.709 -16.082 1.00 0.00 C ATOM 448 CG LYS A 32 -1.047 -6.186 -16.196 1.00 0.00 C ATOM 449 CD LYS A 32 -0.072 -5.162 -15.639 1.00 0.00 C ATOM 450 CE LYS A 32 1.367 -5.635 -15.767 1.00 0.00 C ATOM 451 NZ LYS A 32 1.730 -6.604 -14.696 1.00 0.00 N ATOM 0 H LYS A 32 -2.984 -7.732 -14.729 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.198 -5.256 -14.000 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.127 -6.379 -16.652 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -2.568 -4.722 -16.538 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.932 -7.128 -15.660 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.810 -6.383 -17.242 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -0.194 -4.217 -16.168 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -0.302 -4.972 -14.591 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.511 -6.101 -16.742 1.00 0.00 H new ATOM 0 HE3 LYS A 32 2.037 -4.776 -15.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.719 -6.902 -14.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.617 -6.152 -13.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 1.108 -7.435 -14.754 1.00 0.00 H new ATOM 465 N ALA A 33 -5.362 -5.185 -14.900 1.00 0.00 N ATOM 466 CA ALA A 33 -6.575 -4.378 -14.860 1.00 0.00 C ATOM 467 C ALA A 33 -6.921 -3.978 -13.430 1.00 0.00 C ATOM 468 O ALA A 33 -7.412 -2.876 -13.183 1.00 0.00 O ATOM 469 CB ALA A 33 -7.733 -5.135 -15.493 1.00 0.00 C ATOM 0 H ALA A 33 -5.505 -6.146 -15.210 1.00 0.00 H new ATOM 0 HA ALA A 33 -6.395 -3.467 -15.431 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -8.633 -4.521 -15.456 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -7.493 -5.365 -16.531 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -7.904 -6.062 -14.946 1.00 0.00 H new ATOM 475 N LYS A 34 -6.663 -4.881 -12.489 1.00 0.00 N ATOM 476 CA LYS A 34 -6.947 -4.623 -11.082 1.00 0.00 C ATOM 477 C LYS A 34 -6.162 -3.415 -10.582 1.00 0.00 C ATOM 478 O LYS A 34 -6.743 -2.434 -10.119 1.00 0.00 O ATOM 479 CB LYS A 34 -6.604 -5.852 -10.238 1.00 0.00 C ATOM 480 CG LYS A 34 -6.646 -5.594 -8.742 1.00 0.00 C ATOM 481 CD LYS A 34 -8.037 -5.190 -8.285 1.00 0.00 C ATOM 482 CE LYS A 34 -7.980 -4.232 -7.104 1.00 0.00 C ATOM 483 NZ LYS A 34 -9.133 -3.290 -7.098 1.00 0.00 N ATOM 0 H LYS A 34 -6.258 -5.798 -12.676 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.011 -4.409 -10.985 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.301 -6.654 -10.479 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.608 -6.203 -10.510 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.333 -6.491 -8.208 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -5.936 -4.807 -8.487 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.570 -4.719 -9.111 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.602 -6.079 -8.006 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.971 -4.801 -6.175 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -7.049 -3.666 -7.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -9.383 -3.054 -6.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -8.874 -2.421 -7.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.948 -3.736 -7.565 1.00 0.00 H new ATOM 497 N MET A 35 -4.839 -3.492 -10.680 1.00 0.00 N ATOM 498 CA MET A 35 -3.975 -2.403 -10.239 1.00 0.00 C ATOM 499 C MET A 35 -4.554 -1.051 -10.646 1.00 0.00 C ATOM 500 O MET A 35 -4.371 -0.051 -9.951 1.00 0.00 O ATOM 501 CB MET A 35 -2.572 -2.567 -10.826 1.00 0.00 C ATOM 502 CG MET A 35 -1.650 -3.419 -9.968 1.00 0.00 C ATOM 503 SD MET A 35 -0.998 -2.521 -8.547 1.00 0.00 S ATOM 504 CE MET A 35 -0.627 -3.874 -7.433 1.00 0.00 C ATOM 0 H MET A 35 -4.342 -4.297 -11.061 1.00 0.00 H new ATOM 0 HA MET A 35 -3.913 -2.440 -9.151 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.651 -3.016 -11.816 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.125 -1.582 -10.958 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.193 -4.298 -9.620 1.00 0.00 H new ATOM 0 HG3 MET A 35 -0.821 -3.778 -10.578 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.419 -3.480 -6.438 1.00 0.00 H new ATOM 0 HE2 MET A 35 -1.481 -4.549 -7.384 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.245 -4.417 -7.798 1.00 0.00 H new ATOM 514 N THR A 36 -5.253 -1.028 -11.776 1.00 0.00 N ATOM 515 CA THR A 36 -5.857 0.201 -12.276 1.00 0.00 C ATOM 516 C THR A 36 -7.136 0.533 -11.516 1.00 0.00 C ATOM 517 O THR A 36 -7.377 1.687 -11.165 1.00 0.00 O ATOM 518 CB THR A 36 -6.179 0.098 -13.779 1.00 0.00 C ATOM 519 OG1 THR A 36 -4.965 0.055 -14.538 1.00 0.00 O ATOM 520 CG2 THR A 36 -7.026 1.277 -14.233 1.00 0.00 C ATOM 0 H THR A 36 -5.415 -1.847 -12.363 1.00 0.00 H new ATOM 0 HA THR A 36 -5.128 0.997 -12.122 1.00 0.00 H new ATOM 0 HB THR A 36 -6.744 -0.819 -13.945 1.00 0.00 H new ATOM 0 HG1 THR A 36 -5.178 -0.012 -15.492 1.00 0.00 H new ATOM 0 HG21 THR A 36 -7.241 1.182 -15.297 1.00 0.00 H new ATOM 0 HG22 THR A 36 -7.962 1.290 -13.674 1.00 0.00 H new ATOM 0 HG23 THR A 36 -6.484 2.205 -14.053 1.00 0.00 H new ATOM 528 N GLN A 37 -7.952 -0.486 -11.265 1.00 0.00 N ATOM 529 CA GLN A 37 -9.207 -0.301 -10.546 1.00 0.00 C ATOM 530 C GLN A 37 -8.976 0.434 -9.229 1.00 0.00 C ATOM 531 O GLN A 37 -9.846 1.164 -8.754 1.00 0.00 O ATOM 532 CB GLN A 37 -9.871 -1.652 -10.280 1.00 0.00 C ATOM 533 CG GLN A 37 -10.317 -2.370 -11.543 1.00 0.00 C ATOM 534 CD GLN A 37 -11.705 -1.956 -11.991 1.00 0.00 C ATOM 535 OE1 GLN A 37 -12.679 -2.681 -11.783 1.00 0.00 O ATOM 536 NE2 GLN A 37 -11.803 -0.785 -12.609 1.00 0.00 N ATOM 0 H GLN A 37 -7.766 -1.448 -11.549 1.00 0.00 H new ATOM 0 HA GLN A 37 -9.867 0.304 -11.168 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.173 -2.290 -9.737 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.735 -1.502 -9.633 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -9.605 -2.166 -12.343 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -10.301 -3.446 -11.369 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -10.970 -0.217 -12.760 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -12.712 -0.454 -12.933 1.00 0.00 H new ATOM 545 N ILE A 38 -7.799 0.235 -8.645 1.00 0.00 N ATOM 546 CA ILE A 38 -7.455 0.879 -7.384 1.00 0.00 C ATOM 547 C ILE A 38 -7.054 2.335 -7.601 1.00 0.00 C ATOM 548 O ILE A 38 -7.547 3.235 -6.920 1.00 0.00 O ATOM 549 CB ILE A 38 -6.305 0.143 -6.671 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.554 -1.366 -6.679 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.152 0.653 -5.246 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.583 -2.144 -5.819 1.00 0.00 C ATOM 0 H ILE A 38 -7.068 -0.367 -9.025 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.346 0.839 -6.757 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.378 0.342 -7.208 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.569 -1.560 -6.333 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.491 -1.731 -7.704 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.335 0.123 -4.756 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -5.933 1.721 -5.263 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.078 0.481 -4.697 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -5.820 -3.207 -5.873 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.567 -1.980 -6.178 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.661 -1.807 -4.785 1.00 0.00 H new ATOM 564 N THR A 39 -6.158 2.560 -8.556 1.00 0.00 N ATOM 565 CA THR A 39 -5.691 3.906 -8.865 1.00 0.00 C ATOM 566 C THR A 39 -6.859 4.837 -9.167 1.00 0.00 C ATOM 567 O THR A 39 -6.910 5.965 -8.678 1.00 0.00 O ATOM 568 CB THR A 39 -4.726 3.904 -10.066 1.00 0.00 C ATOM 569 OG1 THR A 39 -3.635 3.011 -9.817 1.00 0.00 O ATOM 570 CG2 THR A 39 -4.193 5.303 -10.333 1.00 0.00 C ATOM 0 H THR A 39 -5.741 1.827 -9.130 1.00 0.00 H new ATOM 0 HA THR A 39 -5.161 4.267 -7.984 1.00 0.00 H new ATOM 0 HB THR A 39 -5.276 3.568 -10.945 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.939 2.085 -9.923 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.514 5.277 -11.185 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.024 5.973 -10.552 1.00 0.00 H new ATOM 0 HG23 THR A 39 -3.658 5.663 -9.454 1.00 0.00 H new ATOM 578 N LYS A 40 -7.798 4.358 -9.977 1.00 0.00 N ATOM 579 CA LYS A 40 -8.968 5.146 -10.343 1.00 0.00 C ATOM 580 C LYS A 40 -9.716 5.620 -9.101 1.00 0.00 C ATOM 581 O LYS A 40 -10.298 6.704 -9.092 1.00 0.00 O ATOM 582 CB LYS A 40 -9.904 4.325 -11.233 1.00 0.00 C ATOM 583 CG LYS A 40 -9.211 3.702 -12.433 1.00 0.00 C ATOM 584 CD LYS A 40 -9.914 2.432 -12.885 1.00 0.00 C ATOM 585 CE LYS A 40 -10.924 2.716 -13.985 1.00 0.00 C ATOM 586 NZ LYS A 40 -11.196 1.509 -14.814 1.00 0.00 N ATOM 0 H LYS A 40 -7.771 3.427 -10.392 1.00 0.00 H new ATOM 0 HA LYS A 40 -8.626 6.021 -10.896 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -10.359 3.535 -10.636 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -10.713 4.966 -11.583 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.189 4.419 -13.254 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.175 3.475 -12.179 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.176 1.714 -13.244 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.419 1.972 -12.035 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.855 3.069 -13.541 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.551 3.518 -14.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.089 1.748 -15.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.523 0.757 -14.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.166 1.178 -14.638 1.00 0.00 H new ATOM 600 N ALA A 41 -9.694 4.801 -8.055 1.00 0.00 N ATOM 601 CA ALA A 41 -10.367 5.139 -6.807 1.00 0.00 C ATOM 602 C ALA A 41 -9.546 6.132 -5.992 1.00 0.00 C ATOM 603 O ALA A 41 -10.090 7.067 -5.404 1.00 0.00 O ATOM 604 CB ALA A 41 -10.635 3.881 -5.994 1.00 0.00 C ATOM 0 H ALA A 41 -9.218 3.899 -8.047 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.319 5.610 -7.053 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.138 4.149 -5.065 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.269 3.205 -6.568 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.690 3.387 -5.766 1.00 0.00 H new ATOM 610 N ALA A 42 -8.234 5.923 -5.960 1.00 0.00 N ATOM 611 CA ALA A 42 -7.338 6.801 -5.218 1.00 0.00 C ATOM 612 C ALA A 42 -7.319 8.202 -5.820 1.00 0.00 C ATOM 613 O ALA A 42 -7.695 9.175 -5.165 1.00 0.00 O ATOM 614 CB ALA A 42 -5.933 6.219 -5.188 1.00 0.00 C ATOM 0 H ALA A 42 -7.768 5.153 -6.440 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.709 6.878 -4.196 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.275 6.886 -4.631 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -5.954 5.242 -4.705 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.562 6.112 -6.207 1.00 0.00 H new ATOM 620 N ILE A 43 -6.879 8.298 -7.070 1.00 0.00 N ATOM 621 CA ILE A 43 -6.811 9.580 -7.760 1.00 0.00 C ATOM 622 C ILE A 43 -8.130 10.337 -7.643 1.00 0.00 C ATOM 623 O ILE A 43 -8.155 11.568 -7.656 1.00 0.00 O ATOM 624 CB ILE A 43 -6.467 9.400 -9.250 1.00 0.00 C ATOM 625 CG1 ILE A 43 -5.107 8.714 -9.403 1.00 0.00 C ATOM 626 CG2 ILE A 43 -6.470 10.745 -9.961 1.00 0.00 C ATOM 627 CD1 ILE A 43 -3.935 9.632 -9.138 1.00 0.00 C ATOM 0 H ILE A 43 -6.564 7.503 -7.626 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.020 10.155 -7.280 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.226 8.767 -9.709 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.057 7.867 -8.718 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -5.023 8.313 -10.413 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -6.225 10.601 -11.013 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.458 11.199 -9.877 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.730 11.401 -9.503 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.004 9.079 -9.265 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.960 10.466 -9.839 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.995 10.013 -8.119 1.00 0.00 H new ATOM 639 N LYS A 44 -9.224 9.594 -7.525 1.00 0.00 N ATOM 640 CA LYS A 44 -10.548 10.193 -7.402 1.00 0.00 C ATOM 641 C LYS A 44 -10.769 10.739 -5.995 1.00 0.00 C ATOM 642 O LYS A 44 -11.416 11.770 -5.813 1.00 0.00 O ATOM 643 CB LYS A 44 -11.630 9.164 -7.737 1.00 0.00 C ATOM 644 CG LYS A 44 -11.996 9.125 -9.210 1.00 0.00 C ATOM 645 CD LYS A 44 -13.088 10.128 -9.541 1.00 0.00 C ATOM 646 CE LYS A 44 -14.470 9.568 -9.239 1.00 0.00 C ATOM 647 NZ LYS A 44 -15.528 10.239 -10.044 1.00 0.00 N ATOM 0 H LYS A 44 -9.221 8.574 -7.512 1.00 0.00 H new ATOM 0 HA LYS A 44 -10.612 11.021 -8.109 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.287 8.176 -7.430 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.524 9.387 -7.155 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.112 9.337 -9.811 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.329 8.122 -9.476 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -12.931 11.041 -8.967 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.027 10.400 -10.595 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.481 8.498 -9.445 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.688 9.691 -8.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.455 9.830 -9.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.535 11.257 -9.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.334 10.100 -11.056 1.00 0.00 H new ATOM 661 N ALA A 45 -10.225 10.042 -5.002 1.00 0.00 N ATOM 662 CA ALA A 45 -10.360 10.459 -3.612 1.00 0.00 C ATOM 663 C ALA A 45 -9.221 11.387 -3.204 1.00 0.00 C ATOM 664 O ALA A 45 -8.973 11.595 -2.016 1.00 0.00 O ATOM 665 CB ALA A 45 -10.406 9.243 -2.699 1.00 0.00 C ATOM 0 H ALA A 45 -9.687 9.186 -5.135 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.295 11.010 -3.513 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.507 9.569 -1.664 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.258 8.618 -2.968 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.486 8.669 -2.811 1.00 0.00 H new ATOM 671 N ILE A 46 -8.531 11.940 -4.196 1.00 0.00 N ATOM 672 CA ILE A 46 -7.418 12.845 -3.939 1.00 0.00 C ATOM 673 C ILE A 46 -7.784 13.880 -2.880 1.00 0.00 C ATOM 674 O ILE A 46 -7.015 14.136 -1.954 1.00 0.00 O ATOM 675 CB ILE A 46 -6.978 13.575 -5.222 1.00 0.00 C ATOM 676 CG1 ILE A 46 -5.515 14.010 -5.112 1.00 0.00 C ATOM 677 CG2 ILE A 46 -7.875 14.775 -5.484 1.00 0.00 C ATOM 678 CD1 ILE A 46 -4.808 14.096 -6.446 1.00 0.00 C ATOM 0 H ILE A 46 -8.723 11.777 -5.184 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.592 12.233 -3.576 1.00 0.00 H new ATOM 0 HB ILE A 46 -7.071 12.887 -6.063 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.470 14.983 -4.623 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.982 13.306 -4.472 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -7.551 15.280 -6.394 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -8.905 14.440 -5.602 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -7.813 15.466 -4.644 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.776 14.410 -6.291 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.822 13.119 -6.929 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -5.316 14.821 -7.081 1.00 0.00 H new ATOM 690 N LYS A 47 -8.965 14.471 -3.023 1.00 0.00 N ATOM 691 CA LYS A 47 -9.437 15.476 -2.077 1.00 0.00 C ATOM 692 C LYS A 47 -9.288 14.985 -0.641 1.00 0.00 C ATOM 693 O LYS A 47 -8.958 15.757 0.259 1.00 0.00 O ATOM 694 CB LYS A 47 -10.900 15.824 -2.359 1.00 0.00 C ATOM 695 CG LYS A 47 -11.814 14.612 -2.419 1.00 0.00 C ATOM 696 CD LYS A 47 -13.003 14.854 -3.332 1.00 0.00 C ATOM 697 CE LYS A 47 -13.758 13.565 -3.618 1.00 0.00 C ATOM 698 NZ LYS A 47 -14.610 13.679 -4.834 1.00 0.00 N ATOM 0 H LYS A 47 -9.613 14.272 -3.785 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.826 16.370 -2.201 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -11.259 16.501 -1.584 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -10.961 16.361 -3.305 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -11.252 13.748 -2.774 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.167 14.372 -1.416 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -13.676 15.576 -2.871 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -12.660 15.292 -4.270 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -13.047 12.749 -3.748 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.381 13.311 -2.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -15.108 12.780 -4.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -15.305 14.441 -4.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.013 13.896 -5.657 1.00 0.00 H new ATOM 712 N PHE A 48 -9.533 13.695 -0.434 1.00 0.00 N ATOM 713 CA PHE A 48 -9.426 13.100 0.894 1.00 0.00 C ATOM 714 C PHE A 48 -8.294 12.078 0.942 1.00 0.00 C ATOM 715 O PHE A 48 -8.227 11.252 1.852 1.00 0.00 O ATOM 716 CB PHE A 48 -10.746 12.434 1.286 1.00 0.00 C ATOM 717 CG PHE A 48 -11.959 13.216 0.869 1.00 0.00 C ATOM 718 CD1 PHE A 48 -11.957 14.601 0.917 1.00 0.00 C ATOM 719 CD2 PHE A 48 -13.101 12.567 0.429 1.00 0.00 C ATOM 720 CE1 PHE A 48 -13.072 15.323 0.536 1.00 0.00 C ATOM 721 CE2 PHE A 48 -14.219 13.284 0.046 1.00 0.00 C ATOM 722 CZ PHE A 48 -14.204 14.664 0.098 1.00 0.00 C ATOM 0 H PHE A 48 -9.807 13.042 -1.168 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.204 13.896 1.605 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -10.791 11.442 0.836 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.767 12.295 2.367 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -11.074 15.122 1.256 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -13.118 11.488 0.385 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -13.058 16.402 0.581 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -15.103 12.766 -0.294 1.00 0.00 H new ATOM 0 HZ PHE A 48 -15.075 15.227 -0.203 1.00 0.00 H new ATOM 732 N TYR A 49 -7.406 12.141 -0.044 1.00 0.00 N ATOM 733 CA TYR A 49 -6.278 11.220 -0.117 1.00 0.00 C ATOM 734 C TYR A 49 -5.684 10.976 1.266 1.00 0.00 C ATOM 735 O TYR A 49 -5.090 9.929 1.525 1.00 0.00 O ATOM 736 CB TYR A 49 -5.203 11.771 -1.056 1.00 0.00 C ATOM 737 CG TYR A 49 -4.169 12.625 -0.359 1.00 0.00 C ATOM 738 CD1 TYR A 49 -4.486 13.898 0.100 1.00 0.00 C ATOM 739 CD2 TYR A 49 -2.875 12.160 -0.159 1.00 0.00 C ATOM 740 CE1 TYR A 49 -3.545 14.682 0.738 1.00 0.00 C ATOM 741 CE2 TYR A 49 -1.928 12.937 0.479 1.00 0.00 C ATOM 742 CZ TYR A 49 -2.267 14.198 0.925 1.00 0.00 C ATOM 743 OH TYR A 49 -1.326 14.975 1.560 1.00 0.00 O ATOM 0 H TYR A 49 -7.446 12.820 -0.804 1.00 0.00 H new ATOM 0 HA TYR A 49 -6.642 10.270 -0.509 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.701 10.938 -1.549 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.683 12.361 -1.837 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -5.485 14.281 -0.045 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -2.605 11.174 -0.508 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -3.808 15.669 1.089 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -0.927 12.559 0.628 1.00 0.00 H new ATOM 0 HH TYR A 49 -0.690 14.398 2.032 1.00 0.00 H new ATOM 753 N LYS A 50 -5.848 11.951 2.154 1.00 0.00 N ATOM 754 CA LYS A 50 -5.331 11.844 3.513 1.00 0.00 C ATOM 755 C LYS A 50 -5.605 10.460 4.093 1.00 0.00 C ATOM 756 O LYS A 50 -4.790 9.915 4.836 1.00 0.00 O ATOM 757 CB LYS A 50 -5.960 12.916 4.406 1.00 0.00 C ATOM 758 CG LYS A 50 -5.856 14.320 3.836 1.00 0.00 C ATOM 759 CD LYS A 50 -4.411 14.710 3.573 1.00 0.00 C ATOM 760 CE LYS A 50 -3.647 14.925 4.870 1.00 0.00 C ATOM 761 NZ LYS A 50 -3.067 13.656 5.390 1.00 0.00 N ATOM 0 H LYS A 50 -6.335 12.825 1.956 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.252 11.996 3.477 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -7.011 12.674 4.564 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.477 12.893 5.383 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -6.425 14.380 2.908 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.305 15.030 4.531 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -3.924 13.931 2.987 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -4.382 15.622 2.977 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.848 15.648 4.705 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -4.315 15.352 5.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -2.195 13.863 5.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.752 13.194 6.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -2.848 13.023 4.595 1.00 0.00 H new ATOM 775 N HIS A 51 -6.758 9.896 3.746 1.00 0.00 N ATOM 776 CA HIS A 51 -7.138 8.574 4.230 1.00 0.00 C ATOM 777 C HIS A 51 -6.508 7.480 3.374 1.00 0.00 C ATOM 778 O HIS A 51 -5.939 6.520 3.895 1.00 0.00 O ATOM 779 CB HIS A 51 -8.660 8.426 4.229 1.00 0.00 C ATOM 780 CG HIS A 51 -9.302 8.824 5.523 1.00 0.00 C ATOM 781 ND1 HIS A 51 -10.067 7.963 6.280 1.00 0.00 N ATOM 782 CD2 HIS A 51 -9.287 10.000 6.193 1.00 0.00 C ATOM 783 CE1 HIS A 51 -10.497 8.592 7.359 1.00 0.00 C ATOM 784 NE2 HIS A 51 -10.037 9.830 7.330 1.00 0.00 N ATOM 0 H HIS A 51 -7.445 10.334 3.132 1.00 0.00 H new ATOM 0 HA HIS A 51 -6.771 8.468 5.251 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.075 9.034 3.425 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -8.916 7.389 4.010 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -8.779 10.904 5.890 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -11.119 8.167 8.133 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -10.211 10.544 8.038 1.00 0.00 H new ATOM 792 N VAL A 52 -6.614 7.630 2.058 1.00 0.00 N ATOM 793 CA VAL A 52 -6.054 6.655 1.130 1.00 0.00 C ATOM 794 C VAL A 52 -4.626 6.287 1.515 1.00 0.00 C ATOM 795 O VAL A 52 -4.362 5.175 1.974 1.00 0.00 O ATOM 796 CB VAL A 52 -6.064 7.187 -0.316 1.00 0.00 C ATOM 797 CG1 VAL A 52 -5.089 6.402 -1.180 1.00 0.00 C ATOM 798 CG2 VAL A 52 -7.469 7.128 -0.896 1.00 0.00 C ATOM 0 H VAL A 52 -7.083 8.418 1.610 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.682 5.766 1.187 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.744 8.229 -0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.110 6.792 -2.198 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.082 6.501 -0.774 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.375 5.350 -1.188 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.457 7.508 -1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.819 6.096 -0.896 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.139 7.738 -0.290 1.00 0.00 H new ATOM 808 N VAL A 53 -3.707 7.228 1.325 1.00 0.00 N ATOM 809 CA VAL A 53 -2.304 7.003 1.654 1.00 0.00 C ATOM 810 C VAL A 53 -2.163 6.117 2.886 1.00 0.00 C ATOM 811 O VAL A 53 -1.503 5.079 2.844 1.00 0.00 O ATOM 812 CB VAL A 53 -1.567 8.332 1.905 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.162 8.073 2.427 1.00 0.00 C ATOM 814 CG2 VAL A 53 -1.527 9.167 0.633 1.00 0.00 C ATOM 0 H VAL A 53 -3.908 8.153 0.945 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.855 6.502 0.797 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.113 8.893 2.664 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.343 9.023 2.598 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.218 7.518 3.363 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.397 7.492 1.694 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -1.003 10.103 0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -1.005 8.615 -0.148 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.545 9.383 0.307 1.00 0.00 H new ATOM 824 N GLN A 54 -2.790 6.532 3.982 1.00 0.00 N ATOM 825 CA GLN A 54 -2.734 5.775 5.227 1.00 0.00 C ATOM 826 C GLN A 54 -3.107 4.315 4.993 1.00 0.00 C ATOM 827 O GLN A 54 -2.325 3.410 5.285 1.00 0.00 O ATOM 828 CB GLN A 54 -3.672 6.392 6.266 1.00 0.00 C ATOM 829 CG GLN A 54 -3.484 5.829 7.666 1.00 0.00 C ATOM 830 CD GLN A 54 -4.363 6.514 8.693 1.00 0.00 C ATOM 831 OE1 GLN A 54 -4.969 7.549 8.417 1.00 0.00 O ATOM 832 NE2 GLN A 54 -4.436 5.939 9.888 1.00 0.00 N ATOM 0 H GLN A 54 -3.342 7.388 4.033 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.711 5.815 5.601 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.513 7.470 6.292 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.704 6.230 5.954 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.706 4.762 7.657 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.439 5.935 7.959 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -3.917 5.081 10.074 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -5.011 6.355 10.620 1.00 0.00 H new ATOM 841 N SER A 55 -4.306 4.092 4.465 1.00 0.00 N ATOM 842 CA SER A 55 -4.784 2.741 4.196 1.00 0.00 C ATOM 843 C SER A 55 -3.763 1.957 3.378 1.00 0.00 C ATOM 844 O SER A 55 -3.539 0.770 3.616 1.00 0.00 O ATOM 845 CB SER A 55 -6.121 2.789 3.453 1.00 0.00 C ATOM 846 OG SER A 55 -7.204 2.912 4.359 1.00 0.00 O ATOM 0 H SER A 55 -4.964 4.830 4.215 1.00 0.00 H new ATOM 0 HA SER A 55 -4.925 2.235 5.151 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.125 3.630 2.760 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.242 1.884 2.857 1.00 0.00 H new ATOM 0 HG SER A 55 -8.047 2.942 3.859 1.00 0.00 H new ATOM 852 N VAL A 56 -3.146 2.629 2.411 1.00 0.00 N ATOM 853 CA VAL A 56 -2.147 1.997 1.557 1.00 0.00 C ATOM 854 C VAL A 56 -0.947 1.525 2.372 1.00 0.00 C ATOM 855 O VAL A 56 -0.280 0.558 2.008 1.00 0.00 O ATOM 856 CB VAL A 56 -1.661 2.957 0.456 1.00 0.00 C ATOM 857 CG1 VAL A 56 -0.473 2.363 -0.285 1.00 0.00 C ATOM 858 CG2 VAL A 56 -2.794 3.280 -0.507 1.00 0.00 C ATOM 0 H VAL A 56 -3.321 3.611 2.199 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.627 1.137 1.091 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.337 3.886 0.925 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.144 3.056 -1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.343 2.188 0.416 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.766 1.419 -0.744 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -2.433 3.960 -1.279 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -3.150 2.360 -0.971 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.612 3.752 0.038 1.00 0.00 H new ATOM 868 N GLU A 57 -0.680 2.216 3.475 1.00 0.00 N ATOM 869 CA GLU A 57 0.441 1.868 4.341 1.00 0.00 C ATOM 870 C GLU A 57 0.040 0.786 5.340 1.00 0.00 C ATOM 871 O GLU A 57 0.855 -0.052 5.725 1.00 0.00 O ATOM 872 CB GLU A 57 0.942 3.106 5.087 1.00 0.00 C ATOM 873 CG GLU A 57 1.400 4.226 4.168 1.00 0.00 C ATOM 874 CD GLU A 57 1.857 5.455 4.929 1.00 0.00 C ATOM 875 OE1 GLU A 57 1.603 5.525 6.150 1.00 0.00 O ATOM 876 OE2 GLU A 57 2.469 6.347 4.305 1.00 0.00 O ATOM 0 H GLU A 57 -1.224 3.019 3.790 1.00 0.00 H new ATOM 0 HA GLU A 57 1.245 1.481 3.715 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.146 3.479 5.731 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.769 2.819 5.736 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.217 3.866 3.542 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.583 4.500 3.500 1.00 0.00 H new ATOM 883 N LYS A 58 -1.221 0.812 5.757 1.00 0.00 N ATOM 884 CA LYS A 58 -1.733 -0.166 6.711 1.00 0.00 C ATOM 885 C LYS A 58 -1.963 -1.514 6.037 1.00 0.00 C ATOM 886 O LYS A 58 -1.382 -2.525 6.433 1.00 0.00 O ATOM 887 CB LYS A 58 -3.037 0.335 7.334 1.00 0.00 C ATOM 888 CG LYS A 58 -2.928 1.722 7.942 1.00 0.00 C ATOM 889 CD LYS A 58 -2.100 1.710 9.216 1.00 0.00 C ATOM 890 CE LYS A 58 -1.722 3.119 9.648 1.00 0.00 C ATOM 891 NZ LYS A 58 -1.566 3.222 11.125 1.00 0.00 N ATOM 0 H LYS A 58 -1.908 1.500 5.449 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.989 -0.296 7.497 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.815 0.342 6.571 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.354 -0.367 8.106 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.476 2.402 7.220 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.925 2.104 8.159 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.663 1.223 10.012 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.196 1.122 9.058 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -0.790 3.410 9.163 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.488 3.819 9.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -1.308 4.197 11.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -2.463 2.969 11.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -0.818 2.572 11.441 1.00 0.00 H new ATOM 905 N PHE A 59 -2.813 -1.523 5.015 1.00 0.00 N ATOM 906 CA PHE A 59 -3.120 -2.747 4.286 1.00 0.00 C ATOM 907 C PHE A 59 -1.852 -3.552 4.016 1.00 0.00 C ATOM 908 O PHE A 59 -1.885 -4.781 3.954 1.00 0.00 O ATOM 909 CB PHE A 59 -3.819 -2.418 2.965 1.00 0.00 C ATOM 910 CG PHE A 59 -3.748 -3.529 1.956 1.00 0.00 C ATOM 911 CD1 PHE A 59 -4.640 -4.588 2.008 1.00 0.00 C ATOM 912 CD2 PHE A 59 -2.790 -3.513 0.956 1.00 0.00 C ATOM 913 CE1 PHE A 59 -4.577 -5.611 1.081 1.00 0.00 C ATOM 914 CE2 PHE A 59 -2.722 -4.534 0.026 1.00 0.00 C ATOM 915 CZ PHE A 59 -3.617 -5.583 0.088 1.00 0.00 C ATOM 0 H PHE A 59 -3.301 -0.695 4.673 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.788 -3.349 4.902 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.865 -2.186 3.165 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.369 -1.521 2.539 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.393 -4.614 2.782 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -2.088 -2.694 0.902 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.277 -6.431 1.133 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.969 -4.511 -0.748 1.00 0.00 H new ATOM 0 HZ PHE A 59 -3.567 -6.381 -0.639 1.00 0.00 H new ATOM 925 N ILE A 60 -0.736 -2.849 3.855 1.00 0.00 N ATOM 926 CA ILE A 60 0.544 -3.497 3.593 1.00 0.00 C ATOM 927 C ILE A 60 1.013 -4.298 4.803 1.00 0.00 C ATOM 928 O ILE A 60 1.576 -5.382 4.660 1.00 0.00 O ATOM 929 CB ILE A 60 1.628 -2.470 3.219 1.00 0.00 C ATOM 930 CG1 ILE A 60 1.412 -1.963 1.791 1.00 0.00 C ATOM 931 CG2 ILE A 60 3.012 -3.085 3.364 1.00 0.00 C ATOM 932 CD1 ILE A 60 2.350 -0.844 1.398 1.00 0.00 C ATOM 0 H ILE A 60 -0.692 -1.831 3.901 1.00 0.00 H new ATOM 0 HA ILE A 60 0.390 -4.173 2.752 1.00 0.00 H new ATOM 0 HB ILE A 60 1.554 -1.622 3.900 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.539 -2.793 1.096 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.384 -1.617 1.689 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.768 -2.347 3.096 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.163 -3.401 4.396 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.098 -3.948 2.704 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.139 -0.535 0.374 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.207 0.003 2.069 1.00 0.00 H new ATOM 0 HD13 ILE A 60 3.381 -1.192 1.467 1.00 0.00 H new ATOM 944 N GLN A 61 0.775 -3.756 5.993 1.00 0.00 N ATOM 945 CA GLN A 61 1.172 -4.421 7.228 1.00 0.00 C ATOM 946 C GLN A 61 0.178 -5.515 7.601 1.00 0.00 C ATOM 947 O GLN A 61 0.544 -6.520 8.211 1.00 0.00 O ATOM 948 CB GLN A 61 1.282 -3.405 8.366 1.00 0.00 C ATOM 949 CG GLN A 61 -0.059 -2.850 8.818 1.00 0.00 C ATOM 950 CD GLN A 61 -0.071 -2.477 10.287 1.00 0.00 C ATOM 951 OE1 GLN A 61 -0.426 -1.356 10.652 1.00 0.00 O ATOM 952 NE2 GLN A 61 0.317 -3.418 11.140 1.00 0.00 N ATOM 0 H GLN A 61 0.309 -2.859 6.128 1.00 0.00 H new ATOM 0 HA GLN A 61 2.147 -4.882 7.066 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.776 -3.876 9.216 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.918 -2.580 8.045 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.304 -1.971 8.222 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.837 -3.590 8.629 1.00 0.00 H new ATOM 0 HE21 GLN A 61 0.603 -4.334 10.794 1.00 0.00 H new ATOM 0 HE22 GLN A 61 0.329 -3.225 12.142 1.00 0.00 H new ATOM 961 N LYS A 62 -1.082 -5.314 7.231 1.00 0.00 N ATOM 962 CA LYS A 62 -2.131 -6.284 7.525 1.00 0.00 C ATOM 963 C LYS A 62 -2.083 -7.451 6.545 1.00 0.00 C ATOM 964 O LYS A 62 -2.271 -8.606 6.930 1.00 0.00 O ATOM 965 CB LYS A 62 -3.505 -5.612 7.470 1.00 0.00 C ATOM 966 CG LYS A 62 -3.545 -4.253 8.146 1.00 0.00 C ATOM 967 CD LYS A 62 -3.319 -4.368 9.644 1.00 0.00 C ATOM 968 CE LYS A 62 -4.084 -3.298 10.407 1.00 0.00 C ATOM 969 NZ LYS A 62 -5.551 -3.554 10.400 1.00 0.00 N ATOM 0 H LYS A 62 -1.402 -4.487 6.726 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.963 -6.671 8.530 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -3.803 -5.499 6.428 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -4.239 -6.265 7.942 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.783 -3.607 7.711 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.509 -3.780 7.958 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -3.633 -5.354 9.986 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.254 -4.280 9.860 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.727 -3.260 11.436 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -3.883 -2.322 9.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.998 -3.031 11.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -5.954 -3.238 9.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -5.726 -4.572 10.520 1.00 0.00 H new ATOM 983 N CYS A 63 -1.831 -7.143 5.278 1.00 0.00 N ATOM 984 CA CYS A 63 -1.758 -8.168 4.242 1.00 0.00 C ATOM 985 C CYS A 63 -0.793 -9.279 4.642 1.00 0.00 C ATOM 986 O CYS A 63 -0.272 -9.291 5.758 1.00 0.00 O ATOM 987 CB CYS A 63 -1.319 -7.549 2.913 1.00 0.00 C ATOM 988 SG CYS A 63 0.449 -7.188 2.816 1.00 0.00 S ATOM 0 H CYS A 63 -1.674 -6.193 4.943 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.752 -8.600 4.123 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.585 -8.228 2.103 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.877 -6.626 2.752 1.00 0.00 H new ATOM 0 HG CYS A 63 0.833 -6.603 3.912 1.00 0.00 H new ATOM 994 N LYS A 64 -0.560 -10.212 3.726 1.00 0.00 N ATOM 995 CA LYS A 64 0.341 -11.329 3.982 1.00 0.00 C ATOM 996 C LYS A 64 1.705 -11.085 3.343 1.00 0.00 C ATOM 997 O LYS A 64 1.844 -10.308 2.399 1.00 0.00 O ATOM 998 CB LYS A 64 -0.260 -12.630 3.446 1.00 0.00 C ATOM 999 CG LYS A 64 -1.670 -12.899 3.943 1.00 0.00 C ATOM 1000 CD LYS A 64 -2.713 -12.337 2.992 1.00 0.00 C ATOM 1001 CE LYS A 64 -4.116 -12.465 3.565 1.00 0.00 C ATOM 1002 NZ LYS A 64 -4.751 -13.760 3.194 1.00 0.00 N ATOM 0 H LYS A 64 -0.983 -10.217 2.798 1.00 0.00 H new ATOM 0 HA LYS A 64 0.475 -11.416 5.060 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.268 -12.595 2.357 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.382 -13.462 3.733 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.819 -13.973 4.054 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.800 -12.455 4.930 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.495 -11.288 2.790 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.659 -12.863 2.039 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -4.074 -12.379 4.651 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.732 -11.642 3.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -5.706 -13.808 3.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -4.815 -13.831 2.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.177 -14.546 3.561 1.00 0.00 H new ATOM 1016 N PRO A 65 2.735 -11.764 3.868 1.00 0.00 N ATOM 1017 CA PRO A 65 4.106 -11.639 3.363 1.00 0.00 C ATOM 1018 C PRO A 65 4.176 -11.755 1.844 1.00 0.00 C ATOM 1019 O PRO A 65 5.150 -11.328 1.225 1.00 0.00 O ATOM 1020 CB PRO A 65 4.836 -12.812 4.023 1.00 0.00 C ATOM 1021 CG PRO A 65 4.066 -13.084 5.269 1.00 0.00 C ATOM 1022 CD PRO A 65 2.642 -12.707 4.995 1.00 0.00 C ATOM 0 HA PRO A 65 4.539 -10.666 3.595 1.00 0.00 H new ATOM 0 HB2 PRO A 65 4.854 -13.685 3.370 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.873 -12.559 4.245 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.140 -14.136 5.546 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.464 -12.506 6.103 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.041 -13.579 4.738 1.00 0.00 H new ATOM 0 HD3 PRO A 65 2.177 -12.244 5.865 1.00 0.00 H new ATOM 1030 N GLU A 66 3.138 -12.335 1.250 1.00 0.00 N ATOM 1031 CA GLU A 66 3.084 -12.507 -0.197 1.00 0.00 C ATOM 1032 C GLU A 66 2.541 -11.251 -0.873 1.00 0.00 C ATOM 1033 O GLU A 66 2.893 -10.945 -2.013 1.00 0.00 O ATOM 1034 CB GLU A 66 2.212 -13.711 -0.558 1.00 0.00 C ATOM 1035 CG GLU A 66 0.725 -13.464 -0.373 1.00 0.00 C ATOM 1036 CD GLU A 66 -0.074 -14.749 -0.282 1.00 0.00 C ATOM 1037 OE1 GLU A 66 0.110 -15.495 0.703 1.00 0.00 O ATOM 1038 OE2 GLU A 66 -0.884 -15.010 -1.196 1.00 0.00 O ATOM 0 H GLU A 66 2.323 -12.694 1.748 1.00 0.00 H new ATOM 0 HA GLU A 66 4.099 -12.683 -0.555 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.399 -13.986 -1.596 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.509 -14.561 0.056 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.568 -12.878 0.533 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.353 -12.868 -1.206 1.00 0.00 H new ATOM 1045 N TYR A 67 1.681 -10.529 -0.164 1.00 0.00 N ATOM 1046 CA TYR A 67 1.086 -9.309 -0.696 1.00 0.00 C ATOM 1047 C TYR A 67 1.964 -8.098 -0.394 1.00 0.00 C ATOM 1048 O TYR A 67 1.477 -6.972 -0.295 1.00 0.00 O ATOM 1049 CB TYR A 67 -0.311 -9.099 -0.109 1.00 0.00 C ATOM 1050 CG TYR A 67 -1.360 -10.013 -0.702 1.00 0.00 C ATOM 1051 CD1 TYR A 67 -1.958 -9.717 -1.921 1.00 0.00 C ATOM 1052 CD2 TYR A 67 -1.752 -11.171 -0.044 1.00 0.00 C ATOM 1053 CE1 TYR A 67 -2.917 -10.549 -2.466 1.00 0.00 C ATOM 1054 CE2 TYR A 67 -2.710 -12.009 -0.582 1.00 0.00 C ATOM 1055 CZ TYR A 67 -3.290 -11.693 -1.793 1.00 0.00 C ATOM 1056 OH TYR A 67 -4.244 -12.525 -2.333 1.00 0.00 O ATOM 0 H TYR A 67 1.380 -10.767 0.781 1.00 0.00 H new ATOM 0 HA TYR A 67 1.006 -9.416 -1.778 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.271 -9.257 0.969 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.611 -8.063 -0.268 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.668 -8.822 -2.451 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.300 -11.421 0.905 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.372 -10.304 -3.414 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.003 -12.906 -0.057 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.462 -12.227 -3.241 1.00 0.00 H new ATOM 1066 N LYS A 68 3.262 -8.339 -0.248 1.00 0.00 N ATOM 1067 CA LYS A 68 4.211 -7.270 0.041 1.00 0.00 C ATOM 1068 C LYS A 68 4.647 -6.568 -1.241 1.00 0.00 C ATOM 1069 O LYS A 68 5.089 -5.419 -1.211 1.00 0.00 O ATOM 1070 CB LYS A 68 5.435 -7.831 0.770 1.00 0.00 C ATOM 1071 CG LYS A 68 5.119 -8.395 2.144 1.00 0.00 C ATOM 1072 CD LYS A 68 4.211 -7.467 2.933 1.00 0.00 C ATOM 1073 CE LYS A 68 4.209 -7.815 4.414 1.00 0.00 C ATOM 1074 NZ LYS A 68 3.720 -6.684 5.249 1.00 0.00 N ATOM 0 H LYS A 68 3.681 -9.266 -0.325 1.00 0.00 H new ATOM 0 HA LYS A 68 3.716 -6.541 0.682 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.884 -8.615 0.159 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.180 -7.042 0.873 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.641 -9.369 2.037 1.00 0.00 H new ATOM 0 HG3 LYS A 68 6.046 -8.554 2.695 1.00 0.00 H new ATOM 0 HD2 LYS A 68 4.539 -6.436 2.801 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.196 -7.531 2.542 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.579 -8.689 4.581 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.218 -8.086 4.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 3.589 -7.007 6.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.416 -5.912 5.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 2.813 -6.342 4.873 1.00 0.00 H new ATOM 1088 N VAL A 69 4.519 -7.265 -2.365 1.00 0.00 N ATOM 1089 CA VAL A 69 4.897 -6.707 -3.658 1.00 0.00 C ATOM 1090 C VAL A 69 3.789 -5.822 -4.220 1.00 0.00 C ATOM 1091 O VAL A 69 4.022 -4.692 -4.651 1.00 0.00 O ATOM 1092 CB VAL A 69 5.219 -7.817 -4.676 1.00 0.00 C ATOM 1093 CG1 VAL A 69 4.827 -7.383 -6.081 1.00 0.00 C ATOM 1094 CG2 VAL A 69 6.693 -8.185 -4.614 1.00 0.00 C ATOM 0 H VAL A 69 4.156 -8.217 -2.407 1.00 0.00 H new ATOM 0 HA VAL A 69 5.791 -6.105 -3.494 1.00 0.00 H new ATOM 0 HB VAL A 69 4.637 -8.702 -4.419 1.00 0.00 H new ATOM 0 HG11 VAL A 69 5.062 -8.180 -6.787 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.758 -7.174 -6.112 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.380 -6.484 -6.352 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.903 -8.971 -5.340 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.297 -7.307 -4.844 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.937 -8.541 -3.613 1.00 0.00 H new ATOM 1104 N PRO A 70 2.555 -6.346 -4.215 1.00 0.00 N ATOM 1105 CA PRO A 70 1.385 -5.620 -4.720 1.00 0.00 C ATOM 1106 C PRO A 70 1.307 -4.197 -4.178 1.00 0.00 C ATOM 1107 O PRO A 70 1.307 -3.231 -4.939 1.00 0.00 O ATOM 1108 CB PRO A 70 0.205 -6.452 -4.213 1.00 0.00 C ATOM 1109 CG PRO A 70 0.752 -7.829 -4.054 1.00 0.00 C ATOM 1110 CD PRO A 70 2.205 -7.686 -3.717 1.00 0.00 C ATOM 0 HA PRO A 70 1.411 -5.509 -5.804 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.175 -6.065 -3.267 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -0.624 -6.435 -4.920 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.224 -8.365 -3.265 1.00 0.00 H new ATOM 0 HG3 PRO A 70 0.623 -8.404 -4.971 1.00 0.00 H new ATOM 0 HD2 PRO A 70 2.376 -7.770 -2.644 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.804 -8.460 -4.197 1.00 0.00 H new ATOM 1118 N GLY A 71 1.240 -4.076 -2.855 1.00 0.00 N ATOM 1119 CA GLY A 71 1.163 -2.767 -2.233 1.00 0.00 C ATOM 1120 C GLY A 71 2.041 -1.744 -2.925 1.00 0.00 C ATOM 1121 O GLY A 71 1.554 -0.717 -3.400 1.00 0.00 O ATOM 0 H GLY A 71 1.238 -4.861 -2.204 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.129 -2.422 -2.246 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.459 -2.847 -1.187 1.00 0.00 H new ATOM 1125 N LEU A 72 3.338 -2.022 -2.982 1.00 0.00 N ATOM 1126 CA LEU A 72 4.288 -1.116 -3.619 1.00 0.00 C ATOM 1127 C LEU A 72 3.746 -0.609 -4.952 1.00 0.00 C ATOM 1128 O LEU A 72 3.764 0.591 -5.225 1.00 0.00 O ATOM 1129 CB LEU A 72 5.628 -1.820 -3.836 1.00 0.00 C ATOM 1130 CG LEU A 72 6.848 -0.910 -3.985 1.00 0.00 C ATOM 1131 CD1 LEU A 72 6.661 0.047 -5.152 1.00 0.00 C ATOM 1132 CD2 LEU A 72 7.100 -0.141 -2.697 1.00 0.00 C ATOM 0 H LEU A 72 3.757 -2.868 -2.595 1.00 0.00 H new ATOM 0 HA LEU A 72 4.436 -0.262 -2.959 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.802 -2.493 -2.997 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.550 -2.439 -4.730 1.00 0.00 H new ATOM 0 HG LEU A 72 7.719 -1.533 -4.189 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.539 0.686 -5.242 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.530 -0.522 -6.072 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.779 0.664 -4.979 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.972 0.501 -2.821 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.229 0.471 -2.462 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.280 -0.843 -1.883 1.00 0.00 H new ATOM 1144 N TYR A 73 3.262 -1.531 -5.777 1.00 0.00 N ATOM 1145 CA TYR A 73 2.714 -1.178 -7.081 1.00 0.00 C ATOM 1146 C TYR A 73 1.564 -0.185 -6.939 1.00 0.00 C ATOM 1147 O TYR A 73 1.496 0.812 -7.658 1.00 0.00 O ATOM 1148 CB TYR A 73 2.233 -2.432 -7.812 1.00 0.00 C ATOM 1149 CG TYR A 73 3.355 -3.339 -8.263 1.00 0.00 C ATOM 1150 CD1 TYR A 73 4.677 -3.050 -7.947 1.00 0.00 C ATOM 1151 CD2 TYR A 73 3.095 -4.484 -9.005 1.00 0.00 C ATOM 1152 CE1 TYR A 73 5.707 -3.875 -8.356 1.00 0.00 C ATOM 1153 CE2 TYR A 73 4.117 -5.316 -9.418 1.00 0.00 C ATOM 1154 CZ TYR A 73 5.422 -5.007 -9.091 1.00 0.00 C ATOM 1155 OH TYR A 73 6.443 -5.832 -9.502 1.00 0.00 O ATOM 0 H TYR A 73 3.238 -2.529 -5.566 1.00 0.00 H new ATOM 0 HA TYR A 73 3.506 -0.707 -7.664 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.567 -2.992 -7.156 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.647 -2.133 -8.681 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.903 -2.165 -7.371 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.075 -4.728 -9.264 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.729 -3.635 -8.102 1.00 0.00 H new ATOM 0 HE2 TYR A 73 3.897 -6.203 -9.993 1.00 0.00 H new ATOM 0 HH TYR A 73 6.072 -6.585 -10.008 1.00 0.00 H new ATOM 1165 N VAL A 74 0.661 -0.466 -6.004 1.00 0.00 N ATOM 1166 CA VAL A 74 -0.486 0.401 -5.764 1.00 0.00 C ATOM 1167 C VAL A 74 -0.047 1.844 -5.542 1.00 0.00 C ATOM 1168 O VAL A 74 -0.672 2.779 -6.044 1.00 0.00 O ATOM 1169 CB VAL A 74 -1.300 -0.070 -4.545 1.00 0.00 C ATOM 1170 CG1 VAL A 74 -2.391 0.936 -4.210 1.00 0.00 C ATOM 1171 CG2 VAL A 74 -1.894 -1.447 -4.801 1.00 0.00 C ATOM 0 H VAL A 74 0.702 -1.287 -5.401 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.114 0.348 -6.653 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.630 -0.142 -3.688 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.956 0.586 -3.346 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.938 1.901 -3.981 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.062 1.043 -5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.466 -1.764 -3.929 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.551 -1.404 -5.670 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.091 -2.161 -4.988 1.00 0.00 H new ATOM 1181 N ILE A 75 1.033 2.019 -4.787 1.00 0.00 N ATOM 1182 CA ILE A 75 1.556 3.348 -4.499 1.00 0.00 C ATOM 1183 C ILE A 75 2.111 4.005 -5.759 1.00 0.00 C ATOM 1184 O ILE A 75 1.873 5.186 -6.011 1.00 0.00 O ATOM 1185 CB ILE A 75 2.664 3.298 -3.430 1.00 0.00 C ATOM 1186 CG1 ILE A 75 2.104 2.767 -2.109 1.00 0.00 C ATOM 1187 CG2 ILE A 75 3.277 4.677 -3.237 1.00 0.00 C ATOM 1188 CD1 ILE A 75 3.166 2.235 -1.173 1.00 0.00 C ATOM 0 H ILE A 75 1.562 1.257 -4.364 1.00 0.00 H new ATOM 0 HA ILE A 75 0.723 3.939 -4.120 1.00 0.00 H new ATOM 0 HB ILE A 75 3.446 2.619 -3.770 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.557 3.566 -1.608 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.387 1.974 -2.320 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.058 4.625 -2.479 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.707 5.019 -4.178 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.505 5.376 -2.916 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.697 1.876 -0.257 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.698 1.414 -1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 75 3.870 3.031 -0.932 1.00 0.00 H new ATOM 1200 N ASP A 76 2.848 3.231 -6.547 1.00 0.00 N ATOM 1201 CA ASP A 76 3.435 3.736 -7.783 1.00 0.00 C ATOM 1202 C ASP A 76 2.348 4.127 -8.780 1.00 0.00 C ATOM 1203 O ASP A 76 2.314 5.258 -9.265 1.00 0.00 O ATOM 1204 CB ASP A 76 4.358 2.686 -8.402 1.00 0.00 C ATOM 1205 CG ASP A 76 4.483 2.838 -9.905 1.00 0.00 C ATOM 1206 OD1 ASP A 76 5.289 3.681 -10.351 1.00 0.00 O ATOM 1207 OD2 ASP A 76 3.775 2.113 -10.635 1.00 0.00 O ATOM 0 H ASP A 76 3.054 2.251 -6.352 1.00 0.00 H new ATOM 0 HA ASP A 76 4.019 4.624 -7.542 1.00 0.00 H new ATOM 0 HB2 ASP A 76 5.346 2.763 -7.949 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.978 1.691 -8.171 1.00 0.00 H new ATOM 1212 N SER A 77 1.462 3.183 -9.081 1.00 0.00 N ATOM 1213 CA SER A 77 0.376 3.427 -10.024 1.00 0.00 C ATOM 1214 C SER A 77 -0.378 4.704 -9.666 1.00 0.00 C ATOM 1215 O SER A 77 -0.866 5.416 -10.545 1.00 0.00 O ATOM 1216 CB SER A 77 -0.589 2.240 -10.042 1.00 0.00 C ATOM 1217 OG SER A 77 -1.251 2.139 -11.290 1.00 0.00 O ATOM 0 H SER A 77 1.475 2.243 -8.686 1.00 0.00 H new ATOM 0 HA SER A 77 0.810 3.548 -11.016 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.041 1.319 -9.842 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.324 2.353 -9.245 1.00 0.00 H new ATOM 0 HG SER A 77 -2.197 2.369 -11.178 1.00 0.00 H new ATOM 1223 N ILE A 78 -0.468 4.987 -8.371 1.00 0.00 N ATOM 1224 CA ILE A 78 -1.161 6.179 -7.897 1.00 0.00 C ATOM 1225 C ILE A 78 -0.305 7.426 -8.090 1.00 0.00 C ATOM 1226 O ILE A 78 -0.649 8.313 -8.871 1.00 0.00 O ATOM 1227 CB ILE A 78 -1.539 6.055 -6.409 1.00 0.00 C ATOM 1228 CG1 ILE A 78 -2.684 5.055 -6.233 1.00 0.00 C ATOM 1229 CG2 ILE A 78 -1.924 7.414 -5.846 1.00 0.00 C ATOM 1230 CD1 ILE A 78 -2.709 4.399 -4.871 1.00 0.00 C ATOM 0 H ILE A 78 -0.070 4.408 -7.632 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.072 6.271 -8.489 1.00 0.00 H new ATOM 0 HB ILE A 78 -0.673 5.688 -5.858 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.632 5.568 -6.398 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.602 4.283 -6.998 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -2.189 7.310 -4.794 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.082 8.100 -5.943 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.778 7.808 -6.398 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.546 3.703 -4.818 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.776 3.858 -4.711 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -2.822 5.163 -4.101 1.00 0.00 H new ATOM 1242 N VAL A 79 0.814 7.486 -7.374 1.00 0.00 N ATOM 1243 CA VAL A 79 1.721 8.623 -7.469 1.00 0.00 C ATOM 1244 C VAL A 79 1.973 9.006 -8.923 1.00 0.00 C ATOM 1245 O VAL A 79 2.023 10.188 -9.264 1.00 0.00 O ATOM 1246 CB VAL A 79 3.070 8.323 -6.788 1.00 0.00 C ATOM 1247 CG1 VAL A 79 4.049 9.464 -7.016 1.00 0.00 C ATOM 1248 CG2 VAL A 79 2.871 8.069 -5.301 1.00 0.00 C ATOM 0 H VAL A 79 1.113 6.761 -6.722 1.00 0.00 H new ATOM 0 HA VAL A 79 1.240 9.455 -6.955 1.00 0.00 H new ATOM 0 HB VAL A 79 3.490 7.422 -7.234 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.996 9.234 -6.528 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.214 9.593 -8.086 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.639 10.384 -6.598 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.834 7.859 -4.836 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.429 8.951 -4.837 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.207 7.215 -5.163 1.00 0.00 H new ATOM 1258 N ARG A 80 2.130 7.999 -9.776 1.00 0.00 N ATOM 1259 CA ARG A 80 2.377 8.230 -11.194 1.00 0.00 C ATOM 1260 C ARG A 80 1.240 9.033 -11.820 1.00 0.00 C ATOM 1261 O ARG A 80 1.475 10.017 -12.521 1.00 0.00 O ATOM 1262 CB ARG A 80 2.540 6.899 -11.929 1.00 0.00 C ATOM 1263 CG ARG A 80 3.965 6.368 -11.918 1.00 0.00 C ATOM 1264 CD ARG A 80 4.060 5.013 -12.602 1.00 0.00 C ATOM 1265 NE ARG A 80 3.705 5.088 -14.016 1.00 0.00 N ATOM 1266 CZ ARG A 80 3.654 4.030 -14.818 1.00 0.00 C ATOM 1267 NH1 ARG A 80 3.933 2.822 -14.346 1.00 0.00 N ATOM 1268 NH2 ARG A 80 3.323 4.178 -16.094 1.00 0.00 N ATOM 0 H ARG A 80 2.091 7.015 -9.510 1.00 0.00 H new ATOM 0 HA ARG A 80 3.299 8.804 -11.287 1.00 0.00 H new ATOM 0 HB2 ARG A 80 1.882 6.159 -11.474 1.00 0.00 H new ATOM 0 HB3 ARG A 80 2.215 7.022 -12.962 1.00 0.00 H new ATOM 0 HG2 ARG A 80 4.623 7.077 -12.420 1.00 0.00 H new ATOM 0 HG3 ARG A 80 4.315 6.283 -10.889 1.00 0.00 H new ATOM 0 HD2 ARG A 80 5.075 4.627 -12.503 1.00 0.00 H new ATOM 0 HD3 ARG A 80 3.400 4.306 -12.099 1.00 0.00 H new ATOM 0 HE ARG A 80 3.484 6.003 -14.410 1.00 0.00 H new ATOM 0 HH11 ARG A 80 4.187 2.704 -13.365 1.00 0.00 H new ATOM 0 HH12 ARG A 80 3.893 2.011 -14.964 1.00 0.00 H new ATOM 0 HH21 ARG A 80 3.107 5.105 -16.461 1.00 0.00 H new ATOM 0 HH22 ARG A 80 3.284 3.365 -16.708 1.00 0.00 H new ATOM 1282 N GLN A 81 0.008 8.604 -11.562 1.00 0.00 N ATOM 1283 CA GLN A 81 -1.164 9.282 -12.102 1.00 0.00 C ATOM 1284 C GLN A 81 -1.291 10.690 -11.529 1.00 0.00 C ATOM 1285 O GLN A 81 -1.164 11.679 -12.251 1.00 0.00 O ATOM 1286 CB GLN A 81 -2.430 8.479 -11.797 1.00 0.00 C ATOM 1287 CG GLN A 81 -2.782 7.466 -12.875 1.00 0.00 C ATOM 1288 CD GLN A 81 -2.742 8.060 -14.269 1.00 0.00 C ATOM 1289 OE1 GLN A 81 -2.290 7.417 -15.217 1.00 0.00 O ATOM 1290 NE2 GLN A 81 -3.215 9.294 -14.401 1.00 0.00 N ATOM 0 H GLN A 81 -0.204 7.791 -10.983 1.00 0.00 H new ATOM 0 HA GLN A 81 -1.042 9.359 -13.182 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.300 7.958 -10.849 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.265 9.168 -11.670 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.087 6.628 -12.821 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -3.778 7.067 -12.682 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -3.580 9.790 -13.588 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -3.213 9.746 -15.315 1.00 0.00 H new ATOM 1299 N SER A 82 -1.543 10.773 -10.226 1.00 0.00 N ATOM 1300 CA SER A 82 -1.691 12.060 -9.557 1.00 0.00 C ATOM 1301 C SER A 82 -0.579 13.019 -9.970 1.00 0.00 C ATOM 1302 O SER A 82 -0.829 14.189 -10.261 1.00 0.00 O ATOM 1303 CB SER A 82 -1.681 11.873 -8.039 1.00 0.00 C ATOM 1304 OG SER A 82 -0.616 11.029 -7.636 1.00 0.00 O ATOM 0 H SER A 82 -1.649 9.964 -9.613 1.00 0.00 H new ATOM 0 HA SER A 82 -2.647 12.490 -9.857 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.585 12.843 -7.551 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.630 11.446 -7.716 1.00 0.00 H new ATOM 0 HG SER A 82 -0.118 11.456 -6.908 1.00 0.00 H new ATOM 1310 N ARG A 83 0.650 12.514 -9.994 1.00 0.00 N ATOM 1311 CA ARG A 83 1.802 13.325 -10.371 1.00 0.00 C ATOM 1312 C ARG A 83 1.634 13.887 -11.779 1.00 0.00 C ATOM 1313 O ARG A 83 2.154 14.957 -12.098 1.00 0.00 O ATOM 1314 CB ARG A 83 3.085 12.495 -10.291 1.00 0.00 C ATOM 1315 CG ARG A 83 4.328 13.252 -10.728 1.00 0.00 C ATOM 1316 CD ARG A 83 5.393 12.310 -11.268 1.00 0.00 C ATOM 1317 NE ARG A 83 6.588 13.027 -11.703 1.00 0.00 N ATOM 1318 CZ ARG A 83 7.479 13.547 -10.866 1.00 0.00 C ATOM 1319 NH1 ARG A 83 7.310 13.429 -9.556 1.00 0.00 N ATOM 1320 NH2 ARG A 83 8.542 14.185 -11.338 1.00 0.00 N ATOM 0 H ARG A 83 0.874 11.547 -9.757 1.00 0.00 H new ATOM 0 HA ARG A 83 1.872 14.158 -9.672 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.221 12.150 -9.266 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.973 11.607 -10.914 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.062 13.979 -11.495 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.730 13.812 -9.884 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.664 11.589 -10.497 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.985 11.744 -12.105 1.00 0.00 H new ATOM 0 HE ARG A 83 6.748 13.135 -12.705 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.495 12.938 -9.189 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.995 13.829 -8.915 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.676 14.277 -12.345 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.225 14.584 -10.694 1.00 0.00 H new ATOM 1334 N HIS A 84 0.906 13.158 -12.619 1.00 0.00 N ATOM 1335 CA HIS A 84 0.669 13.584 -13.994 1.00 0.00 C ATOM 1336 C HIS A 84 -0.645 14.351 -14.106 1.00 0.00 C ATOM 1337 O HIS A 84 -0.653 15.545 -14.405 1.00 0.00 O ATOM 1338 CB HIS A 84 0.649 12.374 -14.928 1.00 0.00 C ATOM 1339 CG HIS A 84 0.151 12.689 -16.305 1.00 0.00 C ATOM 1340 ND1 HIS A 84 0.939 13.270 -17.276 1.00 0.00 N ATOM 1341 CD2 HIS A 84 -1.063 12.499 -16.873 1.00 0.00 C ATOM 1342 CE1 HIS A 84 0.231 13.426 -18.380 1.00 0.00 C ATOM 1343 NE2 HIS A 84 -0.987 12.965 -18.162 1.00 0.00 N ATOM 0 H HIS A 84 0.470 12.270 -12.372 1.00 0.00 H new ATOM 0 HA HIS A 84 1.482 14.247 -14.289 1.00 0.00 H new ATOM 0 HB2 HIS A 84 1.656 11.964 -15.000 1.00 0.00 H new ATOM 0 HB3 HIS A 84 0.020 11.599 -14.491 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -1.930 12.062 -16.400 1.00 0.00 H new ATOM 0 HE1 HIS A 84 0.588 13.857 -19.304 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -1.748 12.957 -18.841 1.00 0.00 H new ATOM 1351 N GLN A 85 -1.752 13.656 -13.867 1.00 0.00 N ATOM 1352 CA GLN A 85 -3.072 14.273 -13.943 1.00 0.00 C ATOM 1353 C GLN A 85 -3.061 15.661 -13.312 1.00 0.00 C ATOM 1354 O GLN A 85 -3.344 16.658 -13.977 1.00 0.00 O ATOM 1355 CB GLN A 85 -4.111 13.391 -13.247 1.00 0.00 C ATOM 1356 CG GLN A 85 -4.767 12.379 -14.172 1.00 0.00 C ATOM 1357 CD GLN A 85 -6.192 12.057 -13.768 1.00 0.00 C ATOM 1358 OE1 GLN A 85 -7.135 12.727 -14.191 1.00 0.00 O ATOM 1359 NE2 GLN A 85 -6.357 11.028 -12.946 1.00 0.00 N ATOM 0 H GLN A 85 -1.762 12.667 -13.619 1.00 0.00 H new ATOM 0 HA GLN A 85 -3.338 14.375 -14.995 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -3.633 12.861 -12.423 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -4.882 14.027 -12.812 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -4.761 12.766 -15.191 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -4.178 11.462 -14.176 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -5.547 10.501 -12.620 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -7.294 10.765 -12.640 1.00 0.00 H new ATOM 1449 N ASP A 91 0.813 16.870 -7.005 1.00 0.00 N ATOM 1450 CA ASP A 91 0.725 15.540 -6.414 1.00 0.00 C ATOM 1451 C ASP A 91 0.616 15.626 -4.895 1.00 0.00 C ATOM 1452 O ASP A 91 1.123 16.562 -4.278 1.00 0.00 O ATOM 1453 CB ASP A 91 1.944 14.704 -6.805 1.00 0.00 C ATOM 1454 CG ASP A 91 1.702 13.216 -6.645 1.00 0.00 C ATOM 1455 OD1 ASP A 91 0.734 12.845 -5.948 1.00 0.00 O ATOM 1456 OD2 ASP A 91 2.479 12.422 -7.216 1.00 0.00 O ATOM 0 HA ASP A 91 -0.174 15.058 -6.797 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.209 14.917 -7.841 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.795 14.999 -6.191 1.00 0.00 H new ATOM 1461 N VAL A 92 -0.049 14.642 -4.298 1.00 0.00 N ATOM 1462 CA VAL A 92 -0.225 14.606 -2.851 1.00 0.00 C ATOM 1463 C VAL A 92 0.258 13.281 -2.272 1.00 0.00 C ATOM 1464 O VAL A 92 0.654 13.207 -1.108 1.00 0.00 O ATOM 1465 CB VAL A 92 -1.699 14.818 -2.459 1.00 0.00 C ATOM 1466 CG1 VAL A 92 -2.173 16.198 -2.890 1.00 0.00 C ATOM 1467 CG2 VAL A 92 -2.573 13.731 -3.065 1.00 0.00 C ATOM 0 H VAL A 92 -0.475 13.859 -4.794 1.00 0.00 H new ATOM 0 HA VAL A 92 0.373 15.419 -2.439 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.781 14.755 -1.374 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.217 16.330 -2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.565 16.960 -2.403 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.078 16.294 -3.972 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.611 13.897 -2.778 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.488 13.759 -4.151 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.247 12.757 -2.701 1.00 0.00 H new ATOM 1477 N PHE A 93 0.224 12.236 -3.091 1.00 0.00 N ATOM 1478 CA PHE A 93 0.657 10.912 -2.660 1.00 0.00 C ATOM 1479 C PHE A 93 2.179 10.800 -2.695 1.00 0.00 C ATOM 1480 O PHE A 93 2.777 10.081 -1.895 1.00 0.00 O ATOM 1481 CB PHE A 93 0.035 9.833 -3.550 1.00 0.00 C ATOM 1482 CG PHE A 93 -1.463 9.906 -3.621 1.00 0.00 C ATOM 1483 CD1 PHE A 93 -2.087 10.734 -4.540 1.00 0.00 C ATOM 1484 CD2 PHE A 93 -2.248 9.146 -2.769 1.00 0.00 C ATOM 1485 CE1 PHE A 93 -3.466 10.803 -4.607 1.00 0.00 C ATOM 1486 CE2 PHE A 93 -3.627 9.210 -2.832 1.00 0.00 C ATOM 1487 CZ PHE A 93 -4.237 10.040 -3.753 1.00 0.00 C ATOM 0 H PHE A 93 -0.099 12.280 -4.057 1.00 0.00 H new ATOM 0 HA PHE A 93 0.322 10.764 -1.633 1.00 0.00 H new ATOM 0 HB2 PHE A 93 0.443 9.923 -4.557 1.00 0.00 H new ATOM 0 HB3 PHE A 93 0.326 8.852 -3.175 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -1.489 11.332 -5.212 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -1.777 8.496 -2.047 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.940 11.454 -5.327 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.227 8.612 -2.162 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.315 10.092 -3.805 1.00 0.00 H new ATOM 1497 N ALA A 94 2.798 11.516 -3.628 1.00 0.00 N ATOM 1498 CA ALA A 94 4.249 11.499 -3.766 1.00 0.00 C ATOM 1499 C ALA A 94 4.925 12.077 -2.528 1.00 0.00 C ATOM 1500 O ALA A 94 5.711 11.411 -1.853 1.00 0.00 O ATOM 1501 CB ALA A 94 4.669 12.271 -5.008 1.00 0.00 C ATOM 0 H ALA A 94 2.317 12.115 -4.299 1.00 0.00 H new ATOM 0 HA ALA A 94 4.568 10.462 -3.871 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.755 12.251 -5.099 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.222 11.812 -5.890 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.331 13.304 -4.926 1.00 0.00 H new ATOM 1507 N PRO A 95 4.615 13.345 -2.220 1.00 0.00 N ATOM 1508 CA PRO A 95 5.183 14.040 -1.061 1.00 0.00 C ATOM 1509 C PRO A 95 4.658 13.488 0.260 1.00 0.00 C ATOM 1510 O PRO A 95 5.305 13.619 1.299 1.00 0.00 O ATOM 1511 CB PRO A 95 4.725 15.488 -1.256 1.00 0.00 C ATOM 1512 CG PRO A 95 3.488 15.386 -2.080 1.00 0.00 C ATOM 1513 CD PRO A 95 3.686 14.198 -2.981 1.00 0.00 C ATOM 0 HA PRO A 95 6.266 13.925 -1.007 1.00 0.00 H new ATOM 0 HB2 PRO A 95 4.525 15.972 -0.300 1.00 0.00 H new ATOM 0 HB3 PRO A 95 5.489 16.080 -1.760 1.00 0.00 H new ATOM 0 HG2 PRO A 95 2.609 15.255 -1.449 1.00 0.00 H new ATOM 0 HG3 PRO A 95 3.331 16.294 -2.661 1.00 0.00 H new ATOM 0 HD2 PRO A 95 2.745 13.686 -3.184 1.00 0.00 H new ATOM 0 HD3 PRO A 95 4.105 14.489 -3.944 1.00 0.00 H new ATOM 1521 N ARG A 96 3.482 12.871 0.212 1.00 0.00 N ATOM 1522 CA ARG A 96 2.870 12.300 1.406 1.00 0.00 C ATOM 1523 C ARG A 96 3.489 10.945 1.739 1.00 0.00 C ATOM 1524 O ARG A 96 3.757 10.642 2.902 1.00 0.00 O ATOM 1525 CB ARG A 96 1.361 12.149 1.209 1.00 0.00 C ATOM 1526 CG ARG A 96 0.665 11.437 2.357 1.00 0.00 C ATOM 1527 CD ARG A 96 0.842 12.188 3.668 1.00 0.00 C ATOM 1528 NE ARG A 96 -0.050 11.687 4.710 1.00 0.00 N ATOM 1529 CZ ARG A 96 -0.201 12.275 5.892 1.00 0.00 C ATOM 1530 NH1 ARG A 96 0.476 13.378 6.180 1.00 0.00 N ATOM 1531 NH2 ARG A 96 -1.032 11.759 6.789 1.00 0.00 N ATOM 0 H ARG A 96 2.934 12.754 -0.640 1.00 0.00 H new ATOM 0 HA ARG A 96 3.054 12.979 2.239 1.00 0.00 H new ATOM 0 HB2 ARG A 96 0.919 13.137 1.084 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.177 11.599 0.286 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -0.397 11.337 2.134 1.00 0.00 H new ATOM 0 HG3 ARG A 96 1.066 10.428 2.457 1.00 0.00 H new ATOM 0 HD2 ARG A 96 1.876 12.097 4.001 1.00 0.00 H new ATOM 0 HD3 ARG A 96 0.651 13.249 3.507 1.00 0.00 H new ATOM 0 HE ARG A 96 -0.586 10.840 4.520 1.00 0.00 H new ATOM 0 HH11 ARG A 96 1.115 13.778 5.493 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.357 13.827 7.088 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.555 10.911 6.571 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -1.148 12.211 7.696 1.00 0.00 H new ATOM 1545 N PHE A 97 3.712 10.134 0.711 1.00 0.00 N ATOM 1546 CA PHE A 97 4.297 8.810 0.894 1.00 0.00 C ATOM 1547 C PHE A 97 5.762 8.916 1.305 1.00 0.00 C ATOM 1548 O PHE A 97 6.257 8.109 2.091 1.00 0.00 O ATOM 1549 CB PHE A 97 4.174 7.993 -0.394 1.00 0.00 C ATOM 1550 CG PHE A 97 2.826 7.353 -0.571 1.00 0.00 C ATOM 1551 CD1 PHE A 97 2.221 6.681 0.479 1.00 0.00 C ATOM 1552 CD2 PHE A 97 2.166 7.423 -1.787 1.00 0.00 C ATOM 1553 CE1 PHE A 97 0.981 6.090 0.318 1.00 0.00 C ATOM 1554 CE2 PHE A 97 0.926 6.835 -1.953 1.00 0.00 C ATOM 1555 CZ PHE A 97 0.333 6.169 -0.899 1.00 0.00 C ATOM 0 H PHE A 97 3.497 10.370 -0.258 1.00 0.00 H new ATOM 0 HA PHE A 97 3.750 8.304 1.690 1.00 0.00 H new ATOM 0 HB2 PHE A 97 4.374 8.642 -1.247 1.00 0.00 H new ATOM 0 HB3 PHE A 97 4.939 7.217 -0.397 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.723 6.618 1.433 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.625 7.943 -2.615 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.520 5.567 1.143 1.00 0.00 H new ATOM 0 HE2 PHE A 97 0.422 6.897 -2.906 1.00 0.00 H new ATOM 0 HZ PHE A 97 -0.636 5.710 -1.026 1.00 0.00 H new ATOM 1565 N SER A 98 6.451 9.917 0.766 1.00 0.00 N ATOM 1566 CA SER A 98 7.861 10.127 1.072 1.00 0.00 C ATOM 1567 C SER A 98 8.065 10.352 2.568 1.00 0.00 C ATOM 1568 O SER A 98 9.145 10.108 3.102 1.00 0.00 O ATOM 1569 CB SER A 98 8.404 11.322 0.286 1.00 0.00 C ATOM 1570 OG SER A 98 7.612 12.477 0.503 1.00 0.00 O ATOM 0 H SER A 98 6.055 10.595 0.115 1.00 0.00 H new ATOM 0 HA SER A 98 8.408 9.231 0.779 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.433 11.521 0.586 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.422 11.084 -0.778 1.00 0.00 H new ATOM 0 HG SER A 98 6.891 12.266 1.132 1.00 0.00 H new ATOM 1576 N ASN A 99 7.016 10.822 3.237 1.00 0.00 N ATOM 1577 CA ASN A 99 7.079 11.082 4.670 1.00 0.00 C ATOM 1578 C ASN A 99 7.552 9.845 5.428 1.00 0.00 C ATOM 1579 O ASN A 99 8.621 9.849 6.036 1.00 0.00 O ATOM 1580 CB ASN A 99 5.708 11.518 5.191 1.00 0.00 C ATOM 1581 CG ASN A 99 5.209 12.781 4.516 1.00 0.00 C ATOM 1582 OD1 ASN A 99 5.967 13.480 3.844 1.00 0.00 O ATOM 1583 ND2 ASN A 99 3.927 13.079 4.693 1.00 0.00 N ATOM 0 H ASN A 99 6.114 11.030 2.809 1.00 0.00 H new ATOM 0 HA ASN A 99 7.797 11.885 4.836 1.00 0.00 H new ATOM 0 HB2 ASN A 99 4.989 10.715 5.030 1.00 0.00 H new ATOM 0 HB3 ASN A 99 5.767 11.683 6.267 1.00 0.00 H new ATOM 0 HD21 ASN A 99 3.534 13.917 4.263 1.00 0.00 H new ATOM 0 HD22 ASN A 99 3.335 12.470 5.258 1.00 0.00 H new ATOM 1590 N ASN A 100 6.748 8.787 5.384 1.00 0.00 N ATOM 1591 CA ASN A 100 7.085 7.543 6.066 1.00 0.00 C ATOM 1592 C ASN A 100 7.399 6.439 5.060 1.00 0.00 C ATOM 1593 O ASN A 100 7.439 5.259 5.411 1.00 0.00 O ATOM 1594 CB ASN A 100 5.934 7.107 6.975 1.00 0.00 C ATOM 1595 CG ASN A 100 5.248 8.284 7.643 1.00 0.00 C ATOM 1596 OD1 ASN A 100 4.203 8.748 7.188 1.00 0.00 O ATOM 1597 ND2 ASN A 100 5.836 8.771 8.730 1.00 0.00 N ATOM 0 H ASN A 100 5.859 8.767 4.884 1.00 0.00 H new ATOM 0 HA ASN A 100 7.972 7.720 6.674 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.204 6.548 6.390 1.00 0.00 H new ATOM 0 HB3 ASN A 100 6.315 6.430 7.740 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.421 9.562 9.223 1.00 0.00 H new ATOM 0 HD22 ASN A 100 6.702 8.354 9.071 1.00 0.00 H new ATOM 1604 N ILE A 101 7.621 6.831 3.810 1.00 0.00 N ATOM 1605 CA ILE A 101 7.933 5.876 2.755 1.00 0.00 C ATOM 1606 C ILE A 101 8.745 4.705 3.296 1.00 0.00 C ATOM 1607 O ILE A 101 8.497 3.550 2.947 1.00 0.00 O ATOM 1608 CB ILE A 101 8.714 6.541 1.606 1.00 0.00 C ATOM 1609 CG1 ILE A 101 9.049 5.512 0.525 1.00 0.00 C ATOM 1610 CG2 ILE A 101 9.982 7.193 2.136 1.00 0.00 C ATOM 1611 CD1 ILE A 101 7.990 5.396 -0.549 1.00 0.00 C ATOM 0 H ILE A 101 7.590 7.803 3.504 1.00 0.00 H new ATOM 0 HA ILE A 101 6.981 5.508 2.371 1.00 0.00 H new ATOM 0 HB ILE A 101 8.089 7.316 1.162 1.00 0.00 H new ATOM 0 HG12 ILE A 101 9.998 5.781 0.061 1.00 0.00 H new ATOM 0 HG13 ILE A 101 9.188 4.538 0.993 1.00 0.00 H new ATOM 0 HG21 ILE A 101 10.523 7.659 1.312 1.00 0.00 H new ATOM 0 HG22 ILE A 101 9.720 7.952 2.873 1.00 0.00 H new ATOM 0 HG23 ILE A 101 10.613 6.436 2.603 1.00 0.00 H new ATOM 0 HD11 ILE A 101 8.295 4.648 -1.281 1.00 0.00 H new ATOM 0 HD12 ILE A 101 7.044 5.097 -0.097 1.00 0.00 H new ATOM 0 HD13 ILE A 101 7.867 6.359 -1.044 1.00 0.00 H new ATOM 1623 N ILE A 102 9.716 5.010 4.150 1.00 0.00 N ATOM 1624 CA ILE A 102 10.563 3.982 4.742 1.00 0.00 C ATOM 1625 C ILE A 102 9.729 2.940 5.481 1.00 0.00 C ATOM 1626 O ILE A 102 9.763 1.755 5.149 1.00 0.00 O ATOM 1627 CB ILE A 102 11.587 4.590 5.719 1.00 0.00 C ATOM 1628 CG1 ILE A 102 12.433 5.649 5.011 1.00 0.00 C ATOM 1629 CG2 ILE A 102 12.473 3.500 6.304 1.00 0.00 C ATOM 1630 CD1 ILE A 102 13.327 5.085 3.929 1.00 0.00 C ATOM 0 H ILE A 102 9.936 5.961 4.447 1.00 0.00 H new ATOM 0 HA ILE A 102 11.096 3.502 3.921 1.00 0.00 H new ATOM 0 HB ILE A 102 11.048 5.070 6.536 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.772 6.396 4.572 1.00 0.00 H new ATOM 0 HG13 ILE A 102 13.049 6.163 5.749 1.00 0.00 H new ATOM 0 HG21 ILE A 102 13.191 3.945 6.992 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.856 2.778 6.840 1.00 0.00 H new ATOM 0 HG23 ILE A 102 13.007 2.994 5.499 1.00 0.00 H new ATOM 0 HD11 ILE A 102 13.897 5.893 3.470 1.00 0.00 H new ATOM 0 HD12 ILE A 102 14.013 4.359 4.366 1.00 0.00 H new ATOM 0 HD13 ILE A 102 12.716 4.596 3.170 1.00 0.00 H new ATOM 1642 N SER A 103 8.980 3.391 6.482 1.00 0.00 N ATOM 1643 CA SER A 103 8.138 2.498 7.269 1.00 0.00 C ATOM 1644 C SER A 103 7.214 1.686 6.366 1.00 0.00 C ATOM 1645 O SER A 103 6.895 0.533 6.659 1.00 0.00 O ATOM 1646 CB SER A 103 7.311 3.298 8.277 1.00 0.00 C ATOM 1647 OG SER A 103 6.948 2.498 9.388 1.00 0.00 O ATOM 0 H SER A 103 8.939 4.369 6.767 1.00 0.00 H new ATOM 0 HA SER A 103 8.788 1.809 7.809 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.883 4.161 8.618 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.413 3.682 7.792 1.00 0.00 H new ATOM 0 HG SER A 103 6.422 3.033 10.018 1.00 0.00 H new ATOM 1653 N THR A 104 6.787 2.296 5.265 1.00 0.00 N ATOM 1654 CA THR A 104 5.899 1.633 4.319 1.00 0.00 C ATOM 1655 C THR A 104 6.620 0.508 3.585 1.00 0.00 C ATOM 1656 O THR A 104 6.090 -0.595 3.445 1.00 0.00 O ATOM 1657 CB THR A 104 5.336 2.626 3.285 1.00 0.00 C ATOM 1658 OG1 THR A 104 4.440 3.543 3.925 1.00 0.00 O ATOM 1659 CG2 THR A 104 4.607 1.892 2.170 1.00 0.00 C ATOM 0 H THR A 104 7.042 3.249 5.007 1.00 0.00 H new ATOM 0 HA THR A 104 5.075 1.217 4.898 1.00 0.00 H new ATOM 0 HB THR A 104 6.170 3.176 2.850 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.338 4.343 3.368 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.218 2.614 1.452 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.298 1.216 1.667 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.781 1.319 2.591 1.00 0.00 H new ATOM 1667 N PHE A 105 7.831 0.792 3.118 1.00 0.00 N ATOM 1668 CA PHE A 105 8.624 -0.197 2.398 1.00 0.00 C ATOM 1669 C PHE A 105 9.071 -1.319 3.330 1.00 0.00 C ATOM 1670 O PHE A 105 9.093 -2.487 2.944 1.00 0.00 O ATOM 1671 CB PHE A 105 9.846 0.467 1.758 1.00 0.00 C ATOM 1672 CG PHE A 105 9.587 0.990 0.374 1.00 0.00 C ATOM 1673 CD1 PHE A 105 8.523 1.844 0.130 1.00 0.00 C ATOM 1674 CD2 PHE A 105 10.407 0.629 -0.682 1.00 0.00 C ATOM 1675 CE1 PHE A 105 8.283 2.328 -1.142 1.00 0.00 C ATOM 1676 CE2 PHE A 105 10.172 1.110 -1.956 1.00 0.00 C ATOM 1677 CZ PHE A 105 9.108 1.960 -2.187 1.00 0.00 C ATOM 0 H PHE A 105 8.285 1.699 3.225 1.00 0.00 H new ATOM 0 HA PHE A 105 8.000 -0.627 1.615 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.177 1.289 2.393 1.00 0.00 H new ATOM 0 HB3 PHE A 105 10.663 -0.254 1.719 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.874 2.134 0.943 1.00 0.00 H new ATOM 0 HD2 PHE A 105 11.240 -0.036 -0.508 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.451 2.993 -1.319 1.00 0.00 H new ATOM 0 HE2 PHE A 105 10.820 0.822 -2.771 1.00 0.00 H new ATOM 0 HZ PHE A 105 8.922 2.336 -3.182 1.00 0.00 H new ATOM 1687 N GLN A 106 9.427 -0.954 4.558 1.00 0.00 N ATOM 1688 CA GLN A 106 9.874 -1.930 5.544 1.00 0.00 C ATOM 1689 C GLN A 106 8.904 -3.104 5.628 1.00 0.00 C ATOM 1690 O GLN A 106 9.318 -4.260 5.703 1.00 0.00 O ATOM 1691 CB GLN A 106 10.015 -1.271 6.917 1.00 0.00 C ATOM 1692 CG GLN A 106 11.166 -0.281 7.002 1.00 0.00 C ATOM 1693 CD GLN A 106 12.518 -0.964 7.072 1.00 0.00 C ATOM 1694 OE1 GLN A 106 12.613 -2.148 7.394 1.00 0.00 O ATOM 1695 NE2 GLN A 106 13.574 -0.218 6.769 1.00 0.00 N ATOM 0 H GLN A 106 9.414 0.009 4.893 1.00 0.00 H new ATOM 0 HA GLN A 106 10.846 -2.308 5.228 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.086 -0.756 7.161 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.157 -2.046 7.670 1.00 0.00 H new ATOM 0 HG2 GLN A 106 11.140 0.377 6.133 1.00 0.00 H new ATOM 0 HG3 GLN A 106 11.035 0.348 7.882 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.449 0.760 6.507 1.00 0.00 H new ATOM 0 HE22 GLN A 106 14.510 -0.623 6.798 1.00 0.00 H new ATOM 1704 N ASN A 107 7.610 -2.798 5.615 1.00 0.00 N ATOM 1705 CA ASN A 107 6.581 -3.828 5.691 1.00 0.00 C ATOM 1706 C ASN A 107 6.511 -4.624 4.391 1.00 0.00 C ATOM 1707 O ASN A 107 5.970 -5.730 4.356 1.00 0.00 O ATOM 1708 CB ASN A 107 5.219 -3.197 5.989 1.00 0.00 C ATOM 1709 CG ASN A 107 5.237 -2.353 7.249 1.00 0.00 C ATOM 1710 OD1 ASN A 107 6.188 -2.402 8.029 1.00 0.00 O ATOM 1711 ND2 ASN A 107 4.182 -1.573 7.454 1.00 0.00 N ATOM 0 H ASN A 107 7.250 -1.846 5.553 1.00 0.00 H new ATOM 0 HA ASN A 107 6.843 -4.509 6.500 1.00 0.00 H new ATOM 0 HB2 ASN A 107 4.916 -2.578 5.145 1.00 0.00 H new ATOM 0 HB3 ASN A 107 4.472 -3.984 6.092 1.00 0.00 H new ATOM 0 HD21 ASN A 107 4.138 -0.983 8.285 1.00 0.00 H new ATOM 0 HD22 ASN A 107 3.416 -1.564 6.781 1.00 0.00 H new ATOM 1718 N LEU A 108 7.061 -4.054 3.325 1.00 0.00 N ATOM 1719 CA LEU A 108 7.063 -4.710 2.022 1.00 0.00 C ATOM 1720 C LEU A 108 8.333 -5.532 1.827 1.00 0.00 C ATOM 1721 O LEU A 108 8.326 -6.548 1.132 1.00 0.00 O ATOM 1722 CB LEU A 108 6.938 -3.671 0.906 1.00 0.00 C ATOM 1723 CG LEU A 108 5.737 -2.730 0.997 1.00 0.00 C ATOM 1724 CD1 LEU A 108 5.941 -1.516 0.103 1.00 0.00 C ATOM 1725 CD2 LEU A 108 4.456 -3.461 0.622 1.00 0.00 C ATOM 0 H LEU A 108 7.511 -3.139 3.337 1.00 0.00 H new ATOM 0 HA LEU A 108 6.207 -5.384 1.981 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.846 -3.068 0.894 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.892 -4.196 -0.048 1.00 0.00 H new ATOM 0 HG LEU A 108 5.647 -2.386 2.027 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.076 -0.857 0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.836 -0.979 0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.058 -1.841 -0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.612 -2.775 0.693 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.536 -3.834 -0.399 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.302 -4.298 1.303 1.00 0.00 H new ATOM 1737 N TYR A 109 9.420 -5.087 2.447 1.00 0.00 N ATOM 1738 CA TYR A 109 10.698 -5.781 2.342 1.00 0.00 C ATOM 1739 C TYR A 109 10.733 -6.999 3.259 1.00 0.00 C ATOM 1740 O TYR A 109 11.726 -7.725 3.307 1.00 0.00 O ATOM 1741 CB TYR A 109 11.847 -4.833 2.690 1.00 0.00 C ATOM 1742 CG TYR A 109 12.173 -3.848 1.591 1.00 0.00 C ATOM 1743 CD1 TYR A 109 12.391 -4.277 0.287 1.00 0.00 C ATOM 1744 CD2 TYR A 109 12.264 -2.486 1.856 1.00 0.00 C ATOM 1745 CE1 TYR A 109 12.690 -3.380 -0.720 1.00 0.00 C ATOM 1746 CE2 TYR A 109 12.561 -1.582 0.854 1.00 0.00 C ATOM 1747 CZ TYR A 109 12.774 -2.034 -0.431 1.00 0.00 C ATOM 1748 OH TYR A 109 13.070 -1.137 -1.432 1.00 0.00 O ATOM 0 H TYR A 109 9.442 -4.249 3.028 1.00 0.00 H new ATOM 0 HA TYR A 109 10.815 -6.120 1.313 1.00 0.00 H new ATOM 0 HB2 TYR A 109 11.591 -4.283 3.595 1.00 0.00 H new ATOM 0 HB3 TYR A 109 12.737 -5.421 2.915 1.00 0.00 H new ATOM 0 HD1 TYR A 109 12.325 -5.330 0.057 1.00 0.00 H new ATOM 0 HD2 TYR A 109 12.100 -2.129 2.862 1.00 0.00 H new ATOM 0 HE1 TYR A 109 12.857 -3.731 -1.728 1.00 0.00 H new ATOM 0 HE2 TYR A 109 12.626 -0.527 1.076 1.00 0.00 H new ATOM 0 HH TYR A 109 14.018 -0.893 -1.383 1.00 0.00 H new ATOM 1758 N ARG A 110 9.641 -7.217 3.985 1.00 0.00 N ATOM 1759 CA ARG A 110 9.546 -8.347 4.901 1.00 0.00 C ATOM 1760 C ARG A 110 9.390 -9.657 4.135 1.00 0.00 C ATOM 1761 O ARG A 110 9.667 -10.734 4.664 1.00 0.00 O ATOM 1762 CB ARG A 110 8.365 -8.158 5.856 1.00 0.00 C ATOM 1763 CG ARG A 110 8.265 -6.754 6.430 1.00 0.00 C ATOM 1764 CD ARG A 110 7.550 -6.751 7.772 1.00 0.00 C ATOM 1765 NE ARG A 110 8.128 -7.718 8.702 1.00 0.00 N ATOM 1766 CZ ARG A 110 9.297 -7.545 9.310 1.00 0.00 C ATOM 1767 NH1 ARG A 110 10.008 -6.448 9.087 1.00 0.00 N ATOM 1768 NH2 ARG A 110 9.756 -8.470 10.142 1.00 0.00 N ATOM 0 H ARG A 110 8.810 -6.626 3.956 1.00 0.00 H new ATOM 0 HA ARG A 110 10.469 -8.393 5.479 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.441 -8.392 5.328 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.454 -8.871 6.676 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.265 -6.336 6.548 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.731 -6.111 5.730 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.601 -5.753 8.208 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.495 -6.979 7.621 1.00 0.00 H new ATOM 0 HE ARG A 110 7.606 -8.573 8.895 1.00 0.00 H new ATOM 0 HH11 ARG A 110 9.658 -5.735 8.448 1.00 0.00 H new ATOM 0 HH12 ARG A 110 10.905 -6.318 9.555 1.00 0.00 H new ATOM 0 HH21 ARG A 110 9.212 -9.315 10.316 1.00 0.00 H new ATOM 0 HH22 ARG A 110 10.653 -8.336 10.608 1.00 0.00 H new ATOM 1782 N CYS A 111 8.944 -9.557 2.888 1.00 0.00 N ATOM 1783 CA CYS A 111 8.749 -10.734 2.049 1.00 0.00 C ATOM 1784 C CYS A 111 9.932 -11.689 2.169 1.00 0.00 C ATOM 1785 O CYS A 111 11.041 -11.300 2.537 1.00 0.00 O ATOM 1786 CB CYS A 111 8.559 -10.320 0.589 1.00 0.00 C ATOM 1787 SG CYS A 111 9.873 -9.258 -0.055 1.00 0.00 S ATOM 0 H CYS A 111 8.711 -8.673 2.435 1.00 0.00 H new ATOM 0 HA CYS A 111 7.852 -11.250 2.392 1.00 0.00 H new ATOM 0 HB2 CYS A 111 8.497 -11.217 -0.027 1.00 0.00 H new ATOM 0 HB3 CYS A 111 7.606 -9.800 0.491 1.00 0.00 H new ATOM 0 HG CYS A 111 9.608 -8.018 0.230 1.00 0.00 H new ATOM 1793 N PRO A 112 9.694 -12.970 1.852 1.00 0.00 N ATOM 1794 CA PRO A 112 10.727 -14.008 1.918 1.00 0.00 C ATOM 1795 C PRO A 112 12.024 -13.578 1.240 1.00 0.00 C ATOM 1796 O PRO A 112 13.087 -14.142 1.498 1.00 0.00 O ATOM 1797 CB PRO A 112 10.097 -15.184 1.168 1.00 0.00 C ATOM 1798 CG PRO A 112 8.628 -14.982 1.312 1.00 0.00 C ATOM 1799 CD PRO A 112 8.396 -13.505 1.405 1.00 0.00 C ATOM 0 HA PRO A 112 11.006 -14.240 2.946 1.00 0.00 H new ATOM 0 HB2 PRO A 112 10.395 -15.190 0.120 1.00 0.00 H new ATOM 0 HB3 PRO A 112 10.409 -16.138 1.594 1.00 0.00 H new ATOM 0 HG2 PRO A 112 8.095 -15.403 0.459 1.00 0.00 H new ATOM 0 HG3 PRO A 112 8.255 -15.488 2.202 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.101 -13.086 0.443 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.601 -13.269 2.113 1.00 0.00 H new ATOM 1807 N GLY A 113 11.929 -12.575 0.373 1.00 0.00 N ATOM 1808 CA GLY A 113 13.102 -12.087 -0.328 1.00 0.00 C ATOM 1809 C GLY A 113 13.022 -12.317 -1.824 1.00 0.00 C ATOM 1810 O GLY A 113 13.525 -11.515 -2.611 1.00 0.00 O ATOM 0 H GLY A 113 11.061 -12.092 0.144 1.00 0.00 H new ATOM 0 HA2 GLY A 113 13.220 -11.021 -0.133 1.00 0.00 H new ATOM 0 HA3 GLY A 113 13.989 -12.583 0.066 1.00 0.00 H new ATOM 1814 N ASP A 114 12.389 -13.417 -2.218 1.00 0.00 N ATOM 1815 CA ASP A 114 12.246 -13.751 -3.631 1.00 0.00 C ATOM 1816 C ASP A 114 11.256 -12.812 -4.313 1.00 0.00 C ATOM 1817 O ASP A 114 10.996 -12.933 -5.511 1.00 0.00 O ATOM 1818 CB ASP A 114 11.784 -15.201 -3.789 1.00 0.00 C ATOM 1819 CG ASP A 114 12.587 -16.161 -2.933 1.00 0.00 C ATOM 1820 OD1 ASP A 114 13.699 -16.544 -3.355 1.00 0.00 O ATOM 1821 OD2 ASP A 114 12.105 -16.528 -1.841 1.00 0.00 O ATOM 0 H ASP A 114 11.967 -14.092 -1.580 1.00 0.00 H new ATOM 0 HA ASP A 114 13.219 -13.633 -4.108 1.00 0.00 H new ATOM 0 HB2 ASP A 114 10.730 -15.275 -3.521 1.00 0.00 H new ATOM 0 HB3 ASP A 114 11.868 -15.494 -4.835 1.00 0.00 H new ATOM 1826 N ASP A 115 10.708 -11.878 -3.544 1.00 0.00 N ATOM 1827 CA ASP A 115 9.746 -10.918 -4.075 1.00 0.00 C ATOM 1828 C ASP A 115 10.308 -9.501 -4.021 1.00 0.00 C ATOM 1829 O ASP A 115 9.717 -8.566 -4.562 1.00 0.00 O ATOM 1830 CB ASP A 115 8.435 -10.991 -3.291 1.00 0.00 C ATOM 1831 CG ASP A 115 7.936 -12.413 -3.128 1.00 0.00 C ATOM 1832 OD1 ASP A 115 7.396 -12.969 -4.107 1.00 0.00 O ATOM 1833 OD2 ASP A 115 8.086 -12.971 -2.021 1.00 0.00 O ATOM 0 H ASP A 115 10.913 -11.765 -2.551 1.00 0.00 H new ATOM 0 HA ASP A 115 9.551 -11.173 -5.117 1.00 0.00 H new ATOM 0 HB2 ASP A 115 8.578 -10.544 -2.307 1.00 0.00 H new ATOM 0 HB3 ASP A 115 7.676 -10.399 -3.802 1.00 0.00 H new ATOM 1838 N LYS A 116 11.453 -9.348 -3.364 1.00 0.00 N ATOM 1839 CA LYS A 116 12.096 -8.045 -3.239 1.00 0.00 C ATOM 1840 C LYS A 116 12.357 -7.433 -4.611 1.00 0.00 C ATOM 1841 O LYS A 116 12.233 -6.223 -4.795 1.00 0.00 O ATOM 1842 CB LYS A 116 13.411 -8.175 -2.467 1.00 0.00 C ATOM 1843 CG LYS A 116 13.247 -8.064 -0.961 1.00 0.00 C ATOM 1844 CD LYS A 116 14.580 -8.189 -0.244 1.00 0.00 C ATOM 1845 CE LYS A 116 14.413 -8.091 1.264 1.00 0.00 C ATOM 1846 NZ LYS A 116 14.437 -6.678 1.734 1.00 0.00 N ATOM 0 H LYS A 116 11.955 -10.111 -2.910 1.00 0.00 H new ATOM 0 HA LYS A 116 11.423 -7.386 -2.690 1.00 0.00 H new ATOM 0 HB2 LYS A 116 13.868 -9.136 -2.704 1.00 0.00 H new ATOM 0 HB3 LYS A 116 14.100 -7.402 -2.807 1.00 0.00 H new ATOM 0 HG2 LYS A 116 12.788 -7.107 -0.714 1.00 0.00 H new ATOM 0 HG3 LYS A 116 12.570 -8.842 -0.610 1.00 0.00 H new ATOM 0 HD2 LYS A 116 15.043 -9.142 -0.499 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.254 -7.405 -0.588 1.00 0.00 H new ATOM 0 HE2 LYS A 116 13.471 -8.555 1.556 1.00 0.00 H new ATOM 0 HE3 LYS A 116 15.209 -8.651 1.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 14.121 -6.636 2.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 15.405 -6.305 1.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 13.802 -6.105 1.143 1.00 0.00 H new ATOM 1860 N SER A 117 12.718 -8.278 -5.572 1.00 0.00 N ATOM 1861 CA SER A 117 12.999 -7.820 -6.927 1.00 0.00 C ATOM 1862 C SER A 117 11.868 -6.938 -7.448 1.00 0.00 C ATOM 1863 O SER A 117 12.107 -5.918 -8.094 1.00 0.00 O ATOM 1864 CB SER A 117 13.201 -9.015 -7.861 1.00 0.00 C ATOM 1865 OG SER A 117 13.514 -8.587 -9.175 1.00 0.00 O ATOM 0 H SER A 117 12.823 -9.284 -5.437 1.00 0.00 H new ATOM 0 HA SER A 117 13.915 -7.229 -6.902 1.00 0.00 H new ATOM 0 HB2 SER A 117 14.003 -9.647 -7.480 1.00 0.00 H new ATOM 0 HB3 SER A 117 12.297 -9.624 -7.879 1.00 0.00 H new ATOM 0 HG SER A 117 13.640 -9.369 -9.752 1.00 0.00 H new ATOM 1871 N LYS A 118 10.634 -7.340 -7.162 1.00 0.00 N ATOM 1872 CA LYS A 118 9.464 -6.589 -7.599 1.00 0.00 C ATOM 1873 C LYS A 118 9.356 -5.265 -6.849 1.00 0.00 C ATOM 1874 O LYS A 118 8.672 -4.343 -7.295 1.00 0.00 O ATOM 1875 CB LYS A 118 8.193 -7.414 -7.384 1.00 0.00 C ATOM 1876 CG LYS A 118 7.949 -8.450 -8.468 1.00 0.00 C ATOM 1877 CD LYS A 118 8.609 -9.776 -8.131 1.00 0.00 C ATOM 1878 CE LYS A 118 8.112 -10.892 -9.036 1.00 0.00 C ATOM 1879 NZ LYS A 118 8.875 -12.155 -8.830 1.00 0.00 N ATOM 0 H LYS A 118 10.419 -8.183 -6.629 1.00 0.00 H new ATOM 0 HA LYS A 118 9.576 -6.376 -8.662 1.00 0.00 H new ATOM 0 HB2 LYS A 118 8.256 -7.918 -6.419 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.337 -6.741 -7.337 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.877 -8.598 -8.596 1.00 0.00 H new ATOM 0 HG3 LYS A 118 8.335 -8.081 -9.418 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.690 -9.681 -8.229 1.00 0.00 H new ATOM 0 HD3 LYS A 118 8.405 -10.031 -7.091 1.00 0.00 H new ATOM 0 HE2 LYS A 118 7.054 -11.071 -8.844 1.00 0.00 H new ATOM 0 HE3 LYS A 118 8.199 -10.581 -10.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 8.506 -12.891 -9.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 9.881 -11.991 -9.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 8.772 -12.466 -7.843 1.00 0.00 H new ATOM 1893 N ILE A 119 10.036 -5.178 -5.711 1.00 0.00 N ATOM 1894 CA ILE A 119 10.018 -3.966 -4.902 1.00 0.00 C ATOM 1895 C ILE A 119 11.171 -3.040 -5.273 1.00 0.00 C ATOM 1896 O ILE A 119 11.026 -1.817 -5.268 1.00 0.00 O ATOM 1897 CB ILE A 119 10.099 -4.291 -3.399 1.00 0.00 C ATOM 1898 CG1 ILE A 119 9.041 -5.330 -3.021 1.00 0.00 C ATOM 1899 CG2 ILE A 119 9.925 -3.025 -2.573 1.00 0.00 C ATOM 1900 CD1 ILE A 119 9.222 -5.900 -1.632 1.00 0.00 C ATOM 0 H ILE A 119 10.606 -5.932 -5.328 1.00 0.00 H new ATOM 0 HA ILE A 119 9.072 -3.465 -5.107 1.00 0.00 H new ATOM 0 HB ILE A 119 11.083 -4.708 -3.186 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.054 -4.873 -3.092 1.00 0.00 H new ATOM 0 HG13 ILE A 119 9.068 -6.144 -3.745 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.985 -3.271 -1.513 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.712 -2.315 -2.825 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.953 -2.581 -2.788 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.437 -6.629 -1.433 1.00 0.00 H new ATOM 0 HD12 ILE A 119 10.195 -6.386 -1.562 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.165 -5.096 -0.898 1.00 0.00 H new ATOM 1912 N VAL A 120 12.316 -3.631 -5.598 1.00 0.00 N ATOM 1913 CA VAL A 120 13.494 -2.859 -5.976 1.00 0.00 C ATOM 1914 C VAL A 120 13.376 -2.339 -7.404 1.00 0.00 C ATOM 1915 O VAL A 120 13.999 -1.341 -7.766 1.00 0.00 O ATOM 1916 CB VAL A 120 14.779 -3.700 -5.852 1.00 0.00 C ATOM 1917 CG1 VAL A 120 14.809 -4.436 -4.522 1.00 0.00 C ATOM 1918 CG2 VAL A 120 14.891 -4.676 -7.014 1.00 0.00 C ATOM 0 H VAL A 120 12.453 -4.642 -5.607 1.00 0.00 H new ATOM 0 HA VAL A 120 13.553 -2.015 -5.289 1.00 0.00 H new ATOM 0 HB VAL A 120 15.637 -3.029 -5.888 1.00 0.00 H new ATOM 0 HG11 VAL A 120 15.724 -5.025 -4.452 1.00 0.00 H new ATOM 0 HG12 VAL A 120 14.779 -3.714 -3.706 1.00 0.00 H new ATOM 0 HG13 VAL A 120 13.946 -5.098 -4.453 1.00 0.00 H new ATOM 0 HG21 VAL A 120 15.804 -5.262 -6.910 1.00 0.00 H new ATOM 0 HG22 VAL A 120 14.029 -5.344 -7.013 1.00 0.00 H new ATOM 0 HG23 VAL A 120 14.920 -4.123 -7.953 1.00 0.00 H new ATOM 1928 N ARG A 121 12.572 -3.022 -8.212 1.00 0.00 N ATOM 1929 CA ARG A 121 12.372 -2.630 -9.602 1.00 0.00 C ATOM 1930 C ARG A 121 11.595 -1.320 -9.690 1.00 0.00 C ATOM 1931 O ARG A 121 11.803 -0.523 -10.606 1.00 0.00 O ATOM 1932 CB ARG A 121 11.628 -3.729 -10.363 1.00 0.00 C ATOM 1933 CG ARG A 121 10.146 -3.801 -10.034 1.00 0.00 C ATOM 1934 CD ARG A 121 9.402 -4.703 -11.007 1.00 0.00 C ATOM 1935 NE ARG A 121 10.034 -4.727 -12.323 1.00 0.00 N ATOM 1936 CZ ARG A 121 11.060 -5.513 -12.632 1.00 0.00 C ATOM 1937 NH1 ARG A 121 11.566 -6.335 -11.723 1.00 0.00 N ATOM 1938 NH2 ARG A 121 11.581 -5.477 -13.852 1.00 0.00 N ATOM 0 H ARG A 121 12.048 -3.850 -7.928 1.00 0.00 H new ATOM 0 HA ARG A 121 13.352 -2.483 -10.057 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.746 -3.562 -11.434 1.00 0.00 H new ATOM 0 HB3 ARG A 121 12.089 -4.691 -10.138 1.00 0.00 H new ATOM 0 HG2 ARG A 121 10.015 -4.174 -9.018 1.00 0.00 H new ATOM 0 HG3 ARG A 121 9.717 -2.800 -10.064 1.00 0.00 H new ATOM 0 HD2 ARG A 121 9.363 -5.715 -10.605 1.00 0.00 H new ATOM 0 HD3 ARG A 121 8.372 -4.359 -11.105 1.00 0.00 H new ATOM 0 HE ARG A 121 9.668 -4.106 -13.045 1.00 0.00 H new ATOM 0 HH11 ARG A 121 11.168 -6.365 -10.784 1.00 0.00 H new ATOM 0 HH12 ARG A 121 12.354 -6.937 -11.962 1.00 0.00 H new ATOM 0 HH21 ARG A 121 11.194 -4.846 -14.553 1.00 0.00 H new ATOM 0 HH22 ARG A 121 12.369 -6.081 -14.088 1.00 0.00 H new ATOM 1952 N VAL A 122 10.698 -1.104 -8.733 1.00 0.00 N ATOM 1953 CA VAL A 122 9.890 0.109 -8.702 1.00 0.00 C ATOM 1954 C VAL A 122 10.748 1.334 -8.408 1.00 0.00 C ATOM 1955 O VAL A 122 10.569 2.392 -9.012 1.00 0.00 O ATOM 1956 CB VAL A 122 8.773 0.013 -7.646 1.00 0.00 C ATOM 1957 CG1 VAL A 122 7.830 1.202 -7.756 1.00 0.00 C ATOM 1958 CG2 VAL A 122 8.012 -1.296 -7.794 1.00 0.00 C ATOM 0 H VAL A 122 10.513 -1.754 -7.969 1.00 0.00 H new ATOM 0 HA VAL A 122 9.439 0.213 -9.689 1.00 0.00 H new ATOM 0 HB VAL A 122 9.230 0.032 -6.656 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.047 1.117 -7.002 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.388 2.125 -7.597 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.378 1.217 -8.748 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.226 -1.347 -7.040 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.566 -1.347 -8.787 1.00 0.00 H new ATOM 0 HG23 VAL A 122 8.698 -2.133 -7.661 1.00 0.00 H new ATOM 1968 N LEU A 123 11.683 1.184 -7.476 1.00 0.00 N ATOM 1969 CA LEU A 123 12.572 2.279 -7.100 1.00 0.00 C ATOM 1970 C LEU A 123 13.373 2.766 -8.303 1.00 0.00 C ATOM 1971 O LEU A 123 13.548 3.968 -8.499 1.00 0.00 O ATOM 1972 CB LEU A 123 13.521 1.832 -5.987 1.00 0.00 C ATOM 1973 CG LEU A 123 12.862 1.398 -4.677 1.00 0.00 C ATOM 1974 CD1 LEU A 123 13.917 0.995 -3.658 1.00 0.00 C ATOM 1975 CD2 LEU A 123 11.985 2.513 -4.127 1.00 0.00 C ATOM 0 H LEU A 123 11.845 0.315 -6.967 1.00 0.00 H new ATOM 0 HA LEU A 123 11.960 3.104 -6.736 1.00 0.00 H new ATOM 0 HB2 LEU A 123 14.122 1.003 -6.360 1.00 0.00 H new ATOM 0 HB3 LEU A 123 14.207 2.651 -5.771 1.00 0.00 H new ATOM 0 HG LEU A 123 12.231 0.532 -4.878 1.00 0.00 H new ATOM 0 HD11 LEU A 123 13.430 0.689 -2.732 1.00 0.00 H new ATOM 0 HD12 LEU A 123 14.504 0.165 -4.051 1.00 0.00 H new ATOM 0 HD13 LEU A 123 14.574 1.842 -3.460 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.524 2.187 -3.195 1.00 0.00 H new ATOM 0 HD22 LEU A 123 12.595 3.397 -3.941 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.207 2.755 -4.851 1.00 0.00 H new ATOM 1987 N ASN A 124 13.856 1.824 -9.107 1.00 0.00 N ATOM 1988 CA ASN A 124 14.638 2.158 -10.292 1.00 0.00 C ATOM 1989 C ASN A 124 13.808 2.972 -11.280 1.00 0.00 C ATOM 1990 O ASN A 124 14.326 3.857 -11.962 1.00 0.00 O ATOM 1991 CB ASN A 124 15.149 0.884 -10.967 1.00 0.00 C ATOM 1992 CG ASN A 124 16.435 0.375 -10.343 1.00 0.00 C ATOM 1993 OD1 ASN A 124 17.528 0.811 -10.704 1.00 0.00 O ATOM 1994 ND2 ASN A 124 16.308 -0.553 -9.402 1.00 0.00 N ATOM 0 H ASN A 124 13.720 0.824 -8.960 1.00 0.00 H new ATOM 0 HA ASN A 124 15.489 2.761 -9.977 1.00 0.00 H new ATOM 0 HB2 ASN A 124 14.385 0.109 -10.901 1.00 0.00 H new ATOM 0 HB3 ASN A 124 15.315 1.079 -12.027 1.00 0.00 H new ATOM 0 HD21 ASN A 124 17.137 -0.934 -8.946 1.00 0.00 H new ATOM 0 HD22 ASN A 124 15.381 -0.885 -9.135 1.00 0.00 H new ATOM 2001 N LEU A 125 12.517 2.668 -11.350 1.00 0.00 N ATOM 2002 CA LEU A 125 11.613 3.372 -12.254 1.00 0.00 C ATOM 2003 C LEU A 125 11.262 4.752 -11.707 1.00 0.00 C ATOM 2004 O LEU A 125 11.176 5.724 -12.458 1.00 0.00 O ATOM 2005 CB LEU A 125 10.338 2.556 -12.469 1.00 0.00 C ATOM 2006 CG LEU A 125 10.436 1.409 -13.476 1.00 0.00 C ATOM 2007 CD1 LEU A 125 9.398 0.340 -13.170 1.00 0.00 C ATOM 2008 CD2 LEU A 125 10.265 1.930 -14.896 1.00 0.00 C ATOM 0 H LEU A 125 12.072 1.939 -10.792 1.00 0.00 H new ATOM 0 HA LEU A 125 12.121 3.499 -13.210 1.00 0.00 H new ATOM 0 HB2 LEU A 125 10.028 2.144 -11.509 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.548 3.233 -12.795 1.00 0.00 H new ATOM 0 HG LEU A 125 11.426 0.960 -13.392 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.483 -0.468 -13.897 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.566 -0.054 -12.168 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.400 0.775 -13.226 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.338 1.100 -15.599 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.289 2.405 -14.994 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.046 2.659 -15.113 1.00 0.00 H new ATOM 2020 N TRP A 126 11.062 4.829 -10.397 1.00 0.00 N ATOM 2021 CA TRP A 126 10.722 6.091 -9.749 1.00 0.00 C ATOM 2022 C TRP A 126 11.818 7.129 -9.970 1.00 0.00 C ATOM 2023 O TRP A 126 11.554 8.229 -10.452 1.00 0.00 O ATOM 2024 CB TRP A 126 10.501 5.876 -8.251 1.00 0.00 C ATOM 2025 CG TRP A 126 9.142 5.335 -7.924 1.00 0.00 C ATOM 2026 CD1 TRP A 126 8.104 5.145 -8.791 1.00 0.00 C ATOM 2027 CD2 TRP A 126 8.674 4.914 -6.638 1.00 0.00 C ATOM 2028 NE1 TRP A 126 7.019 4.633 -8.121 1.00 0.00 N ATOM 2029 CE2 TRP A 126 7.343 4.481 -6.799 1.00 0.00 C ATOM 2030 CE3 TRP A 126 9.250 4.860 -5.365 1.00 0.00 C ATOM 2031 CZ2 TRP A 126 6.582 4.002 -5.736 1.00 0.00 C ATOM 2032 CZ3 TRP A 126 8.493 4.385 -4.311 1.00 0.00 C ATOM 2033 CH2 TRP A 126 7.172 3.960 -4.502 1.00 0.00 C ATOM 0 H TRP A 126 11.129 4.033 -9.762 1.00 0.00 H new ATOM 0 HA TRP A 126 9.800 6.463 -10.195 1.00 0.00 H new ATOM 0 HB2 TRP A 126 11.258 5.189 -7.874 1.00 0.00 H new ATOM 0 HB3 TRP A 126 10.642 6.823 -7.730 1.00 0.00 H new ATOM 0 HD1 TRP A 126 8.132 5.365 -9.848 1.00 0.00 H new ATOM 0 HE1 TRP A 126 6.118 4.403 -8.540 1.00 0.00 H new ATOM 0 HE3 TRP A 126 10.268 5.184 -5.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 5.563 3.675 -5.880 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 8.927 4.341 -3.323 1.00 0.00 H new ATOM 0 HH2 TRP A 126 6.608 3.592 -3.658 1.00 0.00 H new ATOM 2044 N GLN A 127 13.047 6.770 -9.614 1.00 0.00 N ATOM 2045 CA GLN A 127 14.182 7.671 -9.773 1.00 0.00 C ATOM 2046 C GLN A 127 14.323 8.118 -11.224 1.00 0.00 C ATOM 2047 O GLN A 127 14.842 9.198 -11.505 1.00 0.00 O ATOM 2048 CB GLN A 127 15.471 6.990 -9.309 1.00 0.00 C ATOM 2049 CG GLN A 127 16.503 7.956 -8.750 1.00 0.00 C ATOM 2050 CD GLN A 127 17.902 7.373 -8.739 1.00 0.00 C ATOM 2051 OE1 GLN A 127 18.498 7.138 -9.790 1.00 0.00 O ATOM 2052 NE2 GLN A 127 18.435 7.137 -7.546 1.00 0.00 N ATOM 0 H GLN A 127 13.282 5.862 -9.214 1.00 0.00 H new ATOM 0 HA GLN A 127 14.003 8.552 -9.156 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.227 6.251 -8.546 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.909 6.449 -10.148 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.499 8.870 -9.344 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.222 8.235 -7.735 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.905 7.347 -6.700 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.374 6.746 -7.475 1.00 0.00 H new ATOM 2061 N LYS A 128 13.858 7.279 -12.144 1.00 0.00 N ATOM 2062 CA LYS A 128 13.931 7.586 -13.568 1.00 0.00 C ATOM 2063 C LYS A 128 12.826 8.556 -13.972 1.00 0.00 C ATOM 2064 O LYS A 128 13.093 9.617 -14.534 1.00 0.00 O ATOM 2065 CB LYS A 128 13.825 6.302 -14.394 1.00 0.00 C ATOM 2066 CG LYS A 128 13.254 6.519 -15.784 1.00 0.00 C ATOM 2067 CD LYS A 128 13.226 5.227 -16.583 1.00 0.00 C ATOM 2068 CE LYS A 128 13.001 5.492 -18.064 1.00 0.00 C ATOM 2069 NZ LYS A 128 14.119 6.272 -18.664 1.00 0.00 N ATOM 0 H LYS A 128 13.426 6.380 -11.929 1.00 0.00 H new ATOM 0 HA LYS A 128 14.894 8.058 -13.764 1.00 0.00 H new ATOM 0 HB2 LYS A 128 14.815 5.854 -14.483 1.00 0.00 H new ATOM 0 HB3 LYS A 128 13.198 5.587 -13.860 1.00 0.00 H new ATOM 0 HG2 LYS A 128 12.244 6.921 -15.705 1.00 0.00 H new ATOM 0 HG3 LYS A 128 13.852 7.262 -16.312 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.167 4.693 -16.447 1.00 0.00 H new ATOM 0 HD3 LYS A 128 12.435 4.580 -16.204 1.00 0.00 H new ATOM 0 HE2 LYS A 128 12.896 4.544 -18.591 1.00 0.00 H new ATOM 0 HE3 LYS A 128 12.066 6.036 -18.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 14.135 6.121 -19.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 13.983 7.284 -18.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 15.021 5.957 -18.254 1.00 0.00 H new ATOM 2083 N ASN A 129 11.583 8.185 -13.681 1.00 0.00 N ATOM 2084 CA ASN A 129 10.437 9.023 -14.014 1.00 0.00 C ATOM 2085 C ASN A 129 10.436 10.299 -13.178 1.00 0.00 C ATOM 2086 O ASN A 129 9.625 11.198 -13.400 1.00 0.00 O ATOM 2087 CB ASN A 129 9.134 8.253 -13.792 1.00 0.00 C ATOM 2088 CG ASN A 129 8.820 7.306 -14.934 1.00 0.00 C ATOM 2089 OD1 ASN A 129 8.105 7.662 -15.871 1.00 0.00 O ATOM 2090 ND2 ASN A 129 9.354 6.093 -14.861 1.00 0.00 N ATOM 0 H ASN A 129 11.344 7.310 -13.215 1.00 0.00 H new ATOM 0 HA ASN A 129 10.513 9.299 -15.066 1.00 0.00 H new ATOM 0 HB2 ASN A 129 9.203 7.687 -12.863 1.00 0.00 H new ATOM 0 HB3 ASN A 129 8.313 8.960 -13.674 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.178 5.413 -15.600 1.00 0.00 H new ATOM 0 HD22 ASN A 129 9.941 5.841 -14.066 1.00 0.00 H new ATOM 2097 N ASN A 130 11.350 10.371 -12.216 1.00 0.00 N ATOM 2098 CA ASN A 130 11.454 11.537 -11.346 1.00 0.00 C ATOM 2099 C ASN A 130 10.310 11.567 -10.337 1.00 0.00 C ATOM 2100 O ASN A 130 9.911 12.633 -9.866 1.00 0.00 O ATOM 2101 CB ASN A 130 11.450 12.821 -12.178 1.00 0.00 C ATOM 2102 CG ASN A 130 12.147 12.648 -13.513 1.00 0.00 C ATOM 2103 OD1 ASN A 130 13.120 11.903 -13.626 1.00 0.00 O ATOM 2104 ND2 ASN A 130 11.649 13.337 -14.534 1.00 0.00 N ATOM 0 H ASN A 130 12.029 9.636 -12.019 1.00 0.00 H new ATOM 0 HA ASN A 130 12.394 11.469 -10.799 1.00 0.00 H new ATOM 0 HB2 ASN A 130 10.421 13.138 -12.347 1.00 0.00 H new ATOM 0 HB3 ASN A 130 11.940 13.616 -11.616 1.00 0.00 H new ATOM 0 HD21 ASN A 130 12.075 13.260 -15.457 1.00 0.00 H new ATOM 0 HD22 ASN A 130 10.840 13.943 -14.394 1.00 0.00 H new ATOM 2111 N VAL A 131 9.787 10.390 -10.009 1.00 0.00 N ATOM 2112 CA VAL A 131 8.690 10.281 -9.054 1.00 0.00 C ATOM 2113 C VAL A 131 9.144 10.659 -7.649 1.00 0.00 C ATOM 2114 O VAL A 131 8.412 11.308 -6.902 1.00 0.00 O ATOM 2115 CB VAL A 131 8.109 8.855 -9.028 1.00 0.00 C ATOM 2116 CG1 VAL A 131 6.784 8.832 -8.281 1.00 0.00 C ATOM 2117 CG2 VAL A 131 7.942 8.322 -10.443 1.00 0.00 C ATOM 0 H VAL A 131 10.105 9.499 -10.390 1.00 0.00 H new ATOM 0 HA VAL A 131 7.916 10.975 -9.381 1.00 0.00 H new ATOM 0 HB VAL A 131 8.808 8.206 -8.500 1.00 0.00 H new ATOM 0 HG11 VAL A 131 6.388 7.816 -8.273 1.00 0.00 H new ATOM 0 HG12 VAL A 131 6.938 9.170 -7.256 1.00 0.00 H new ATOM 0 HG13 VAL A 131 6.075 9.494 -8.778 1.00 0.00 H new ATOM 0 HG21 VAL A 131 7.530 7.313 -10.406 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.264 8.970 -10.998 1.00 0.00 H new ATOM 0 HG23 VAL A 131 8.912 8.300 -10.940 1.00 0.00 H new ATOM 2127 N PHE A 132 10.358 10.249 -7.296 1.00 0.00 N ATOM 2128 CA PHE A 132 10.911 10.544 -5.979 1.00 0.00 C ATOM 2129 C PHE A 132 12.370 10.979 -6.087 1.00 0.00 C ATOM 2130 O PHE A 132 13.070 10.614 -7.032 1.00 0.00 O ATOM 2131 CB PHE A 132 10.798 9.320 -5.069 1.00 0.00 C ATOM 2132 CG PHE A 132 9.386 8.999 -4.668 1.00 0.00 C ATOM 2133 CD1 PHE A 132 8.608 8.154 -5.442 1.00 0.00 C ATOM 2134 CD2 PHE A 132 8.838 9.543 -3.518 1.00 0.00 C ATOM 2135 CE1 PHE A 132 7.308 7.858 -5.076 1.00 0.00 C ATOM 2136 CE2 PHE A 132 7.539 9.250 -3.147 1.00 0.00 C ATOM 2137 CZ PHE A 132 6.774 8.406 -3.927 1.00 0.00 C ATOM 0 H PHE A 132 10.977 9.712 -7.903 1.00 0.00 H new ATOM 0 HA PHE A 132 10.337 11.363 -5.547 1.00 0.00 H new ATOM 0 HB2 PHE A 132 11.227 8.457 -5.579 1.00 0.00 H new ATOM 0 HB3 PHE A 132 11.393 9.489 -4.171 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.021 7.722 -6.341 1.00 0.00 H new ATOM 0 HD2 PHE A 132 9.432 10.204 -2.904 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.711 7.199 -5.688 1.00 0.00 H new ATOM 0 HE2 PHE A 132 7.123 9.681 -2.248 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.759 8.175 -3.639 1.00 0.00 H new ATOM 2147 N LYS A 133 12.822 11.761 -5.112 1.00 0.00 N ATOM 2148 CA LYS A 133 14.197 12.245 -5.095 1.00 0.00 C ATOM 2149 C LYS A 133 15.167 11.119 -4.752 1.00 0.00 C ATOM 2150 O LYS A 133 14.841 10.222 -3.975 1.00 0.00 O ATOM 2151 CB LYS A 133 14.345 13.385 -4.085 1.00 0.00 C ATOM 2152 CG LYS A 133 14.518 12.910 -2.653 1.00 0.00 C ATOM 2153 CD LYS A 133 14.551 14.076 -1.679 1.00 0.00 C ATOM 2154 CE LYS A 133 13.420 15.058 -1.944 1.00 0.00 C ATOM 2155 NZ LYS A 133 13.003 15.771 -0.706 1.00 0.00 N ATOM 0 H LYS A 133 12.256 12.073 -4.323 1.00 0.00 H new ATOM 0 HA LYS A 133 14.437 12.616 -6.091 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.204 13.996 -4.363 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.466 14.027 -4.142 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.701 12.238 -2.390 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.441 12.337 -2.568 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.476 13.701 -0.658 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.508 14.592 -1.760 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.738 15.785 -2.692 1.00 0.00 H new ATOM 0 HE3 LYS A 133 12.566 14.524 -2.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 12.231 16.431 -0.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 12.676 15.080 -0.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 13.811 16.301 -0.322 1.00 0.00 H new ATOM 2169 N SER A 134 16.360 11.174 -5.335 1.00 0.00 N ATOM 2170 CA SER A 134 17.377 10.157 -5.092 1.00 0.00 C ATOM 2171 C SER A 134 17.710 10.065 -3.606 1.00 0.00 C ATOM 2172 O SER A 134 18.105 9.010 -3.112 1.00 0.00 O ATOM 2173 CB SER A 134 18.643 10.470 -5.892 1.00 0.00 C ATOM 2174 OG SER A 134 19.189 11.721 -5.513 1.00 0.00 O ATOM 0 H SER A 134 16.646 11.912 -5.979 1.00 0.00 H new ATOM 0 HA SER A 134 16.979 9.196 -5.417 1.00 0.00 H new ATOM 0 HB2 SER A 134 19.381 9.684 -5.733 1.00 0.00 H new ATOM 0 HB3 SER A 134 18.411 10.478 -6.957 1.00 0.00 H new ATOM 0 HG SER A 134 19.998 11.897 -6.037 1.00 0.00 H new ATOM 2180 N GLU A 135 17.547 11.180 -2.900 1.00 0.00 N ATOM 2181 CA GLU A 135 17.832 11.226 -1.470 1.00 0.00 C ATOM 2182 C GLU A 135 16.811 10.406 -0.686 1.00 0.00 C ATOM 2183 O GLU A 135 17.025 10.084 0.483 1.00 0.00 O ATOM 2184 CB GLU A 135 17.830 12.673 -0.974 1.00 0.00 C ATOM 2185 CG GLU A 135 17.426 12.816 0.484 1.00 0.00 C ATOM 2186 CD GLU A 135 18.345 12.057 1.421 1.00 0.00 C ATOM 2187 OE1 GLU A 135 19.529 11.870 1.070 1.00 0.00 O ATOM 2188 OE2 GLU A 135 17.880 11.649 2.506 1.00 0.00 O ATOM 0 H GLU A 135 17.220 12.062 -3.294 1.00 0.00 H new ATOM 0 HA GLU A 135 18.820 10.795 -1.308 1.00 0.00 H new ATOM 0 HB2 GLU A 135 18.825 13.096 -1.110 1.00 0.00 H new ATOM 0 HB3 GLU A 135 17.148 13.259 -1.590 1.00 0.00 H new ATOM 0 HG2 GLU A 135 17.428 13.872 0.756 1.00 0.00 H new ATOM 0 HG3 GLU A 135 16.405 12.456 0.611 1.00 0.00 H new ATOM 2195 N ILE A 136 15.703 10.073 -1.338 1.00 0.00 N ATOM 2196 CA ILE A 136 14.650 9.290 -0.702 1.00 0.00 C ATOM 2197 C ILE A 136 14.685 7.839 -1.169 1.00 0.00 C ATOM 2198 O ILE A 136 14.445 6.919 -0.386 1.00 0.00 O ATOM 2199 CB ILE A 136 13.257 9.878 -0.995 1.00 0.00 C ATOM 2200 CG1 ILE A 136 13.043 11.165 -0.195 1.00 0.00 C ATOM 2201 CG2 ILE A 136 12.173 8.860 -0.671 1.00 0.00 C ATOM 2202 CD1 ILE A 136 11.949 12.048 -0.751 1.00 0.00 C ATOM 0 H ILE A 136 15.511 10.333 -2.305 1.00 0.00 H new ATOM 0 HA ILE A 136 14.834 9.328 0.372 1.00 0.00 H new ATOM 0 HB ILE A 136 13.197 10.118 -2.056 1.00 0.00 H new ATOM 0 HG12 ILE A 136 12.801 10.906 0.836 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.976 11.728 -0.172 1.00 0.00 H new ATOM 0 HG21 ILE A 136 11.194 9.291 -0.883 1.00 0.00 H new ATOM 0 HG22 ILE A 136 12.317 7.968 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE A 136 12.230 8.591 0.384 1.00 0.00 H new ATOM 0 HD11 ILE A 136 11.854 12.941 -0.134 1.00 0.00 H new ATOM 0 HD12 ILE A 136 12.198 12.337 -1.772 1.00 0.00 H new ATOM 0 HD13 ILE A 136 11.005 11.503 -0.749 1.00 0.00 H new ATOM 2214 N ILE A 137 14.988 7.642 -2.447 1.00 0.00 N ATOM 2215 CA ILE A 137 15.057 6.302 -3.018 1.00 0.00 C ATOM 2216 C ILE A 137 16.393 5.638 -2.699 1.00 0.00 C ATOM 2217 O ILE A 137 16.455 4.434 -2.454 1.00 0.00 O ATOM 2218 CB ILE A 137 14.862 6.329 -4.545 1.00 0.00 C ATOM 2219 CG1 ILE A 137 13.548 7.029 -4.901 1.00 0.00 C ATOM 2220 CG2 ILE A 137 14.885 4.916 -5.107 1.00 0.00 C ATOM 2221 CD1 ILE A 137 13.049 6.705 -6.291 1.00 0.00 C ATOM 0 H ILE A 137 15.190 8.393 -3.107 1.00 0.00 H new ATOM 0 HA ILE A 137 14.249 5.725 -2.568 1.00 0.00 H new ATOM 0 HB ILE A 137 15.683 6.890 -4.992 1.00 0.00 H new ATOM 0 HG12 ILE A 137 12.786 6.745 -4.175 1.00 0.00 H new ATOM 0 HG13 ILE A 137 13.685 8.107 -4.815 1.00 0.00 H new ATOM 0 HG21 ILE A 137 14.746 4.952 -6.187 1.00 0.00 H new ATOM 0 HG22 ILE A 137 15.844 4.450 -4.880 1.00 0.00 H new ATOM 0 HG23 ILE A 137 14.082 4.332 -4.657 1.00 0.00 H new ATOM 0 HD11 ILE A 137 12.115 7.235 -6.475 1.00 0.00 H new ATOM 0 HD12 ILE A 137 13.792 7.014 -7.026 1.00 0.00 H new ATOM 0 HD13 ILE A 137 12.880 5.632 -6.376 1.00 0.00 H new ATOM 2233 N GLN A 138 17.458 6.433 -2.703 1.00 0.00 N ATOM 2234 CA GLN A 138 18.793 5.921 -2.413 1.00 0.00 C ATOM 2235 C GLN A 138 18.745 4.870 -1.309 1.00 0.00 C ATOM 2236 O GLN A 138 19.233 3.750 -1.463 1.00 0.00 O ATOM 2237 CB GLN A 138 19.722 7.065 -2.004 1.00 0.00 C ATOM 2238 CG GLN A 138 20.882 6.623 -1.126 1.00 0.00 C ATOM 2239 CD GLN A 138 21.903 5.796 -1.881 1.00 0.00 C ATOM 2240 OE1 GLN A 138 22.833 6.334 -2.483 1.00 0.00 O ATOM 2241 NE2 GLN A 138 21.736 4.479 -1.853 1.00 0.00 N ATOM 0 H GLN A 138 17.423 7.433 -2.903 1.00 0.00 H new ATOM 0 HA GLN A 138 19.180 5.453 -3.318 1.00 0.00 H new ATOM 0 HB2 GLN A 138 20.117 7.540 -2.902 1.00 0.00 H new ATOM 0 HB3 GLN A 138 19.143 7.820 -1.473 1.00 0.00 H new ATOM 0 HG2 GLN A 138 21.371 7.502 -0.707 1.00 0.00 H new ATOM 0 HG3 GLN A 138 20.497 6.042 -0.288 1.00 0.00 H new ATOM 0 HE21 GLN A 138 20.951 4.075 -1.342 1.00 0.00 H new ATOM 0 HE22 GLN A 138 22.393 3.871 -2.343 1.00 0.00 H new ATOM 2250 N PRO A 139 18.143 5.236 -0.168 1.00 0.00 N ATOM 2251 CA PRO A 139 18.017 4.338 0.984 1.00 0.00 C ATOM 2252 C PRO A 139 17.044 3.194 0.724 1.00 0.00 C ATOM 2253 O PRO A 139 17.290 2.054 1.118 1.00 0.00 O ATOM 2254 CB PRO A 139 17.484 5.253 2.090 1.00 0.00 C ATOM 2255 CG PRO A 139 16.781 6.350 1.368 1.00 0.00 C ATOM 2256 CD PRO A 139 17.539 6.555 0.086 1.00 0.00 C ATOM 0 HA PRO A 139 18.963 3.855 1.230 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.805 4.718 2.754 1.00 0.00 H new ATOM 0 HB3 PRO A 139 18.294 5.641 2.708 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.743 6.084 1.169 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.767 7.263 1.963 1.00 0.00 H new ATOM 0 HD2 PRO A 139 16.879 6.858 -0.727 1.00 0.00 H new ATOM 0 HD3 PRO A 139 18.297 7.331 0.187 1.00 0.00 H new ATOM 2264 N LEU A 140 15.937 3.505 0.058 1.00 0.00 N ATOM 2265 CA LEU A 140 14.926 2.502 -0.256 1.00 0.00 C ATOM 2266 C LEU A 140 15.519 1.374 -1.094 1.00 0.00 C ATOM 2267 O LEU A 140 15.059 0.233 -1.033 1.00 0.00 O ATOM 2268 CB LEU A 140 13.756 3.146 -1.003 1.00 0.00 C ATOM 2269 CG LEU A 140 12.940 4.172 -0.215 1.00 0.00 C ATOM 2270 CD1 LEU A 140 11.871 4.795 -1.099 1.00 0.00 C ATOM 2271 CD2 LEU A 140 12.312 3.527 1.011 1.00 0.00 C ATOM 0 H LEU A 140 15.717 4.444 -0.275 1.00 0.00 H new ATOM 0 HA LEU A 140 14.564 2.081 0.682 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.145 3.631 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 140 13.084 2.355 -1.336 1.00 0.00 H new ATOM 0 HG LEU A 140 13.612 4.962 0.120 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.300 5.522 -0.522 1.00 0.00 H new ATOM 0 HD12 LEU A 140 12.344 5.294 -1.945 1.00 0.00 H new ATOM 0 HD13 LEU A 140 11.202 4.016 -1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.735 4.272 1.559 1.00 0.00 H new ATOM 0 HD22 LEU A 140 11.654 2.716 0.699 1.00 0.00 H new ATOM 0 HD23 LEU A 140 13.096 3.130 1.655 1.00 0.00 H new ATOM 2283 N LEU A 141 16.544 1.699 -1.874 1.00 0.00 N ATOM 2284 CA LEU A 141 17.203 0.713 -2.722 1.00 0.00 C ATOM 2285 C LEU A 141 18.031 -0.259 -1.886 1.00 0.00 C ATOM 2286 O LEU A 141 18.184 -1.426 -2.245 1.00 0.00 O ATOM 2287 CB LEU A 141 18.098 1.410 -3.749 1.00 0.00 C ATOM 2288 CG LEU A 141 17.389 1.985 -4.975 1.00 0.00 C ATOM 2289 CD1 LEU A 141 18.279 2.996 -5.681 1.00 0.00 C ATOM 2290 CD2 LEU A 141 16.984 0.871 -5.929 1.00 0.00 C ATOM 0 H LEU A 141 16.937 2.638 -1.937 1.00 0.00 H new ATOM 0 HA LEU A 141 16.432 0.148 -3.245 1.00 0.00 H new ATOM 0 HB2 LEU A 141 18.629 2.219 -3.248 1.00 0.00 H new ATOM 0 HB3 LEU A 141 18.850 0.698 -4.089 1.00 0.00 H new ATOM 0 HG LEU A 141 16.486 2.497 -4.642 1.00 0.00 H new ATOM 0 HD11 LEU A 141 17.758 3.395 -6.551 1.00 0.00 H new ATOM 0 HD12 LEU A 141 18.518 3.810 -4.997 1.00 0.00 H new ATOM 0 HD13 LEU A 141 19.200 2.509 -6.002 1.00 0.00 H new ATOM 0 HD21 LEU A 141 16.481 1.299 -6.796 1.00 0.00 H new ATOM 0 HD22 LEU A 141 17.873 0.331 -6.256 1.00 0.00 H new ATOM 0 HD23 LEU A 141 16.308 0.184 -5.420 1.00 0.00 H new ATOM 2302 N ASP A 142 18.560 0.231 -0.771 1.00 0.00 N ATOM 2303 CA ASP A 142 19.369 -0.594 0.118 1.00 0.00 C ATOM 2304 C ASP A 142 18.485 -1.449 1.020 1.00 0.00 C ATOM 2305 O ASP A 142 18.696 -2.655 1.150 1.00 0.00 O ATOM 2306 CB ASP A 142 20.288 0.285 0.969 1.00 0.00 C ATOM 2307 CG ASP A 142 21.575 -0.421 1.349 1.00 0.00 C ATOM 2308 OD1 ASP A 142 22.260 -0.935 0.441 1.00 0.00 O ATOM 2309 OD2 ASP A 142 21.895 -0.461 2.556 1.00 0.00 O ATOM 0 H ASP A 142 18.443 1.196 -0.461 1.00 0.00 H new ATOM 0 HA ASP A 142 19.979 -1.256 -0.496 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.525 1.196 0.420 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.761 0.587 1.874 1.00 0.00 H new ATOM 2314 N MET A 143 17.495 -0.817 1.642 1.00 0.00 N ATOM 2315 CA MET A 143 16.579 -1.521 2.532 1.00 0.00 C ATOM 2316 C MET A 143 16.279 -2.921 2.007 1.00 0.00 C ATOM 2317 O MET A 143 16.141 -3.868 2.780 1.00 0.00 O ATOM 2318 CB MET A 143 15.278 -0.732 2.687 1.00 0.00 C ATOM 2319 CG MET A 143 15.484 0.689 3.186 1.00 0.00 C ATOM 2320 SD MET A 143 14.104 1.283 4.184 1.00 0.00 S ATOM 2321 CE MET A 143 12.720 0.879 3.121 1.00 0.00 C ATOM 0 H MET A 143 17.307 0.181 1.546 1.00 0.00 H new ATOM 0 HA MET A 143 17.058 -1.613 3.507 1.00 0.00 H new ATOM 0 HB2 MET A 143 14.766 -0.700 1.725 1.00 0.00 H new ATOM 0 HB3 MET A 143 14.623 -1.260 3.380 1.00 0.00 H new ATOM 0 HG2 MET A 143 16.399 0.733 3.776 1.00 0.00 H new ATOM 0 HG3 MET A 143 15.622 1.353 2.333 1.00 0.00 H new ATOM 0 HE1 MET A 143 11.936 1.626 3.245 1.00 0.00 H new ATOM 0 HE2 MET A 143 13.050 0.869 2.082 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.331 -0.104 3.388 1.00 0.00 H new ATOM 2331 N ALA A 144 16.179 -3.044 0.687 1.00 0.00 N ATOM 2332 CA ALA A 144 15.897 -4.329 0.059 1.00 0.00 C ATOM 2333 C ALA A 144 17.058 -5.299 0.247 1.00 0.00 C ATOM 2334 O ALA A 144 16.856 -6.467 0.579 1.00 0.00 O ATOM 2335 CB ALA A 144 15.600 -4.139 -1.421 1.00 0.00 C ATOM 0 H ALA A 144 16.289 -2.270 0.032 1.00 0.00 H new ATOM 0 HA ALA A 144 15.019 -4.757 0.543 1.00 0.00 H new ATOM 0 HB1 ALA A 144 15.391 -5.107 -1.877 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.733 -3.488 -1.538 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.462 -3.686 -1.910 1.00 0.00 H new