USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 864 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 Single : A 1 GLY N :NH3+ -97:sc= 0.0676 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.774 K(o=-0.77,f=-2.7!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 154:sc= -0.214 (180deg=-0.83) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.0648 X(o=-0.065,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.201 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 22:sc= 0.689 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 67:sc= 0.705 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 40:sc= 0.35 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc=-0.00324 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -4.24! C(o=-4.2!,f=-6.1!) USER MOD Single : A 66 TYR OH : rot 180:sc= -0.209 USER MOD Single : A 67 ASN : amide:sc= -1.3 X(o=-1.3,f=-1) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 GLN : amide:sc= -0.0368 K(o=-0.037,f=-2.1!) USER MOD Single : A 89 THR OG1 : rot -100:sc= 0.595 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ -155:sc= -0.415 (180deg=-1.18) USER MOD Single : A 101 HIS : no HD1:sc= -0.0097 X(o=-0.0097,f=-0.0097) USER MOD Single : A 102 LYS NZ :NH3+ -152:sc= -0.126 (180deg=-0.686) USER MOD Single : A 103 MET CE :methyl -166:sc= 0 (180deg=-0.238) USER MOD Single : A 105 GLN : amide:sc=-0.00685 K(o=-0.0068,f=-0.97) USER MOD Single : A 110 LYS NZ :NH3+ -163:sc= 0.0276 (180deg=0.0019) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 116 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.0437) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0.0435 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.508 2.310 -31.523 1.00 0.00 N ATOM 2 CA GLY A 1 26.451 2.749 -30.632 1.00 0.00 C ATOM 3 C GLY A 1 26.683 4.151 -30.104 1.00 0.00 C ATOM 4 O GLY A 1 27.784 4.690 -30.217 1.00 0.00 O ATOM 0 H1 GLY A 1 27.218 2.467 -32.509 1.00 0.00 H new ATOM 0 H2 GLY A 1 28.374 2.851 -31.327 1.00 0.00 H new ATOM 0 H3 GLY A 1 27.691 1.297 -31.373 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.498 2.716 -31.160 1.00 0.00 H new ATOM 0 HA3 GLY A 1 26.375 2.056 -29.794 1.00 0.00 H new ATOM 8 N SER A 2 25.643 4.744 -29.527 1.00 0.00 N ATOM 9 CA SER A 2 25.736 6.095 -28.985 1.00 0.00 C ATOM 10 C SER A 2 25.100 6.170 -27.601 1.00 0.00 C ATOM 11 O SER A 2 24.007 5.648 -27.379 1.00 0.00 O ATOM 12 CB SER A 2 25.058 7.093 -29.926 1.00 0.00 C ATOM 13 OG SER A 2 25.635 8.381 -29.804 1.00 0.00 O ATOM 0 H SER A 2 24.726 4.310 -29.423 1.00 0.00 H new ATOM 0 HA SER A 2 26.791 6.352 -28.895 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.149 6.746 -30.955 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.993 7.145 -29.700 1.00 0.00 H new ATOM 0 HG SER A 2 25.186 9.000 -30.417 1.00 0.00 H new ATOM 19 N SER A 3 25.792 6.824 -26.673 1.00 0.00 N ATOM 20 CA SER A 3 25.297 6.965 -25.309 1.00 0.00 C ATOM 21 C SER A 3 25.596 8.358 -24.764 1.00 0.00 C ATOM 22 O SER A 3 26.654 8.927 -25.030 1.00 0.00 O ATOM 23 CB SER A 3 25.928 5.905 -24.403 1.00 0.00 C ATOM 24 OG SER A 3 25.266 5.845 -23.151 1.00 0.00 O ATOM 0 H SER A 3 26.697 7.264 -26.841 1.00 0.00 H new ATOM 0 HA SER A 3 24.216 6.824 -25.325 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.881 4.931 -24.890 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.983 6.134 -24.250 1.00 0.00 H new ATOM 0 HG SER A 3 25.687 5.159 -22.591 1.00 0.00 H new ATOM 30 N GLY A 4 24.654 8.903 -24.000 1.00 0.00 N ATOM 31 CA GLY A 4 24.834 10.225 -23.429 1.00 0.00 C ATOM 32 C GLY A 4 25.508 10.184 -22.072 1.00 0.00 C ATOM 33 O GLY A 4 26.257 9.255 -21.771 1.00 0.00 O ATOM 0 H GLY A 4 23.769 8.452 -23.766 1.00 0.00 H new ATOM 0 HA2 GLY A 4 25.431 10.833 -24.109 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.863 10.712 -23.334 1.00 0.00 H new ATOM 37 N SER A 5 25.243 11.195 -21.251 1.00 0.00 N ATOM 38 CA SER A 5 25.834 11.274 -19.920 1.00 0.00 C ATOM 39 C SER A 5 24.950 10.577 -18.891 1.00 0.00 C ATOM 40 O SER A 5 23.815 10.202 -19.184 1.00 0.00 O ATOM 41 CB SER A 5 26.048 12.735 -19.520 1.00 0.00 C ATOM 42 OG SER A 5 27.095 12.857 -18.573 1.00 0.00 O ATOM 0 H SER A 5 24.623 11.971 -21.484 1.00 0.00 H new ATOM 0 HA SER A 5 26.799 10.767 -19.947 1.00 0.00 H new ATOM 0 HB2 SER A 5 26.283 13.327 -20.405 1.00 0.00 H new ATOM 0 HB3 SER A 5 25.126 13.139 -19.102 1.00 0.00 H new ATOM 0 HG SER A 5 27.213 13.800 -18.335 1.00 0.00 H new ATOM 48 N SER A 6 25.480 10.406 -17.684 1.00 0.00 N ATOM 49 CA SER A 6 24.742 9.750 -16.611 1.00 0.00 C ATOM 50 C SER A 6 24.701 10.628 -15.364 1.00 0.00 C ATOM 51 O SER A 6 25.364 11.663 -15.298 1.00 0.00 O ATOM 52 CB SER A 6 25.378 8.400 -16.277 1.00 0.00 C ATOM 53 OG SER A 6 24.905 7.384 -17.145 1.00 0.00 O ATOM 0 H SER A 6 26.418 10.713 -17.425 1.00 0.00 H new ATOM 0 HA SER A 6 23.720 9.587 -16.953 1.00 0.00 H new ATOM 0 HB2 SER A 6 26.462 8.476 -16.358 1.00 0.00 H new ATOM 0 HB3 SER A 6 25.153 8.134 -15.244 1.00 0.00 H new ATOM 0 HG SER A 6 25.328 6.531 -16.912 1.00 0.00 H new ATOM 59 N GLY A 7 23.917 10.207 -14.376 1.00 0.00 N ATOM 60 CA GLY A 7 23.804 10.965 -13.144 1.00 0.00 C ATOM 61 C GLY A 7 23.088 10.195 -12.052 1.00 0.00 C ATOM 62 O GLY A 7 22.303 10.764 -11.294 1.00 0.00 O ATOM 0 H GLY A 7 23.358 9.354 -14.407 1.00 0.00 H new ATOM 0 HA2 GLY A 7 24.800 11.239 -12.797 1.00 0.00 H new ATOM 0 HA3 GLY A 7 23.268 11.894 -13.340 1.00 0.00 H new ATOM 66 N ARG A 8 23.358 8.896 -11.973 1.00 0.00 N ATOM 67 CA ARG A 8 22.732 8.045 -10.968 1.00 0.00 C ATOM 68 C ARG A 8 23.775 7.194 -10.250 1.00 0.00 C ATOM 69 O ARG A 8 23.577 5.997 -10.038 1.00 0.00 O ATOM 70 CB ARG A 8 21.681 7.142 -11.617 1.00 0.00 C ATOM 71 CG ARG A 8 20.346 7.832 -11.848 1.00 0.00 C ATOM 72 CD ARG A 8 19.287 6.849 -12.323 1.00 0.00 C ATOM 73 NE ARG A 8 19.063 5.777 -11.357 1.00 0.00 N ATOM 74 CZ ARG A 8 19.785 4.663 -11.315 1.00 0.00 C ATOM 75 NH1 ARG A 8 20.773 4.476 -12.180 1.00 0.00 N ATOM 76 NH2 ARG A 8 19.521 3.733 -10.406 1.00 0.00 N ATOM 0 H ARG A 8 24.006 8.410 -12.593 1.00 0.00 H new ATOM 0 HA ARG A 8 22.246 8.689 -10.235 1.00 0.00 H new ATOM 0 HB2 ARG A 8 22.064 6.781 -12.571 1.00 0.00 H new ATOM 0 HB3 ARG A 8 21.524 6.268 -10.985 1.00 0.00 H new ATOM 0 HG2 ARG A 8 20.016 8.307 -10.924 1.00 0.00 H new ATOM 0 HG3 ARG A 8 20.467 8.624 -12.587 1.00 0.00 H new ATOM 0 HD2 ARG A 8 18.352 7.380 -12.498 1.00 0.00 H new ATOM 0 HD3 ARG A 8 19.593 6.419 -13.277 1.00 0.00 H new ATOM 0 HE ARG A 8 18.311 5.890 -10.677 1.00 0.00 H new ATOM 0 HH11 ARG A 8 20.980 5.189 -12.880 1.00 0.00 H new ATOM 0 HH12 ARG A 8 21.326 3.620 -12.145 1.00 0.00 H new ATOM 0 HH21 ARG A 8 18.763 3.873 -9.738 1.00 0.00 H new ATOM 0 HH22 ARG A 8 20.076 2.878 -10.375 1.00 0.00 H new ATOM 90 N LEU A 9 24.886 7.820 -9.877 1.00 0.00 N ATOM 91 CA LEU A 9 25.962 7.120 -9.183 1.00 0.00 C ATOM 92 C LEU A 9 26.167 7.690 -7.783 1.00 0.00 C ATOM 93 O LEU A 9 26.802 8.731 -7.612 1.00 0.00 O ATOM 94 CB LEU A 9 27.262 7.221 -9.982 1.00 0.00 C ATOM 95 CG LEU A 9 28.470 6.491 -9.394 1.00 0.00 C ATOM 96 CD1 LEU A 9 28.248 4.987 -9.418 1.00 0.00 C ATOM 97 CD2 LEU A 9 29.737 6.857 -10.154 1.00 0.00 C ATOM 0 H LEU A 9 25.065 8.810 -10.043 1.00 0.00 H new ATOM 0 HA LEU A 9 25.680 6.071 -9.091 1.00 0.00 H new ATOM 0 HB2 LEU A 9 27.080 6.832 -10.984 1.00 0.00 H new ATOM 0 HB3 LEU A 9 27.517 8.275 -10.091 1.00 0.00 H new ATOM 0 HG LEU A 9 28.590 6.804 -8.357 1.00 0.00 H new ATOM 0 HD11 LEU A 9 29.118 4.484 -8.996 1.00 0.00 H new ATOM 0 HD12 LEU A 9 27.365 4.740 -8.829 1.00 0.00 H new ATOM 0 HD13 LEU A 9 28.102 4.657 -10.447 1.00 0.00 H new ATOM 0 HD21 LEU A 9 30.586 6.328 -9.722 1.00 0.00 H new ATOM 0 HD22 LEU A 9 29.628 6.574 -11.201 1.00 0.00 H new ATOM 0 HD23 LEU A 9 29.905 7.932 -10.085 1.00 0.00 H new ATOM 109 N LEU A 10 25.627 7.000 -6.784 1.00 0.00 N ATOM 110 CA LEU A 10 25.753 7.436 -5.398 1.00 0.00 C ATOM 111 C LEU A 10 26.283 6.308 -4.518 1.00 0.00 C ATOM 112 O LEU A 10 26.490 5.188 -4.985 1.00 0.00 O ATOM 113 CB LEU A 10 24.400 7.917 -4.869 1.00 0.00 C ATOM 114 CG LEU A 10 23.166 7.268 -5.496 1.00 0.00 C ATOM 115 CD1 LEU A 10 23.062 7.631 -6.969 1.00 0.00 C ATOM 116 CD2 LEU A 10 23.208 5.758 -5.319 1.00 0.00 C ATOM 0 H LEU A 10 25.098 6.137 -6.908 1.00 0.00 H new ATOM 0 HA LEU A 10 26.464 8.262 -5.366 1.00 0.00 H new ATOM 0 HB2 LEU A 10 24.370 7.743 -3.793 1.00 0.00 H new ATOM 0 HB3 LEU A 10 24.336 8.995 -5.020 1.00 0.00 H new ATOM 0 HG LEU A 10 22.281 7.648 -4.986 1.00 0.00 H new ATOM 0 HD11 LEU A 10 22.178 7.160 -7.398 1.00 0.00 H new ATOM 0 HD12 LEU A 10 22.983 8.713 -7.072 1.00 0.00 H new ATOM 0 HD13 LEU A 10 23.951 7.280 -7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 10 22.321 5.314 -5.772 1.00 0.00 H new ATOM 0 HD22 LEU A 10 24.100 5.360 -5.802 1.00 0.00 H new ATOM 0 HD23 LEU A 10 23.232 5.517 -4.256 1.00 0.00 H new ATOM 128 N ASP A 11 26.500 6.611 -3.243 1.00 0.00 N ATOM 129 CA ASP A 11 27.004 5.622 -2.297 1.00 0.00 C ATOM 130 C ASP A 11 25.919 5.220 -1.303 1.00 0.00 C ATOM 131 O ASP A 11 26.125 4.341 -0.465 1.00 0.00 O ATOM 132 CB ASP A 11 28.219 6.172 -1.550 1.00 0.00 C ATOM 133 CG ASP A 11 29.507 5.996 -2.330 1.00 0.00 C ATOM 134 OD1 ASP A 11 29.881 4.836 -2.602 1.00 0.00 O ATOM 135 OD2 ASP A 11 30.141 7.018 -2.668 1.00 0.00 O ATOM 0 H ASP A 11 26.335 7.534 -2.841 1.00 0.00 H new ATOM 0 HA ASP A 11 27.303 4.737 -2.859 1.00 0.00 H new ATOM 0 HB2 ASP A 11 28.065 7.231 -1.342 1.00 0.00 H new ATOM 0 HB3 ASP A 11 28.309 5.668 -0.588 1.00 0.00 H new ATOM 140 N LEU A 12 24.764 5.870 -1.400 1.00 0.00 N ATOM 141 CA LEU A 12 23.647 5.581 -0.508 1.00 0.00 C ATOM 142 C LEU A 12 22.350 5.421 -1.295 1.00 0.00 C ATOM 143 O LEU A 12 21.502 6.313 -1.301 1.00 0.00 O ATOM 144 CB LEU A 12 23.493 6.697 0.527 1.00 0.00 C ATOM 145 CG LEU A 12 22.949 6.275 1.893 1.00 0.00 C ATOM 146 CD1 LEU A 12 21.735 5.374 1.728 1.00 0.00 C ATOM 147 CD2 LEU A 12 24.029 5.574 2.704 1.00 0.00 C ATOM 0 H LEU A 12 24.577 6.600 -2.087 1.00 0.00 H new ATOM 0 HA LEU A 12 23.858 4.643 0.006 1.00 0.00 H new ATOM 0 HB2 LEU A 12 24.466 7.165 0.675 1.00 0.00 H new ATOM 0 HB3 LEU A 12 22.832 7.459 0.115 1.00 0.00 H new ATOM 0 HG LEU A 12 22.641 7.171 2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 12 21.361 5.084 2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 12 20.955 5.910 1.187 1.00 0.00 H new ATOM 0 HD13 LEU A 12 22.017 4.482 1.169 1.00 0.00 H new ATOM 0 HD21 LEU A 12 23.624 5.281 3.673 1.00 0.00 H new ATOM 0 HD22 LEU A 12 24.368 4.687 2.169 1.00 0.00 H new ATOM 0 HD23 LEU A 12 24.870 6.251 2.852 1.00 0.00 H new ATOM 159 N GLU A 13 22.202 4.277 -1.956 1.00 0.00 N ATOM 160 CA GLU A 13 21.008 4.000 -2.745 1.00 0.00 C ATOM 161 C GLU A 13 19.752 4.100 -1.884 1.00 0.00 C ATOM 162 O GLU A 13 19.697 3.556 -0.782 1.00 0.00 O ATOM 163 CB GLU A 13 21.097 2.608 -3.375 1.00 0.00 C ATOM 164 CG GLU A 13 21.998 2.551 -4.598 1.00 0.00 C ATOM 165 CD GLU A 13 23.449 2.295 -4.241 1.00 0.00 C ATOM 166 OE1 GLU A 13 23.849 2.629 -3.106 1.00 0.00 O ATOM 167 OE2 GLU A 13 24.185 1.760 -5.097 1.00 0.00 O ATOM 0 H GLU A 13 22.894 3.528 -1.961 1.00 0.00 H new ATOM 0 HA GLU A 13 20.946 4.746 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.465 1.904 -2.629 1.00 0.00 H new ATOM 0 HB3 GLU A 13 20.096 2.281 -3.656 1.00 0.00 H new ATOM 0 HG2 GLU A 13 21.648 1.764 -5.266 1.00 0.00 H new ATOM 0 HG3 GLU A 13 21.922 3.491 -5.145 1.00 0.00 H new ATOM 174 N ASN A 14 18.745 4.801 -2.395 1.00 0.00 N ATOM 175 CA ASN A 14 17.490 4.975 -1.673 1.00 0.00 C ATOM 176 C ASN A 14 16.398 5.500 -2.600 1.00 0.00 C ATOM 177 O ASN A 14 16.494 6.612 -3.121 1.00 0.00 O ATOM 178 CB ASN A 14 17.682 5.935 -0.498 1.00 0.00 C ATOM 179 CG ASN A 14 18.114 7.318 -0.945 1.00 0.00 C ATOM 180 OD1 ASN A 14 19.048 7.464 -1.734 1.00 0.00 O ATOM 181 ND2 ASN A 14 17.435 8.341 -0.441 1.00 0.00 N ATOM 0 H ASN A 14 18.774 5.258 -3.307 1.00 0.00 H new ATOM 0 HA ASN A 14 17.181 4.002 -1.291 1.00 0.00 H new ATOM 0 HB2 ASN A 14 16.749 6.012 0.061 1.00 0.00 H new ATOM 0 HB3 ASN A 14 18.429 5.527 0.183 1.00 0.00 H new ATOM 0 HD21 ASN A 14 17.680 9.295 -0.705 1.00 0.00 H new ATOM 0 HD22 ASN A 14 16.668 8.173 0.210 1.00 0.00 H new ATOM 188 N ILE A 15 15.360 4.694 -2.799 1.00 0.00 N ATOM 189 CA ILE A 15 14.250 5.078 -3.661 1.00 0.00 C ATOM 190 C ILE A 15 13.784 6.499 -3.358 1.00 0.00 C ATOM 191 O ILE A 15 13.825 6.944 -2.211 1.00 0.00 O ATOM 192 CB ILE A 15 13.057 4.116 -3.506 1.00 0.00 C ATOM 193 CG1 ILE A 15 13.501 2.674 -3.764 1.00 0.00 C ATOM 194 CG2 ILE A 15 11.933 4.508 -4.453 1.00 0.00 C ATOM 195 CD1 ILE A 15 13.980 1.958 -2.521 1.00 0.00 C ATOM 0 H ILE A 15 15.265 3.771 -2.375 1.00 0.00 H new ATOM 0 HA ILE A 15 14.616 5.028 -4.686 1.00 0.00 H new ATOM 0 HB ILE A 15 12.684 4.185 -2.484 1.00 0.00 H new ATOM 0 HG12 ILE A 15 12.669 2.118 -4.196 1.00 0.00 H new ATOM 0 HG13 ILE A 15 14.301 2.676 -4.504 1.00 0.00 H new ATOM 0 HG21 ILE A 15 11.098 3.819 -4.331 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.603 5.522 -4.226 1.00 0.00 H new ATOM 0 HG23 ILE A 15 12.292 4.465 -5.481 1.00 0.00 H new ATOM 0 HD11 ILE A 15 14.279 0.942 -2.779 1.00 0.00 H new ATOM 0 HD12 ILE A 15 14.832 2.491 -2.100 1.00 0.00 H new ATOM 0 HD13 ILE A 15 13.175 1.924 -1.787 1.00 0.00 H new ATOM 207 N GLN A 16 13.341 7.204 -4.394 1.00 0.00 N ATOM 208 CA GLN A 16 12.867 8.574 -4.237 1.00 0.00 C ATOM 209 C GLN A 16 11.494 8.603 -3.573 1.00 0.00 C ATOM 210 O GLN A 16 10.488 8.898 -4.219 1.00 0.00 O ATOM 211 CB GLN A 16 12.804 9.273 -5.597 1.00 0.00 C ATOM 212 CG GLN A 16 14.136 9.301 -6.328 1.00 0.00 C ATOM 213 CD GLN A 16 15.105 10.306 -5.737 1.00 0.00 C ATOM 214 OE1 GLN A 16 16.025 9.942 -5.004 1.00 0.00 O ATOM 215 NE2 GLN A 16 14.904 11.580 -6.054 1.00 0.00 N ATOM 0 H GLN A 16 13.300 6.850 -5.350 1.00 0.00 H new ATOM 0 HA GLN A 16 13.571 9.104 -3.596 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.067 8.769 -6.222 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.455 10.296 -5.455 1.00 0.00 H new ATOM 0 HG2 GLN A 16 14.584 8.308 -6.297 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.965 9.541 -7.378 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.129 11.837 -6.665 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.525 12.301 -5.686 1.00 0.00 H new ATOM 224 N ILE A 17 11.461 8.293 -2.282 1.00 0.00 N ATOM 225 CA ILE A 17 10.211 8.284 -1.531 1.00 0.00 C ATOM 226 C ILE A 17 10.051 9.563 -0.716 1.00 0.00 C ATOM 227 O ILE A 17 10.996 10.063 -0.107 1.00 0.00 O ATOM 228 CB ILE A 17 10.132 7.072 -0.584 1.00 0.00 C ATOM 229 CG1 ILE A 17 10.208 5.768 -1.381 1.00 0.00 C ATOM 230 CG2 ILE A 17 8.852 7.124 0.237 1.00 0.00 C ATOM 231 CD1 ILE A 17 10.369 4.539 -0.515 1.00 0.00 C ATOM 0 H ILE A 17 12.285 8.045 -1.734 1.00 0.00 H new ATOM 0 HA ILE A 17 9.404 8.217 -2.261 1.00 0.00 H new ATOM 0 HB ILE A 17 10.980 7.108 0.099 1.00 0.00 H new ATOM 0 HG12 ILE A 17 9.303 5.664 -1.980 1.00 0.00 H new ATOM 0 HG13 ILE A 17 11.046 5.825 -2.076 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.811 6.261 0.901 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.837 8.039 0.829 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.991 7.109 -0.431 1.00 0.00 H new ATOM 0 HD11 ILE A 17 10.416 3.652 -1.147 1.00 0.00 H new ATOM 0 HD12 ILE A 17 11.288 4.620 0.065 1.00 0.00 H new ATOM 0 HD13 ILE A 17 9.519 4.457 0.162 1.00 0.00 H new ATOM 243 N PRO A 18 8.824 10.105 -0.702 1.00 0.00 N ATOM 244 CA PRO A 18 8.509 11.332 0.037 1.00 0.00 C ATOM 245 C PRO A 18 8.541 11.123 1.547 1.00 0.00 C ATOM 246 O PRO A 18 8.424 9.997 2.030 1.00 0.00 O ATOM 247 CB PRO A 18 7.090 11.670 -0.426 1.00 0.00 C ATOM 248 CG PRO A 18 6.507 10.365 -0.847 1.00 0.00 C ATOM 249 CD PRO A 18 7.650 9.562 -1.405 1.00 0.00 C ATOM 0 HA PRO A 18 9.235 12.122 -0.156 1.00 0.00 H new ATOM 0 HB2 PRO A 18 6.509 12.122 0.378 1.00 0.00 H new ATOM 0 HB3 PRO A 18 7.102 12.383 -1.251 1.00 0.00 H new ATOM 0 HG2 PRO A 18 6.046 9.853 -0.002 1.00 0.00 H new ATOM 0 HG3 PRO A 18 5.729 10.509 -1.596 1.00 0.00 H new ATOM 0 HD2 PRO A 18 7.524 8.496 -1.213 1.00 0.00 H new ATOM 0 HD3 PRO A 18 7.737 9.683 -2.485 1.00 0.00 H new ATOM 257 N ASP A 19 8.699 12.215 2.287 1.00 0.00 N ATOM 258 CA ASP A 19 8.745 12.152 3.743 1.00 0.00 C ATOM 259 C ASP A 19 7.557 11.366 4.290 1.00 0.00 C ATOM 260 O ASP A 19 7.698 10.582 5.228 1.00 0.00 O ATOM 261 CB ASP A 19 8.756 13.562 4.336 1.00 0.00 C ATOM 262 CG ASP A 19 8.380 13.575 5.804 1.00 0.00 C ATOM 263 OD1 ASP A 19 9.037 12.863 6.591 1.00 0.00 O ATOM 264 OD2 ASP A 19 7.427 14.298 6.167 1.00 0.00 O ATOM 0 H ASP A 19 8.797 13.155 1.902 1.00 0.00 H new ATOM 0 HA ASP A 19 9.662 11.638 4.031 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.748 13.997 4.214 1.00 0.00 H new ATOM 0 HB3 ASP A 19 8.062 14.192 3.780 1.00 0.00 H new ATOM 269 N ALA A 20 6.387 11.584 3.699 1.00 0.00 N ATOM 270 CA ALA A 20 5.175 10.895 4.127 1.00 0.00 C ATOM 271 C ALA A 20 4.306 10.521 2.931 1.00 0.00 C ATOM 272 O ALA A 20 4.306 11.191 1.899 1.00 0.00 O ATOM 273 CB ALA A 20 4.391 11.763 5.101 1.00 0.00 C ATOM 0 H ALA A 20 6.252 12.232 2.923 1.00 0.00 H new ATOM 0 HA ALA A 20 5.468 9.975 4.632 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.489 11.237 5.412 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.007 11.976 5.975 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.115 12.698 4.614 1.00 0.00 H new ATOM 279 N PRO A 21 3.547 9.424 3.071 1.00 0.00 N ATOM 280 CA PRO A 21 2.659 8.935 2.012 1.00 0.00 C ATOM 281 C PRO A 21 1.462 9.853 1.790 1.00 0.00 C ATOM 282 O PRO A 21 0.924 10.450 2.723 1.00 0.00 O ATOM 283 CB PRO A 21 2.197 7.573 2.537 1.00 0.00 C ATOM 284 CG PRO A 21 2.320 7.676 4.018 1.00 0.00 C ATOM 285 CD PRO A 21 3.497 8.576 4.274 1.00 0.00 C ATOM 0 HA PRO A 21 3.164 8.887 1.047 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.170 7.361 2.239 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.816 6.766 2.144 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.411 8.087 4.457 1.00 0.00 H new ATOM 0 HG3 PRO A 21 2.475 6.694 4.466 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.360 9.169 5.178 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.418 8.007 4.403 1.00 0.00 H new ATOM 293 N PRO A 22 1.033 9.972 0.524 1.00 0.00 N ATOM 294 CA PRO A 22 -0.105 10.816 0.150 1.00 0.00 C ATOM 295 C PRO A 22 -1.432 10.255 0.650 1.00 0.00 C ATOM 296 O PRO A 22 -1.520 9.111 1.099 1.00 0.00 O ATOM 297 CB PRO A 22 -0.065 10.808 -1.380 1.00 0.00 C ATOM 298 CG PRO A 22 0.627 9.537 -1.734 1.00 0.00 C ATOM 299 CD PRO A 22 1.627 9.291 -0.639 1.00 0.00 C ATOM 0 HA PRO A 22 -0.034 11.812 0.587 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -1.069 10.843 -1.802 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.474 11.673 -1.767 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.083 8.713 -1.806 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.121 9.618 -2.702 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.766 8.226 -0.453 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.605 9.701 -0.889 1.00 0.00 H new ATOM 307 N PRO A 23 -2.490 11.076 0.573 1.00 0.00 N ATOM 308 CA PRO A 23 -3.831 10.682 1.013 1.00 0.00 C ATOM 309 C PRO A 23 -4.456 9.632 0.100 1.00 0.00 C ATOM 310 O PRO A 23 -4.811 9.922 -1.043 1.00 0.00 O ATOM 311 CB PRO A 23 -4.625 11.989 0.945 1.00 0.00 C ATOM 312 CG PRO A 23 -3.912 12.813 -0.071 1.00 0.00 C ATOM 313 CD PRO A 23 -2.457 12.452 0.049 1.00 0.00 C ATOM 0 HA PRO A 23 -3.817 10.226 2.003 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -5.660 11.809 0.653 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.649 12.488 1.914 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -4.284 12.604 -1.074 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -4.066 13.877 0.111 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.949 12.503 -0.914 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -1.930 13.127 0.724 1.00 0.00 H new ATOM 321 N ILE A 24 -4.587 8.413 0.611 1.00 0.00 N ATOM 322 CA ILE A 24 -5.170 7.321 -0.158 1.00 0.00 C ATOM 323 C ILE A 24 -6.272 7.827 -1.082 1.00 0.00 C ATOM 324 O ILE A 24 -7.089 8.670 -0.711 1.00 0.00 O ATOM 325 CB ILE A 24 -5.748 6.230 0.762 1.00 0.00 C ATOM 326 CG1 ILE A 24 -4.644 5.634 1.639 1.00 0.00 C ATOM 327 CG2 ILE A 24 -6.420 5.143 -0.063 1.00 0.00 C ATOM 328 CD1 ILE A 24 -5.168 4.772 2.767 1.00 0.00 C ATOM 0 H ILE A 24 -4.297 8.157 1.555 1.00 0.00 H new ATOM 0 HA ILE A 24 -4.366 6.892 -0.756 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.498 6.683 1.411 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -3.978 5.037 1.016 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.047 6.444 2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.824 4.379 0.601 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.229 5.579 -0.649 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -5.689 4.691 -0.734 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.331 4.383 3.347 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.811 5.370 3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.740 3.941 2.354 1.00 0.00 H new ATOM 340 N PRO A 25 -6.299 7.300 -2.316 1.00 0.00 N ATOM 341 CA PRO A 25 -7.298 7.682 -3.318 1.00 0.00 C ATOM 342 C PRO A 25 -8.694 7.179 -2.967 1.00 0.00 C ATOM 343 O PRO A 25 -8.882 6.487 -1.966 1.00 0.00 O ATOM 344 CB PRO A 25 -6.793 7.009 -4.597 1.00 0.00 C ATOM 345 CG PRO A 25 -5.982 5.853 -4.121 1.00 0.00 C ATOM 346 CD PRO A 25 -5.356 6.291 -2.826 1.00 0.00 C ATOM 0 HA PRO A 25 -7.399 8.764 -3.400 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -7.621 6.680 -5.225 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -6.193 7.695 -5.195 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -6.607 4.972 -3.974 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.219 5.584 -4.852 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.244 5.458 -2.132 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -4.363 6.712 -2.982 1.00 0.00 H new ATOM 354 N LYS A 26 -9.670 7.529 -3.797 1.00 0.00 N ATOM 355 CA LYS A 26 -11.050 7.111 -3.576 1.00 0.00 C ATOM 356 C LYS A 26 -11.308 5.739 -4.190 1.00 0.00 C ATOM 357 O LYS A 26 -10.800 5.425 -5.266 1.00 0.00 O ATOM 358 CB LYS A 26 -12.016 8.137 -4.171 1.00 0.00 C ATOM 359 CG LYS A 26 -12.312 7.913 -5.644 1.00 0.00 C ATOM 360 CD LYS A 26 -11.077 8.139 -6.500 1.00 0.00 C ATOM 361 CE LYS A 26 -11.448 8.428 -7.947 1.00 0.00 C ATOM 362 NZ LYS A 26 -12.280 9.657 -8.071 1.00 0.00 N ATOM 0 H LYS A 26 -9.531 8.102 -4.630 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.216 7.045 -2.501 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.952 8.108 -3.613 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -11.598 9.135 -4.041 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -12.678 6.897 -5.792 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.106 8.588 -5.964 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -10.501 8.972 -6.097 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -10.436 7.258 -6.456 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -10.540 8.543 -8.539 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -11.992 7.578 -8.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -12.152 10.069 -9.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -13.282 9.414 -7.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.988 10.348 -7.350 1.00 0.00 H new ATOM 376 N GLU A 27 -12.100 4.926 -3.499 1.00 0.00 N ATOM 377 CA GLU A 27 -12.426 3.587 -3.978 1.00 0.00 C ATOM 378 C GLU A 27 -12.956 3.635 -5.408 1.00 0.00 C ATOM 379 O GLU A 27 -13.612 4.591 -5.822 1.00 0.00 O ATOM 380 CB GLU A 27 -13.459 2.930 -3.061 1.00 0.00 C ATOM 381 CG GLU A 27 -12.880 2.437 -1.746 1.00 0.00 C ATOM 382 CD GLU A 27 -13.948 2.158 -0.706 1.00 0.00 C ATOM 383 OE1 GLU A 27 -14.882 1.386 -1.007 1.00 0.00 O ATOM 384 OE2 GLU A 27 -13.848 2.711 0.409 1.00 0.00 O ATOM 0 H GLU A 27 -12.528 5.170 -2.606 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.512 2.993 -3.967 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -14.254 3.646 -2.852 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.915 2.090 -3.585 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.306 1.528 -1.924 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.185 3.182 -1.357 1.00 0.00 H new ATOM 391 N PRO A 28 -12.663 2.580 -6.182 1.00 0.00 N ATOM 392 CA PRO A 28 -13.100 2.477 -7.578 1.00 0.00 C ATOM 393 C PRO A 28 -14.607 2.274 -7.700 1.00 0.00 C ATOM 394 O PRO A 28 -15.258 1.808 -6.765 1.00 0.00 O ATOM 395 CB PRO A 28 -12.351 1.246 -8.094 1.00 0.00 C ATOM 396 CG PRO A 28 -12.086 0.426 -6.879 1.00 0.00 C ATOM 397 CD PRO A 28 -11.885 1.405 -5.755 1.00 0.00 C ATOM 0 HA PRO A 28 -12.890 3.387 -8.139 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.948 0.695 -8.821 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.423 1.527 -8.592 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.921 -0.243 -6.670 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -11.203 -0.199 -7.015 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.246 1.007 -4.806 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -10.831 1.649 -5.618 1.00 0.00 H new ATOM 405 N SER A 29 -15.155 2.627 -8.859 1.00 0.00 N ATOM 406 CA SER A 29 -16.586 2.486 -9.102 1.00 0.00 C ATOM 407 C SER A 29 -17.031 1.040 -8.905 1.00 0.00 C ATOM 408 O SER A 29 -16.209 0.150 -8.693 1.00 0.00 O ATOM 409 CB SER A 29 -16.932 2.950 -10.518 1.00 0.00 C ATOM 410 OG SER A 29 -16.141 2.277 -11.483 1.00 0.00 O ATOM 0 H SER A 29 -14.630 3.012 -9.644 1.00 0.00 H new ATOM 0 HA SER A 29 -17.115 3.111 -8.383 1.00 0.00 H new ATOM 0 HB2 SER A 29 -17.988 2.766 -10.716 1.00 0.00 H new ATOM 0 HB3 SER A 29 -16.775 4.025 -10.600 1.00 0.00 H new ATOM 0 HG SER A 29 -16.382 2.590 -12.380 1.00 0.00 H new ATOM 416 N ASN A 30 -18.339 0.815 -8.977 1.00 0.00 N ATOM 417 CA ASN A 30 -18.895 -0.522 -8.806 1.00 0.00 C ATOM 418 C ASN A 30 -18.054 -1.559 -9.545 1.00 0.00 C ATOM 419 O ASN A 30 -18.097 -1.647 -10.772 1.00 0.00 O ATOM 420 CB ASN A 30 -20.338 -0.565 -9.311 1.00 0.00 C ATOM 421 CG ASN A 30 -21.321 -0.010 -8.298 1.00 0.00 C ATOM 422 OD1 ASN A 30 -21.964 -0.761 -7.564 1.00 0.00 O ATOM 423 ND2 ASN A 30 -21.443 1.312 -8.255 1.00 0.00 N ATOM 0 H ASN A 30 -19.033 1.541 -9.153 1.00 0.00 H new ATOM 0 HA ASN A 30 -18.882 -0.761 -7.743 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -20.413 0.005 -10.237 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -20.607 -1.594 -9.548 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -22.090 1.743 -7.595 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -20.890 1.896 -8.882 1.00 0.00 H new ATOM 430 N TYR A 31 -17.292 -2.342 -8.790 1.00 0.00 N ATOM 431 CA TYR A 31 -16.441 -3.372 -9.373 1.00 0.00 C ATOM 432 C TYR A 31 -17.181 -4.136 -10.467 1.00 0.00 C ATOM 433 O TYR A 31 -18.404 -4.266 -10.429 1.00 0.00 O ATOM 434 CB TYR A 31 -15.964 -4.343 -8.291 1.00 0.00 C ATOM 435 CG TYR A 31 -15.467 -3.657 -7.039 1.00 0.00 C ATOM 436 CD1 TYR A 31 -14.200 -3.086 -6.993 1.00 0.00 C ATOM 437 CD2 TYR A 31 -16.261 -3.580 -5.902 1.00 0.00 C ATOM 438 CE1 TYR A 31 -13.741 -2.458 -5.851 1.00 0.00 C ATOM 439 CE2 TYR A 31 -15.811 -2.953 -4.756 1.00 0.00 C ATOM 440 CZ TYR A 31 -14.550 -2.394 -4.736 1.00 0.00 C ATOM 441 OH TYR A 31 -14.097 -1.770 -3.596 1.00 0.00 O ATOM 0 H TYR A 31 -17.246 -2.283 -7.773 1.00 0.00 H new ATOM 0 HA TYR A 31 -15.576 -2.882 -9.819 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -16.783 -5.012 -8.028 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -15.165 -4.963 -8.697 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -13.564 -3.134 -7.865 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -17.248 -4.018 -5.914 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -12.754 -2.020 -5.832 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -16.442 -2.901 -3.881 1.00 0.00 H new ATOM 0 HH TYR A 31 -14.789 -1.812 -2.903 1.00 0.00 H new ATOM 451 N ASP A 32 -16.429 -4.640 -11.439 1.00 0.00 N ATOM 452 CA ASP A 32 -17.011 -5.393 -12.544 1.00 0.00 C ATOM 453 C ASP A 32 -16.597 -6.859 -12.480 1.00 0.00 C ATOM 454 O ASP A 32 -16.192 -7.445 -13.484 1.00 0.00 O ATOM 455 CB ASP A 32 -16.586 -4.787 -13.883 1.00 0.00 C ATOM 456 CG ASP A 32 -17.494 -3.655 -14.321 1.00 0.00 C ATOM 457 OD1 ASP A 32 -17.455 -2.582 -13.684 1.00 0.00 O ATOM 458 OD2 ASP A 32 -18.243 -3.843 -15.303 1.00 0.00 O ATOM 0 H ASP A 32 -15.415 -4.541 -11.484 1.00 0.00 H new ATOM 0 HA ASP A 32 -18.096 -5.337 -12.458 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -15.563 -4.418 -13.803 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -16.586 -5.565 -14.647 1.00 0.00 H new ATOM 463 N PHE A 33 -16.701 -7.447 -11.293 1.00 0.00 N ATOM 464 CA PHE A 33 -16.335 -8.845 -11.097 1.00 0.00 C ATOM 465 C PHE A 33 -17.300 -9.768 -11.835 1.00 0.00 C ATOM 466 O PHE A 33 -18.291 -9.317 -12.409 1.00 0.00 O ATOM 467 CB PHE A 33 -16.324 -9.187 -9.606 1.00 0.00 C ATOM 468 CG PHE A 33 -15.023 -8.867 -8.927 1.00 0.00 C ATOM 469 CD1 PHE A 33 -13.998 -9.798 -8.889 1.00 0.00 C ATOM 470 CD2 PHE A 33 -14.825 -7.634 -8.327 1.00 0.00 C ATOM 471 CE1 PHE A 33 -12.800 -9.507 -8.265 1.00 0.00 C ATOM 472 CE2 PHE A 33 -13.629 -7.336 -7.702 1.00 0.00 C ATOM 473 CZ PHE A 33 -12.615 -8.274 -7.670 1.00 0.00 C ATOM 0 H PHE A 33 -17.036 -6.977 -10.452 1.00 0.00 H new ATOM 0 HA PHE A 33 -15.335 -8.993 -11.504 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -17.127 -8.642 -9.110 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -16.537 -10.249 -9.483 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -14.137 -10.763 -9.353 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -15.614 -6.897 -8.348 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -12.009 -10.242 -8.242 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -13.487 -6.371 -7.239 1.00 0.00 H new ATOM 0 HZ PHE A 33 -11.680 -8.044 -7.181 1.00 0.00 H new ATOM 483 N SER A 34 -17.002 -11.063 -11.816 1.00 0.00 N ATOM 484 CA SER A 34 -17.840 -12.051 -12.487 1.00 0.00 C ATOM 485 C SER A 34 -17.642 -13.435 -11.877 1.00 0.00 C ATOM 486 O SER A 34 -16.532 -13.964 -11.856 1.00 0.00 O ATOM 487 CB SER A 34 -17.521 -12.090 -13.982 1.00 0.00 C ATOM 488 OG SER A 34 -17.774 -10.835 -14.590 1.00 0.00 O ATOM 0 H SER A 34 -16.187 -11.453 -11.343 1.00 0.00 H new ATOM 0 HA SER A 34 -18.882 -11.759 -12.353 1.00 0.00 H new ATOM 0 HB2 SER A 34 -16.476 -12.364 -14.127 1.00 0.00 H new ATOM 0 HB3 SER A 34 -18.122 -12.860 -14.466 1.00 0.00 H new ATOM 0 HG SER A 34 -17.561 -10.885 -15.545 1.00 0.00 H new ATOM 494 N GLY A 35 -18.730 -14.017 -11.380 1.00 0.00 N ATOM 495 CA GLY A 35 -18.656 -15.334 -10.776 1.00 0.00 C ATOM 496 C GLY A 35 -19.911 -15.689 -10.003 1.00 0.00 C ATOM 497 O GLY A 35 -20.971 -15.092 -10.192 1.00 0.00 O ATOM 0 H GLY A 35 -19.661 -13.600 -11.385 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -18.490 -16.079 -11.555 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -17.797 -15.376 -10.107 1.00 0.00 H new ATOM 501 N PRO A 36 -19.800 -16.685 -9.112 1.00 0.00 N ATOM 502 CA PRO A 36 -20.926 -17.142 -8.291 1.00 0.00 C ATOM 503 C PRO A 36 -21.332 -16.114 -7.240 1.00 0.00 C ATOM 504 O PRO A 36 -20.486 -15.575 -6.527 1.00 0.00 O ATOM 505 CB PRO A 36 -20.385 -18.407 -7.621 1.00 0.00 C ATOM 506 CG PRO A 36 -18.908 -18.221 -7.595 1.00 0.00 C ATOM 507 CD PRO A 36 -18.567 -17.441 -8.835 1.00 0.00 C ATOM 0 HA PRO A 36 -21.824 -17.309 -8.886 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -20.787 -18.524 -6.615 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -20.662 -19.300 -8.181 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -18.598 -17.684 -6.699 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -18.394 -19.182 -7.585 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -17.717 -16.778 -8.672 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -18.304 -18.098 -9.664 1.00 0.00 H new ATOM 515 N SER A 37 -22.631 -15.849 -7.150 1.00 0.00 N ATOM 516 CA SER A 37 -23.149 -14.883 -6.188 1.00 0.00 C ATOM 517 C SER A 37 -22.532 -15.104 -4.810 1.00 0.00 C ATOM 518 O SER A 37 -22.631 -16.192 -4.241 1.00 0.00 O ATOM 519 CB SER A 37 -24.673 -14.986 -6.100 1.00 0.00 C ATOM 520 OG SER A 37 -25.184 -14.131 -5.092 1.00 0.00 O ATOM 0 H SER A 37 -23.344 -16.289 -7.731 1.00 0.00 H new ATOM 0 HA SER A 37 -22.879 -13.884 -6.532 1.00 0.00 H new ATOM 0 HB2 SER A 37 -25.115 -14.724 -7.062 1.00 0.00 H new ATOM 0 HB3 SER A 37 -24.959 -16.016 -5.887 1.00 0.00 H new ATOM 0 HG SER A 37 -26.160 -14.214 -5.057 1.00 0.00 H new ATOM 526 N SER A 38 -21.896 -14.065 -4.280 1.00 0.00 N ATOM 527 CA SER A 38 -21.259 -14.146 -2.971 1.00 0.00 C ATOM 528 C SER A 38 -22.254 -13.818 -1.861 1.00 0.00 C ATOM 529 O SER A 38 -23.056 -12.894 -1.984 1.00 0.00 O ATOM 530 CB SER A 38 -20.066 -13.190 -2.900 1.00 0.00 C ATOM 531 OG SER A 38 -18.980 -13.672 -3.671 1.00 0.00 O ATOM 0 H SER A 38 -21.808 -13.157 -4.737 1.00 0.00 H new ATOM 0 HA SER A 38 -20.906 -15.167 -2.829 1.00 0.00 H new ATOM 0 HB2 SER A 38 -20.363 -12.205 -3.260 1.00 0.00 H new ATOM 0 HB3 SER A 38 -19.754 -13.069 -1.863 1.00 0.00 H new ATOM 0 HG SER A 38 -18.231 -13.043 -3.611 1.00 0.00 H new ATOM 537 N GLY A 39 -22.195 -14.585 -0.777 1.00 0.00 N ATOM 538 CA GLY A 39 -23.095 -14.362 0.339 1.00 0.00 C ATOM 539 C GLY A 39 -23.021 -15.467 1.374 1.00 0.00 C ATOM 540 O GLY A 39 -23.222 -15.226 2.565 1.00 0.00 O ATOM 0 H GLY A 39 -21.540 -15.357 -0.652 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -22.854 -13.410 0.811 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -24.117 -14.284 -0.032 1.00 0.00 H new ATOM 544 N ILE A 40 -22.733 -16.683 0.920 1.00 0.00 N ATOM 545 CA ILE A 40 -22.634 -17.828 1.815 1.00 0.00 C ATOM 546 C ILE A 40 -21.210 -18.000 2.333 1.00 0.00 C ATOM 547 O ILE A 40 -20.803 -19.099 2.707 1.00 0.00 O ATOM 548 CB ILE A 40 -23.074 -19.129 1.117 1.00 0.00 C ATOM 549 CG1 ILE A 40 -22.138 -19.448 -0.051 1.00 0.00 C ATOM 550 CG2 ILE A 40 -24.511 -19.010 0.633 1.00 0.00 C ATOM 551 CD1 ILE A 40 -20.946 -20.292 0.343 1.00 0.00 C ATOM 0 H ILE A 40 -22.564 -16.900 -0.062 1.00 0.00 H new ATOM 0 HA ILE A 40 -23.302 -17.631 2.653 1.00 0.00 H new ATOM 0 HB ILE A 40 -23.020 -19.946 1.836 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -22.701 -19.968 -0.826 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -21.783 -18.514 -0.487 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -24.807 -19.937 0.142 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -25.167 -18.824 1.483 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -24.590 -18.184 -0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -20.327 -20.479 -0.534 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -20.360 -19.765 1.096 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -21.292 -21.241 0.752 1.00 0.00 H new ATOM 563 N GLU A 41 -20.457 -16.904 2.353 1.00 0.00 N ATOM 564 CA GLU A 41 -19.079 -16.933 2.827 1.00 0.00 C ATOM 565 C GLU A 41 -19.011 -17.405 4.277 1.00 0.00 C ATOM 566 O GLU A 41 -18.152 -18.206 4.641 1.00 0.00 O ATOM 567 CB GLU A 41 -18.442 -15.547 2.699 1.00 0.00 C ATOM 568 CG GLU A 41 -17.859 -15.270 1.324 1.00 0.00 C ATOM 569 CD GLU A 41 -18.909 -14.832 0.322 1.00 0.00 C ATOM 570 OE1 GLU A 41 -19.380 -13.680 0.421 1.00 0.00 O ATOM 571 OE2 GLU A 41 -19.260 -15.642 -0.561 1.00 0.00 O ATOM 0 H GLU A 41 -20.779 -15.986 2.046 1.00 0.00 H new ATOM 0 HA GLU A 41 -18.524 -17.638 2.208 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -19.192 -14.789 2.926 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -17.654 -15.448 3.445 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -17.096 -14.496 1.406 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -17.364 -16.168 0.956 1.00 0.00 H new ATOM 578 N GLY A 42 -19.925 -16.900 5.100 1.00 0.00 N ATOM 579 CA GLY A 42 -19.952 -17.280 6.501 1.00 0.00 C ATOM 580 C GLY A 42 -20.250 -18.753 6.696 1.00 0.00 C ATOM 581 O GLY A 42 -19.607 -19.421 7.507 1.00 0.00 O ATOM 0 H GLY A 42 -20.647 -16.235 4.822 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -18.991 -17.043 6.957 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -20.706 -16.688 7.020 1.00 0.00 H new ATOM 585 N ARG A 43 -21.228 -19.261 5.953 1.00 0.00 N ATOM 586 CA ARG A 43 -21.611 -20.664 6.051 1.00 0.00 C ATOM 587 C ARG A 43 -20.430 -21.574 5.729 1.00 0.00 C ATOM 588 O ARG A 43 -20.149 -22.525 6.458 1.00 0.00 O ATOM 589 CB ARG A 43 -22.774 -20.964 5.103 1.00 0.00 C ATOM 590 CG ARG A 43 -23.993 -20.087 5.337 1.00 0.00 C ATOM 591 CD ARG A 43 -24.915 -20.684 6.389 1.00 0.00 C ATOM 592 NE ARG A 43 -24.528 -20.293 7.742 1.00 0.00 N ATOM 593 CZ ARG A 43 -25.247 -20.576 8.822 1.00 0.00 C ATOM 594 NH1 ARG A 43 -26.385 -21.248 8.708 1.00 0.00 N ATOM 595 NH2 ARG A 43 -24.829 -20.187 10.020 1.00 0.00 N ATOM 0 H ARG A 43 -21.769 -18.722 5.277 1.00 0.00 H new ATOM 0 HA ARG A 43 -21.927 -20.858 7.076 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -22.436 -20.835 4.075 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -23.062 -22.009 5.215 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -23.673 -19.094 5.653 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -24.539 -19.963 4.401 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -25.939 -20.363 6.198 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -24.901 -21.771 6.308 1.00 0.00 H new ATOM 0 HE ARG A 43 -23.658 -19.774 7.864 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -26.710 -21.549 7.789 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -26.935 -21.464 9.539 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -23.955 -19.670 10.112 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -25.382 -20.405 10.849 1.00 0.00 H new ATOM 609 N GLY A 44 -19.741 -21.276 4.631 1.00 0.00 N ATOM 610 CA GLY A 44 -18.599 -22.077 4.232 1.00 0.00 C ATOM 611 C GLY A 44 -18.956 -23.113 3.184 1.00 0.00 C ATOM 612 O GLY A 44 -19.903 -23.881 3.357 1.00 0.00 O ATOM 0 H GLY A 44 -19.954 -20.494 4.011 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.819 -21.423 3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -18.186 -22.578 5.108 1.00 0.00 H new ATOM 616 N SER A 45 -18.197 -23.135 2.093 1.00 0.00 N ATOM 617 CA SER A 45 -18.442 -24.080 1.010 1.00 0.00 C ATOM 618 C SER A 45 -17.177 -24.302 0.186 1.00 0.00 C ATOM 619 O SER A 45 -16.550 -23.349 -0.277 1.00 0.00 O ATOM 620 CB SER A 45 -19.569 -23.575 0.108 1.00 0.00 C ATOM 621 OG SER A 45 -20.837 -23.821 0.691 1.00 0.00 O ATOM 0 H SER A 45 -17.407 -22.509 1.936 1.00 0.00 H new ATOM 0 HA SER A 45 -18.739 -25.031 1.452 1.00 0.00 H new ATOM 0 HB2 SER A 45 -19.447 -22.506 -0.068 1.00 0.00 H new ATOM 0 HB3 SER A 45 -19.510 -24.067 -0.863 1.00 0.00 H new ATOM 0 HG SER A 45 -20.736 -23.931 1.660 1.00 0.00 H new ATOM 627 N SER A 46 -16.808 -25.566 0.009 1.00 0.00 N ATOM 628 CA SER A 46 -15.616 -25.915 -0.756 1.00 0.00 C ATOM 629 C SER A 46 -15.839 -25.680 -2.247 1.00 0.00 C ATOM 630 O SER A 46 -16.974 -25.656 -2.720 1.00 0.00 O ATOM 631 CB SER A 46 -15.235 -27.375 -0.509 1.00 0.00 C ATOM 632 OG SER A 46 -13.849 -27.583 -0.718 1.00 0.00 O ATOM 0 H SER A 46 -17.317 -26.366 0.385 1.00 0.00 H new ATOM 0 HA SER A 46 -14.800 -25.273 -0.423 1.00 0.00 H new ATOM 0 HB2 SER A 46 -15.498 -27.655 0.511 1.00 0.00 H new ATOM 0 HB3 SER A 46 -15.807 -28.021 -1.175 1.00 0.00 H new ATOM 0 HG SER A 46 -13.631 -28.524 -0.552 1.00 0.00 H new ATOM 638 N GLY A 47 -14.745 -25.508 -2.983 1.00 0.00 N ATOM 639 CA GLY A 47 -14.841 -25.277 -4.412 1.00 0.00 C ATOM 640 C GLY A 47 -14.014 -24.091 -4.865 1.00 0.00 C ATOM 641 O GLY A 47 -14.547 -23.005 -5.095 1.00 0.00 O ATOM 0 H GLY A 47 -13.794 -25.525 -2.615 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -14.512 -26.170 -4.944 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -15.884 -25.112 -4.681 1.00 0.00 H new ATOM 645 N SER A 48 -12.707 -24.296 -4.992 1.00 0.00 N ATOM 646 CA SER A 48 -11.804 -23.232 -5.415 1.00 0.00 C ATOM 647 C SER A 48 -11.134 -23.583 -6.740 1.00 0.00 C ATOM 648 O SER A 48 -9.938 -23.356 -6.924 1.00 0.00 O ATOM 649 CB SER A 48 -10.740 -22.982 -4.344 1.00 0.00 C ATOM 650 OG SER A 48 -9.724 -23.969 -4.393 1.00 0.00 O ATOM 0 H SER A 48 -12.250 -25.189 -4.808 1.00 0.00 H new ATOM 0 HA SER A 48 -12.391 -22.324 -5.554 1.00 0.00 H new ATOM 0 HB2 SER A 48 -10.300 -21.995 -4.488 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.205 -22.983 -3.358 1.00 0.00 H new ATOM 0 HG SER A 48 -9.224 -23.882 -5.231 1.00 0.00 H new ATOM 656 N SER A 49 -11.915 -24.139 -7.661 1.00 0.00 N ATOM 657 CA SER A 49 -11.398 -24.526 -8.969 1.00 0.00 C ATOM 658 C SER A 49 -11.622 -23.416 -9.991 1.00 0.00 C ATOM 659 O SER A 49 -12.647 -22.735 -9.971 1.00 0.00 O ATOM 660 CB SER A 49 -12.069 -25.816 -9.445 1.00 0.00 C ATOM 661 OG SER A 49 -11.626 -26.172 -10.743 1.00 0.00 O ATOM 0 H SER A 49 -12.908 -24.332 -7.526 1.00 0.00 H new ATOM 0 HA SER A 49 -10.326 -24.697 -8.873 1.00 0.00 H new ATOM 0 HB2 SER A 49 -11.847 -26.624 -8.747 1.00 0.00 H new ATOM 0 HB3 SER A 49 -13.151 -25.687 -9.449 1.00 0.00 H new ATOM 0 HG SER A 49 -12.068 -27.000 -11.024 1.00 0.00 H new ATOM 667 N GLY A 50 -10.654 -23.239 -10.886 1.00 0.00 N ATOM 668 CA GLY A 50 -10.763 -22.211 -11.904 1.00 0.00 C ATOM 669 C GLY A 50 -9.925 -22.517 -13.129 1.00 0.00 C ATOM 670 O GLY A 50 -10.204 -23.468 -13.859 1.00 0.00 O ATOM 0 H GLY A 50 -9.796 -23.790 -10.924 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.807 -22.105 -12.199 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -10.452 -21.254 -11.485 1.00 0.00 H new ATOM 674 N SER A 51 -8.895 -21.708 -13.356 1.00 0.00 N ATOM 675 CA SER A 51 -8.016 -21.894 -14.505 1.00 0.00 C ATOM 676 C SER A 51 -7.489 -23.324 -14.560 1.00 0.00 C ATOM 677 O SER A 51 -6.752 -23.760 -13.675 1.00 0.00 O ATOM 678 CB SER A 51 -6.847 -20.909 -14.445 1.00 0.00 C ATOM 679 OG SER A 51 -6.153 -21.017 -13.214 1.00 0.00 O ATOM 0 H SER A 51 -8.649 -20.918 -12.760 1.00 0.00 H new ATOM 0 HA SER A 51 -8.595 -21.704 -15.409 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.162 -21.102 -15.271 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.218 -19.892 -14.569 1.00 0.00 H new ATOM 0 HG SER A 51 -6.086 -21.961 -12.958 1.00 0.00 H new ATOM 685 N SER A 52 -7.871 -24.050 -15.606 1.00 0.00 N ATOM 686 CA SER A 52 -7.440 -25.433 -15.775 1.00 0.00 C ATOM 687 C SER A 52 -6.111 -25.500 -16.521 1.00 0.00 C ATOM 688 O SER A 52 -5.139 -26.073 -16.030 1.00 0.00 O ATOM 689 CB SER A 52 -8.504 -26.231 -16.532 1.00 0.00 C ATOM 690 OG SER A 52 -9.661 -26.422 -15.737 1.00 0.00 O ATOM 0 H SER A 52 -8.478 -23.704 -16.349 1.00 0.00 H new ATOM 0 HA SER A 52 -7.304 -25.870 -14.786 1.00 0.00 H new ATOM 0 HB2 SER A 52 -8.772 -25.707 -17.449 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.097 -27.199 -16.825 1.00 0.00 H new ATOM 0 HG SER A 52 -10.326 -26.933 -16.244 1.00 0.00 H new ATOM 696 N GLY A 53 -6.077 -24.910 -17.712 1.00 0.00 N ATOM 697 CA GLY A 53 -4.863 -24.913 -18.507 1.00 0.00 C ATOM 698 C GLY A 53 -3.979 -23.716 -18.222 1.00 0.00 C ATOM 699 O GLY A 53 -3.817 -23.316 -17.069 1.00 0.00 O ATOM 0 H GLY A 53 -6.869 -24.430 -18.140 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -4.305 -25.828 -18.308 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.125 -24.923 -19.565 1.00 0.00 H new ATOM 703 N SER A 54 -3.404 -23.142 -19.274 1.00 0.00 N ATOM 704 CA SER A 54 -2.526 -21.987 -19.130 1.00 0.00 C ATOM 705 C SER A 54 -3.176 -20.735 -19.714 1.00 0.00 C ATOM 706 O SER A 54 -2.920 -20.367 -20.860 1.00 0.00 O ATOM 707 CB SER A 54 -1.186 -22.248 -19.820 1.00 0.00 C ATOM 708 OG SER A 54 -0.555 -23.400 -19.287 1.00 0.00 O ATOM 0 H SER A 54 -3.531 -23.458 -20.235 1.00 0.00 H new ATOM 0 HA SER A 54 -2.353 -21.824 -18.066 1.00 0.00 H new ATOM 0 HB2 SER A 54 -1.344 -22.378 -20.891 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.535 -21.383 -19.697 1.00 0.00 H new ATOM 0 HG SER A 54 0.299 -23.547 -19.745 1.00 0.00 H new ATOM 714 N SER A 55 -4.018 -20.087 -18.916 1.00 0.00 N ATOM 715 CA SER A 55 -4.709 -18.879 -19.354 1.00 0.00 C ATOM 716 C SER A 55 -3.754 -17.689 -19.386 1.00 0.00 C ATOM 717 O SER A 55 -3.701 -16.949 -20.367 1.00 0.00 O ATOM 718 CB SER A 55 -5.888 -18.576 -18.427 1.00 0.00 C ATOM 719 OG SER A 55 -5.472 -18.519 -17.074 1.00 0.00 O ATOM 0 H SER A 55 -4.238 -20.377 -17.963 1.00 0.00 H new ATOM 0 HA SER A 55 -5.084 -19.050 -20.363 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.343 -17.627 -18.711 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.653 -19.344 -18.543 1.00 0.00 H new ATOM 0 HG SER A 55 -6.243 -18.322 -16.503 1.00 0.00 H new ATOM 725 N GLY A 56 -3.001 -17.513 -18.304 1.00 0.00 N ATOM 726 CA GLY A 56 -2.058 -16.412 -18.228 1.00 0.00 C ATOM 727 C GLY A 56 -1.310 -16.380 -16.911 1.00 0.00 C ATOM 728 O GLY A 56 -1.704 -15.673 -15.983 1.00 0.00 O ATOM 0 H GLY A 56 -3.027 -18.113 -17.479 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -1.343 -16.493 -19.047 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.591 -15.471 -18.362 1.00 0.00 H new ATOM 732 N ASP A 57 -0.229 -17.148 -16.827 1.00 0.00 N ATOM 733 CA ASP A 57 0.576 -17.205 -15.612 1.00 0.00 C ATOM 734 C ASP A 57 1.609 -16.083 -15.592 1.00 0.00 C ATOM 735 O ASP A 57 2.792 -16.318 -15.343 1.00 0.00 O ATOM 736 CB ASP A 57 1.274 -18.561 -15.501 1.00 0.00 C ATOM 737 CG ASP A 57 0.389 -19.619 -14.873 1.00 0.00 C ATOM 738 OD1 ASP A 57 -0.275 -19.313 -13.860 1.00 0.00 O ATOM 739 OD2 ASP A 57 0.358 -20.753 -15.395 1.00 0.00 O ATOM 0 H ASP A 57 0.110 -17.740 -17.586 1.00 0.00 H new ATOM 0 HA ASP A 57 -0.089 -17.077 -14.758 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.581 -18.891 -16.494 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.181 -18.452 -14.907 1.00 0.00 H new ATOM 744 N LYS A 58 1.156 -14.863 -15.857 1.00 0.00 N ATOM 745 CA LYS A 58 2.040 -13.704 -15.870 1.00 0.00 C ATOM 746 C LYS A 58 1.540 -12.628 -14.910 1.00 0.00 C ATOM 747 O LYS A 58 0.909 -11.658 -15.326 1.00 0.00 O ATOM 748 CB LYS A 58 2.143 -13.131 -17.285 1.00 0.00 C ATOM 749 CG LYS A 58 3.271 -13.734 -18.104 1.00 0.00 C ATOM 750 CD LYS A 58 3.827 -12.737 -19.107 1.00 0.00 C ATOM 751 CE LYS A 58 4.972 -11.929 -18.514 1.00 0.00 C ATOM 752 NZ LYS A 58 6.266 -12.661 -18.596 1.00 0.00 N ATOM 0 H LYS A 58 0.180 -14.651 -16.066 1.00 0.00 H new ATOM 0 HA LYS A 58 3.028 -14.028 -15.543 1.00 0.00 H new ATOM 0 HB2 LYS A 58 1.199 -13.296 -17.805 1.00 0.00 H new ATOM 0 HB3 LYS A 58 2.287 -12.052 -17.222 1.00 0.00 H new ATOM 0 HG2 LYS A 58 4.068 -14.065 -17.438 1.00 0.00 H new ATOM 0 HG3 LYS A 58 2.908 -14.617 -18.630 1.00 0.00 H new ATOM 0 HD2 LYS A 58 4.175 -13.267 -19.994 1.00 0.00 H new ATOM 0 HD3 LYS A 58 3.034 -12.063 -19.430 1.00 0.00 H new ATOM 0 HE2 LYS A 58 5.058 -10.979 -19.041 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.751 -11.696 -17.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 7.021 -12.078 -18.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.192 -13.556 -18.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 6.489 -12.861 -19.592 1.00 0.00 H new ATOM 766 N GLU A 59 1.830 -12.808 -13.625 1.00 0.00 N ATOM 767 CA GLU A 59 1.410 -11.852 -12.607 1.00 0.00 C ATOM 768 C GLU A 59 2.478 -10.784 -12.390 1.00 0.00 C ATOM 769 O GLU A 59 3.583 -10.878 -12.926 1.00 0.00 O ATOM 770 CB GLU A 59 1.117 -12.571 -11.289 1.00 0.00 C ATOM 771 CG GLU A 59 0.053 -13.650 -11.408 1.00 0.00 C ATOM 772 CD GLU A 59 0.500 -14.818 -12.264 1.00 0.00 C ATOM 773 OE1 GLU A 59 1.652 -15.271 -12.095 1.00 0.00 O ATOM 774 OE2 GLU A 59 -0.301 -15.280 -13.104 1.00 0.00 O ATOM 0 H GLU A 59 2.353 -13.606 -13.265 1.00 0.00 H new ATOM 0 HA GLU A 59 0.499 -11.365 -12.957 1.00 0.00 H new ATOM 0 HB2 GLU A 59 2.038 -13.020 -10.917 1.00 0.00 H new ATOM 0 HB3 GLU A 59 0.798 -11.838 -10.548 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -0.205 -14.012 -10.413 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.852 -13.217 -11.835 1.00 0.00 H new ATOM 781 N ARG A 60 2.140 -9.769 -11.602 1.00 0.00 N ATOM 782 CA ARG A 60 3.069 -8.682 -11.315 1.00 0.00 C ATOM 783 C ARG A 60 3.574 -8.764 -9.877 1.00 0.00 C ATOM 784 O ARG A 60 2.809 -9.045 -8.954 1.00 0.00 O ATOM 785 CB ARG A 60 2.395 -7.330 -11.553 1.00 0.00 C ATOM 786 CG ARG A 60 3.362 -6.230 -11.960 1.00 0.00 C ATOM 787 CD ARG A 60 2.636 -4.922 -12.230 1.00 0.00 C ATOM 788 NE ARG A 60 2.132 -4.848 -13.599 1.00 0.00 N ATOM 789 CZ ARG A 60 2.915 -4.714 -14.664 1.00 0.00 C ATOM 790 NH1 ARG A 60 4.231 -4.641 -14.519 1.00 0.00 N ATOM 791 NH2 ARG A 60 2.381 -4.655 -15.878 1.00 0.00 N ATOM 0 H ARG A 60 1.230 -9.676 -11.151 1.00 0.00 H new ATOM 0 HA ARG A 60 3.921 -8.779 -11.988 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.638 -7.443 -12.330 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.876 -7.027 -10.644 1.00 0.00 H new ATOM 0 HG2 ARG A 60 4.099 -6.082 -11.171 1.00 0.00 H new ATOM 0 HG3 ARG A 60 3.908 -6.536 -12.853 1.00 0.00 H new ATOM 0 HD2 ARG A 60 1.805 -4.818 -11.532 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.313 -4.087 -12.047 1.00 0.00 H new ATOM 0 HE ARG A 60 1.124 -4.902 -13.745 1.00 0.00 H new ATOM 0 HH11 ARG A 60 4.645 -4.688 -13.588 1.00 0.00 H new ATOM 0 HH12 ARG A 60 4.829 -4.538 -15.339 1.00 0.00 H new ATOM 0 HH21 ARG A 60 1.369 -4.713 -15.993 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.983 -4.552 -16.695 1.00 0.00 H new ATOM 805 N HIS A 61 4.868 -8.517 -9.695 1.00 0.00 N ATOM 806 CA HIS A 61 5.475 -8.563 -8.370 1.00 0.00 C ATOM 807 C HIS A 61 5.531 -7.170 -7.750 1.00 0.00 C ATOM 808 O HIS A 61 6.181 -6.270 -8.279 1.00 0.00 O ATOM 809 CB HIS A 61 6.883 -9.155 -8.451 1.00 0.00 C ATOM 810 CG HIS A 61 7.295 -9.892 -7.214 1.00 0.00 C ATOM 811 ND1 HIS A 61 8.386 -9.531 -6.452 1.00 0.00 N ATOM 812 CD2 HIS A 61 6.755 -10.974 -6.607 1.00 0.00 C ATOM 813 CE1 HIS A 61 8.500 -10.361 -5.430 1.00 0.00 C ATOM 814 NE2 HIS A 61 7.522 -11.246 -5.501 1.00 0.00 N ATOM 0 H HIS A 61 5.515 -8.283 -10.448 1.00 0.00 H new ATOM 0 HA HIS A 61 4.857 -9.199 -7.736 1.00 0.00 H new ATOM 0 HB2 HIS A 61 6.934 -9.834 -9.302 1.00 0.00 H new ATOM 0 HB3 HIS A 61 7.596 -8.352 -8.640 1.00 0.00 H new ATOM 0 HD2 HIS A 61 5.883 -11.522 -6.932 1.00 0.00 H new ATOM 0 HE1 HIS A 61 9.263 -10.322 -4.667 1.00 0.00 H new ATOM 0 HE2 HIS A 61 7.362 -12.008 -4.842 1.00 0.00 H new ATOM 823 N GLY A 62 4.845 -7.001 -6.623 1.00 0.00 N ATOM 824 CA GLY A 62 4.829 -5.715 -5.950 1.00 0.00 C ATOM 825 C GLY A 62 5.294 -5.809 -4.511 1.00 0.00 C ATOM 826 O GLY A 62 5.453 -6.904 -3.972 1.00 0.00 O ATOM 0 H GLY A 62 4.300 -7.731 -6.164 1.00 0.00 H new ATOM 0 HA2 GLY A 62 5.469 -5.017 -6.491 1.00 0.00 H new ATOM 0 HA3 GLY A 62 3.819 -5.307 -5.976 1.00 0.00 H new ATOM 830 N VAL A 63 5.514 -4.657 -3.885 1.00 0.00 N ATOM 831 CA VAL A 63 5.964 -4.613 -2.499 1.00 0.00 C ATOM 832 C VAL A 63 5.360 -3.423 -1.763 1.00 0.00 C ATOM 833 O VAL A 63 5.405 -2.292 -2.247 1.00 0.00 O ATOM 834 CB VAL A 63 7.500 -4.532 -2.410 1.00 0.00 C ATOM 835 CG1 VAL A 63 7.930 -4.036 -1.038 1.00 0.00 C ATOM 836 CG2 VAL A 63 8.123 -5.885 -2.716 1.00 0.00 C ATOM 0 H VAL A 63 5.388 -3.741 -4.316 1.00 0.00 H new ATOM 0 HA VAL A 63 5.628 -5.537 -2.028 1.00 0.00 H new ATOM 0 HB VAL A 63 7.853 -3.818 -3.155 1.00 0.00 H new ATOM 0 HG11 VAL A 63 9.018 -3.985 -0.994 1.00 0.00 H new ATOM 0 HG12 VAL A 63 7.513 -3.044 -0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.568 -4.722 -0.273 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.208 -5.809 -2.649 1.00 0.00 H new ATOM 0 HG22 VAL A 63 7.765 -6.621 -1.996 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.843 -6.195 -3.723 1.00 0.00 H new ATOM 846 N ALA A 64 4.795 -3.685 -0.589 1.00 0.00 N ATOM 847 CA ALA A 64 4.184 -2.636 0.217 1.00 0.00 C ATOM 848 C ALA A 64 5.239 -1.686 0.773 1.00 0.00 C ATOM 849 O ALA A 64 6.200 -2.116 1.411 1.00 0.00 O ATOM 850 CB ALA A 64 3.370 -3.245 1.349 1.00 0.00 C ATOM 0 H ALA A 64 4.748 -4.616 -0.175 1.00 0.00 H new ATOM 0 HA ALA A 64 3.517 -2.061 -0.426 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.920 -2.449 1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 64 2.585 -3.877 0.934 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.022 -3.846 1.983 1.00 0.00 H new ATOM 856 N ILE A 65 5.054 -0.393 0.527 1.00 0.00 N ATOM 857 CA ILE A 65 5.990 0.617 1.004 1.00 0.00 C ATOM 858 C ILE A 65 5.415 1.383 2.190 1.00 0.00 C ATOM 859 O ILE A 65 6.156 1.914 3.018 1.00 0.00 O ATOM 860 CB ILE A 65 6.356 1.616 -0.110 1.00 0.00 C ATOM 861 CG1 ILE A 65 5.091 2.129 -0.800 1.00 0.00 C ATOM 862 CG2 ILE A 65 7.290 0.966 -1.119 1.00 0.00 C ATOM 863 CD1 ILE A 65 5.350 3.254 -1.778 1.00 0.00 C ATOM 0 H ILE A 65 4.264 -0.021 -0.000 1.00 0.00 H new ATOM 0 HA ILE A 65 6.891 0.089 1.318 1.00 0.00 H new ATOM 0 HB ILE A 65 6.872 2.465 0.339 1.00 0.00 H new ATOM 0 HG12 ILE A 65 4.614 1.303 -1.327 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.387 2.472 -0.042 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.539 1.685 -1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.202 0.645 -0.616 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.799 0.101 -1.565 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.409 3.568 -2.229 1.00 0.00 H new ATOM 0 HD12 ILE A 65 5.799 4.097 -1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 65 6.029 2.909 -2.558 1.00 0.00 H new ATOM 875 N TYR A 66 4.090 1.435 2.268 1.00 0.00 N ATOM 876 CA TYR A 66 3.415 2.136 3.353 1.00 0.00 C ATOM 877 C TYR A 66 2.474 1.200 4.105 1.00 0.00 C ATOM 878 O TYR A 66 1.755 0.407 3.500 1.00 0.00 O ATOM 879 CB TYR A 66 2.632 3.332 2.807 1.00 0.00 C ATOM 880 CG TYR A 66 3.513 4.450 2.296 1.00 0.00 C ATOM 881 CD1 TYR A 66 4.405 5.099 3.140 1.00 0.00 C ATOM 882 CD2 TYR A 66 3.454 4.856 0.968 1.00 0.00 C ATOM 883 CE1 TYR A 66 5.211 6.121 2.678 1.00 0.00 C ATOM 884 CE2 TYR A 66 4.257 5.876 0.497 1.00 0.00 C ATOM 885 CZ TYR A 66 5.134 6.506 1.356 1.00 0.00 C ATOM 886 OH TYR A 66 5.936 7.523 0.891 1.00 0.00 O ATOM 0 H TYR A 66 3.462 1.000 1.592 1.00 0.00 H new ATOM 0 HA TYR A 66 4.175 2.493 4.048 1.00 0.00 H new ATOM 0 HB2 TYR A 66 1.984 2.993 1.999 1.00 0.00 H new ATOM 0 HB3 TYR A 66 1.985 3.721 3.593 1.00 0.00 H new ATOM 0 HD1 TYR A 66 4.469 4.799 4.176 1.00 0.00 H new ATOM 0 HD2 TYR A 66 2.768 4.365 0.293 1.00 0.00 H new ATOM 0 HE1 TYR A 66 5.898 6.616 3.348 1.00 0.00 H new ATOM 0 HE2 TYR A 66 4.199 6.179 -0.538 1.00 0.00 H new ATOM 0 HH TYR A 66 5.759 7.670 -0.062 1.00 0.00 H new ATOM 896 N ASN A 67 2.486 1.299 5.431 1.00 0.00 N ATOM 897 CA ASN A 67 1.635 0.462 6.268 1.00 0.00 C ATOM 898 C ASN A 67 0.164 0.821 6.079 1.00 0.00 C ATOM 899 O ASN A 67 -0.278 1.899 6.476 1.00 0.00 O ATOM 900 CB ASN A 67 2.024 0.613 7.740 1.00 0.00 C ATOM 901 CG ASN A 67 1.758 2.009 8.267 1.00 0.00 C ATOM 902 OD1 ASN A 67 0.728 2.263 8.893 1.00 0.00 O ATOM 903 ND2 ASN A 67 2.688 2.923 8.017 1.00 0.00 N ATOM 0 H ASN A 67 3.076 1.951 5.948 1.00 0.00 H new ATOM 0 HA ASN A 67 1.779 -0.575 5.966 1.00 0.00 H new ATOM 0 HB2 ASN A 67 1.467 -0.110 8.336 1.00 0.00 H new ATOM 0 HB3 ASN A 67 3.082 0.378 7.860 1.00 0.00 H new ATOM 0 HD21 ASN A 67 2.564 3.880 8.348 1.00 0.00 H new ATOM 0 HD22 ASN A 67 3.526 2.668 7.494 1.00 0.00 H new ATOM 910 N PHE A 68 -0.589 -0.090 5.472 1.00 0.00 N ATOM 911 CA PHE A 68 -2.010 0.131 5.230 1.00 0.00 C ATOM 912 C PHE A 68 -2.857 -0.578 6.283 1.00 0.00 C ATOM 913 O PHE A 68 -2.600 -1.732 6.626 1.00 0.00 O ATOM 914 CB PHE A 68 -2.394 -0.362 3.833 1.00 0.00 C ATOM 915 CG PHE A 68 -3.849 -0.177 3.512 1.00 0.00 C ATOM 916 CD1 PHE A 68 -4.409 1.090 3.476 1.00 0.00 C ATOM 917 CD2 PHE A 68 -4.658 -1.270 3.245 1.00 0.00 C ATOM 918 CE1 PHE A 68 -5.748 1.263 3.181 1.00 0.00 C ATOM 919 CE2 PHE A 68 -5.998 -1.103 2.949 1.00 0.00 C ATOM 920 CZ PHE A 68 -6.543 0.165 2.916 1.00 0.00 C ATOM 0 H PHE A 68 -0.239 -0.988 5.139 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.202 1.202 5.295 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.796 0.169 3.092 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.143 -1.419 3.748 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.792 1.952 3.681 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -4.237 -2.264 3.268 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.172 2.256 3.158 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.618 -1.963 2.744 1.00 0.00 H new ATOM 0 HZ PHE A 68 -7.589 0.298 2.683 1.00 0.00 H new ATOM 930 N GLN A 69 -3.867 0.121 6.791 1.00 0.00 N ATOM 931 CA GLN A 69 -4.751 -0.440 7.805 1.00 0.00 C ATOM 932 C GLN A 69 -6.192 -0.481 7.308 1.00 0.00 C ATOM 933 O GLN A 69 -6.829 0.557 7.136 1.00 0.00 O ATOM 934 CB GLN A 69 -4.666 0.377 9.095 1.00 0.00 C ATOM 935 CG GLN A 69 -5.015 1.845 8.909 1.00 0.00 C ATOM 936 CD GLN A 69 -4.522 2.712 10.050 1.00 0.00 C ATOM 937 OE1 GLN A 69 -5.197 2.861 11.069 1.00 0.00 O ATOM 938 NE2 GLN A 69 -3.337 3.288 9.887 1.00 0.00 N ATOM 0 H GLN A 69 -4.093 1.077 6.517 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.427 -1.461 8.009 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.338 -0.057 9.835 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.656 0.300 9.498 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -4.583 2.201 7.974 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -6.096 1.949 8.820 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -2.811 3.138 9.026 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -2.953 3.881 10.623 1.00 0.00 H new ATOM 947 N GLY A 70 -6.700 -1.689 7.080 1.00 0.00 N ATOM 948 CA GLY A 70 -8.063 -1.842 6.605 1.00 0.00 C ATOM 949 C GLY A 70 -9.004 -2.326 7.690 1.00 0.00 C ATOM 950 O GLY A 70 -8.605 -2.482 8.844 1.00 0.00 O ATOM 0 H GLY A 70 -6.192 -2.563 7.216 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -8.419 -0.887 6.219 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.078 -2.547 5.774 1.00 0.00 H new ATOM 954 N SER A 71 -10.259 -2.563 7.321 1.00 0.00 N ATOM 955 CA SER A 71 -11.262 -3.026 8.273 1.00 0.00 C ATOM 956 C SER A 71 -11.807 -4.392 7.865 1.00 0.00 C ATOM 957 O SER A 71 -12.006 -5.269 8.705 1.00 0.00 O ATOM 958 CB SER A 71 -12.406 -2.016 8.373 1.00 0.00 C ATOM 959 OG SER A 71 -12.118 -1.013 9.331 1.00 0.00 O ATOM 0 H SER A 71 -10.605 -2.442 6.369 1.00 0.00 H new ATOM 0 HA SER A 71 -10.786 -3.121 9.249 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.575 -1.556 7.400 1.00 0.00 H new ATOM 0 HB3 SER A 71 -13.327 -2.531 8.646 1.00 0.00 H new ATOM 0 HG SER A 71 -12.864 -0.379 9.375 1.00 0.00 H new ATOM 965 N GLY A 72 -12.048 -4.563 6.569 1.00 0.00 N ATOM 966 CA GLY A 72 -12.568 -5.823 6.071 1.00 0.00 C ATOM 967 C GLY A 72 -12.797 -5.805 4.573 1.00 0.00 C ATOM 968 O GLY A 72 -13.002 -4.745 3.983 1.00 0.00 O ATOM 0 H GLY A 72 -11.892 -3.851 5.855 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.871 -6.623 6.319 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.507 -6.050 6.576 1.00 0.00 H new ATOM 972 N ALA A 73 -12.760 -6.981 3.956 1.00 0.00 N ATOM 973 CA ALA A 73 -12.965 -7.096 2.517 1.00 0.00 C ATOM 974 C ALA A 73 -14.076 -6.164 2.045 1.00 0.00 C ATOM 975 O ALA A 73 -14.979 -5.803 2.800 1.00 0.00 O ATOM 976 CB ALA A 73 -13.287 -8.535 2.143 1.00 0.00 C ATOM 0 H ALA A 73 -12.590 -7.868 4.430 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.042 -6.800 2.019 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.438 -8.606 1.066 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.460 -9.181 2.437 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.195 -8.850 2.658 1.00 0.00 H new ATOM 982 N PRO A 74 -14.009 -5.763 0.767 1.00 0.00 N ATOM 983 CA PRO A 74 -12.938 -6.185 -0.140 1.00 0.00 C ATOM 984 C PRO A 74 -11.592 -5.570 0.226 1.00 0.00 C ATOM 985 O PRO A 74 -10.575 -5.860 -0.405 1.00 0.00 O ATOM 986 CB PRO A 74 -13.407 -5.674 -1.505 1.00 0.00 C ATOM 987 CG PRO A 74 -14.301 -4.524 -1.192 1.00 0.00 C ATOM 988 CD PRO A 74 -14.974 -4.865 0.109 1.00 0.00 C ATOM 0 HA PRO A 74 -12.776 -7.262 -0.106 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.564 -5.364 -2.122 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.938 -6.450 -2.057 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.731 -3.599 -1.106 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.035 -4.374 -1.984 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.167 -3.974 0.707 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.934 -5.355 -0.052 1.00 0.00 H new ATOM 996 N GLN A 75 -11.593 -4.720 1.247 1.00 0.00 N ATOM 997 CA GLN A 75 -10.371 -4.064 1.696 1.00 0.00 C ATOM 998 C GLN A 75 -9.437 -5.059 2.378 1.00 0.00 C ATOM 999 O GLN A 75 -9.864 -5.849 3.220 1.00 0.00 O ATOM 1000 CB GLN A 75 -10.703 -2.920 2.655 1.00 0.00 C ATOM 1001 CG GLN A 75 -11.000 -1.604 1.954 1.00 0.00 C ATOM 1002 CD GLN A 75 -11.277 -0.474 2.925 1.00 0.00 C ATOM 1003 OE1 GLN A 75 -10.475 -0.196 3.817 1.00 0.00 O ATOM 1004 NE2 GLN A 75 -12.417 0.186 2.757 1.00 0.00 N ATOM 0 H GLN A 75 -12.426 -4.469 1.779 1.00 0.00 H new ATOM 0 HA GLN A 75 -9.864 -3.659 0.820 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.565 -3.202 3.259 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -9.867 -2.777 3.339 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.154 -1.335 1.321 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.861 -1.733 1.298 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -13.053 -0.078 2.004 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -12.657 0.957 3.381 1.00 0.00 H new ATOM 1013 N LEU A 76 -8.162 -5.015 2.007 1.00 0.00 N ATOM 1014 CA LEU A 76 -7.167 -5.914 2.583 1.00 0.00 C ATOM 1015 C LEU A 76 -6.034 -5.127 3.233 1.00 0.00 C ATOM 1016 O LEU A 76 -5.588 -4.109 2.703 1.00 0.00 O ATOM 1017 CB LEU A 76 -6.605 -6.842 1.504 1.00 0.00 C ATOM 1018 CG LEU A 76 -5.296 -7.553 1.847 1.00 0.00 C ATOM 1019 CD1 LEU A 76 -5.568 -8.815 2.651 1.00 0.00 C ATOM 1020 CD2 LEU A 76 -4.521 -7.884 0.579 1.00 0.00 C ATOM 0 H LEU A 76 -7.793 -4.367 1.311 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.656 -6.513 3.351 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.357 -7.598 1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.452 -6.259 0.596 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.690 -6.882 2.456 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -4.624 -9.307 2.886 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -6.081 -8.553 3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.194 -9.490 2.068 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.592 -8.390 0.842 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.122 -8.536 -0.055 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.293 -6.964 0.041 1.00 0.00 H new ATOM 1032 N SER A 77 -5.571 -5.606 4.383 1.00 0.00 N ATOM 1033 CA SER A 77 -4.491 -4.947 5.107 1.00 0.00 C ATOM 1034 C SER A 77 -3.139 -5.274 4.480 1.00 0.00 C ATOM 1035 O SER A 77 -2.982 -6.295 3.809 1.00 0.00 O ATOM 1036 CB SER A 77 -4.500 -5.370 6.577 1.00 0.00 C ATOM 1037 OG SER A 77 -4.110 -6.725 6.720 1.00 0.00 O ATOM 0 H SER A 77 -5.927 -6.449 4.834 1.00 0.00 H new ATOM 0 HA SER A 77 -4.650 -3.870 5.046 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.824 -4.732 7.146 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.498 -5.230 6.993 1.00 0.00 H new ATOM 0 HG SER A 77 -4.122 -6.971 7.669 1.00 0.00 H new ATOM 1043 N LEU A 78 -2.163 -4.400 4.704 1.00 0.00 N ATOM 1044 CA LEU A 78 -0.823 -4.593 4.163 1.00 0.00 C ATOM 1045 C LEU A 78 0.234 -4.042 5.114 1.00 0.00 C ATOM 1046 O LEU A 78 -0.032 -3.119 5.883 1.00 0.00 O ATOM 1047 CB LEU A 78 -0.700 -3.915 2.797 1.00 0.00 C ATOM 1048 CG LEU A 78 -1.312 -4.669 1.616 1.00 0.00 C ATOM 1049 CD1 LEU A 78 -1.094 -3.901 0.322 1.00 0.00 C ATOM 1050 CD2 LEU A 78 -0.722 -6.068 1.513 1.00 0.00 C ATOM 0 H LEU A 78 -2.276 -3.550 5.257 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.657 -5.664 4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.169 -2.933 2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.357 -3.751 2.589 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.385 -4.760 1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.536 -4.453 -0.508 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.564 -2.920 0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.025 -3.778 0.147 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.169 -6.590 0.667 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.356 -5.998 1.368 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.930 -6.619 2.430 1.00 0.00 H new ATOM 1062 N GLN A 79 1.433 -4.612 5.053 1.00 0.00 N ATOM 1063 CA GLN A 79 2.530 -4.176 5.909 1.00 0.00 C ATOM 1064 C GLN A 79 3.788 -3.910 5.088 1.00 0.00 C ATOM 1065 O GLN A 79 4.162 -4.711 4.231 1.00 0.00 O ATOM 1066 CB GLN A 79 2.819 -5.228 6.980 1.00 0.00 C ATOM 1067 CG GLN A 79 1.902 -5.134 8.189 1.00 0.00 C ATOM 1068 CD GLN A 79 2.031 -6.328 9.114 1.00 0.00 C ATOM 1069 OE1 GLN A 79 1.377 -7.352 8.920 1.00 0.00 O ATOM 1070 NE2 GLN A 79 2.879 -6.202 10.129 1.00 0.00 N ATOM 0 H GLN A 79 1.669 -5.376 4.420 1.00 0.00 H new ATOM 0 HA GLN A 79 2.231 -3.247 6.394 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.723 -6.220 6.538 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.853 -5.124 7.310 1.00 0.00 H new ATOM 0 HG2 GLN A 79 2.130 -4.224 8.743 1.00 0.00 H new ATOM 0 HG3 GLN A 79 0.869 -5.051 7.851 1.00 0.00 H new ATOM 0 HE21 GLN A 79 3.401 -5.335 10.252 1.00 0.00 H new ATOM 0 HE22 GLN A 79 3.008 -6.973 10.785 1.00 0.00 H new ATOM 1079 N ILE A 80 4.435 -2.780 5.356 1.00 0.00 N ATOM 1080 CA ILE A 80 5.651 -2.410 4.642 1.00 0.00 C ATOM 1081 C ILE A 80 6.627 -3.579 4.576 1.00 0.00 C ATOM 1082 O ILE A 80 6.900 -4.232 5.583 1.00 0.00 O ATOM 1083 CB ILE A 80 6.349 -1.209 5.306 1.00 0.00 C ATOM 1084 CG1 ILE A 80 5.422 0.008 5.316 1.00 0.00 C ATOM 1085 CG2 ILE A 80 7.648 -0.886 4.584 1.00 0.00 C ATOM 1086 CD1 ILE A 80 5.966 1.177 6.106 1.00 0.00 C ATOM 0 H ILE A 80 4.138 -2.106 6.061 1.00 0.00 H new ATOM 0 HA ILE A 80 5.352 -2.133 3.631 1.00 0.00 H new ATOM 0 HB ILE A 80 6.584 -1.470 6.338 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.243 0.326 4.289 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.458 -0.284 5.732 1.00 0.00 H new ATOM 0 HG21 ILE A 80 8.130 -0.035 5.065 1.00 0.00 H new ATOM 0 HG22 ILE A 80 8.312 -1.750 4.625 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.435 -0.642 3.543 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.256 2.003 6.069 1.00 0.00 H new ATOM 0 HD12 ILE A 80 6.119 0.876 7.142 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.916 1.496 5.677 1.00 0.00 H new ATOM 1098 N GLY A 81 7.154 -3.837 3.383 1.00 0.00 N ATOM 1099 CA GLY A 81 8.096 -4.927 3.207 1.00 0.00 C ATOM 1100 C GLY A 81 7.411 -6.238 2.878 1.00 0.00 C ATOM 1101 O GLY A 81 8.019 -7.305 2.973 1.00 0.00 O ATOM 0 H GLY A 81 6.945 -3.310 2.535 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.794 -4.675 2.408 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.683 -5.046 4.117 1.00 0.00 H new ATOM 1105 N ASP A 82 6.143 -6.160 2.490 1.00 0.00 N ATOM 1106 CA ASP A 82 5.374 -7.351 2.146 1.00 0.00 C ATOM 1107 C ASP A 82 5.101 -7.406 0.646 1.00 0.00 C ATOM 1108 O ASP A 82 4.812 -6.387 0.019 1.00 0.00 O ATOM 1109 CB ASP A 82 4.054 -7.373 2.919 1.00 0.00 C ATOM 1110 CG ASP A 82 4.259 -7.569 4.408 1.00 0.00 C ATOM 1111 OD1 ASP A 82 5.219 -6.989 4.957 1.00 0.00 O ATOM 1112 OD2 ASP A 82 3.459 -8.304 5.026 1.00 0.00 O ATOM 0 H ASP A 82 5.626 -5.285 2.406 1.00 0.00 H new ATOM 0 HA ASP A 82 5.962 -8.226 2.423 1.00 0.00 H new ATOM 0 HB2 ASP A 82 3.521 -6.438 2.749 1.00 0.00 H new ATOM 0 HB3 ASP A 82 3.424 -8.174 2.533 1.00 0.00 H new ATOM 1117 N VAL A 83 5.195 -8.604 0.077 1.00 0.00 N ATOM 1118 CA VAL A 83 4.957 -8.793 -1.349 1.00 0.00 C ATOM 1119 C VAL A 83 3.607 -9.456 -1.599 1.00 0.00 C ATOM 1120 O VAL A 83 3.224 -10.392 -0.898 1.00 0.00 O ATOM 1121 CB VAL A 83 6.064 -9.648 -1.994 1.00 0.00 C ATOM 1122 CG1 VAL A 83 5.772 -9.877 -3.469 1.00 0.00 C ATOM 1123 CG2 VAL A 83 7.423 -8.990 -1.807 1.00 0.00 C ATOM 0 H VAL A 83 5.434 -9.458 0.582 1.00 0.00 H new ATOM 0 HA VAL A 83 4.961 -7.803 -1.804 1.00 0.00 H new ATOM 0 HB VAL A 83 6.084 -10.618 -1.498 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.565 -10.483 -3.907 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.819 -10.395 -3.575 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.722 -8.917 -3.983 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.193 -9.608 -2.269 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.418 -8.006 -2.275 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.633 -8.884 -0.743 1.00 0.00 H new ATOM 1133 N VAL A 84 2.890 -8.964 -2.604 1.00 0.00 N ATOM 1134 CA VAL A 84 1.582 -9.510 -2.948 1.00 0.00 C ATOM 1135 C VAL A 84 1.531 -9.932 -4.412 1.00 0.00 C ATOM 1136 O VAL A 84 2.137 -9.296 -5.274 1.00 0.00 O ATOM 1137 CB VAL A 84 0.460 -8.489 -2.680 1.00 0.00 C ATOM 1138 CG1 VAL A 84 0.442 -8.087 -1.213 1.00 0.00 C ATOM 1139 CG2 VAL A 84 0.626 -7.269 -3.574 1.00 0.00 C ATOM 0 H VAL A 84 3.192 -8.189 -3.194 1.00 0.00 H new ATOM 0 HA VAL A 84 1.427 -10.384 -2.315 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.496 -8.956 -2.915 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.357 -7.365 -1.043 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.271 -8.969 -0.596 1.00 0.00 H new ATOM 0 HG13 VAL A 84 1.399 -7.638 -0.947 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.175 -6.558 -3.372 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.588 -6.799 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.584 -7.575 -4.619 1.00 0.00 H new ATOM 1149 N ARG A 85 0.803 -11.010 -4.686 1.00 0.00 N ATOM 1150 CA ARG A 85 0.673 -11.519 -6.046 1.00 0.00 C ATOM 1151 C ARG A 85 -0.417 -10.769 -6.805 1.00 0.00 C ATOM 1152 O ARG A 85 -1.606 -11.041 -6.634 1.00 0.00 O ATOM 1153 CB ARG A 85 0.357 -13.016 -6.025 1.00 0.00 C ATOM 1154 CG ARG A 85 0.876 -13.764 -7.242 1.00 0.00 C ATOM 1155 CD ARG A 85 2.386 -13.933 -7.190 1.00 0.00 C ATOM 1156 NE ARG A 85 2.779 -15.124 -6.441 1.00 0.00 N ATOM 1157 CZ ARG A 85 2.682 -16.359 -6.920 1.00 0.00 C ATOM 1158 NH1 ARG A 85 2.208 -16.565 -8.141 1.00 0.00 N ATOM 1159 NH2 ARG A 85 3.059 -17.391 -6.177 1.00 0.00 N ATOM 0 H ARG A 85 0.294 -11.548 -3.984 1.00 0.00 H new ATOM 0 HA ARG A 85 1.622 -11.362 -6.558 1.00 0.00 H new ATOM 0 HB2 ARG A 85 0.788 -13.457 -5.126 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -0.723 -13.150 -5.960 1.00 0.00 H new ATOM 0 HG2 ARG A 85 0.401 -14.743 -7.298 1.00 0.00 H new ATOM 0 HG3 ARG A 85 0.600 -13.223 -8.147 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.779 -13.997 -8.205 1.00 0.00 H new ATOM 0 HD3 ARG A 85 2.834 -13.052 -6.730 1.00 0.00 H new ATOM 0 HE ARG A 85 3.148 -15.000 -5.498 1.00 0.00 H new ATOM 0 HH11 ARG A 85 1.917 -15.774 -8.715 1.00 0.00 H new ATOM 0 HH12 ARG A 85 2.135 -17.515 -8.506 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.424 -17.236 -5.237 1.00 0.00 H new ATOM 0 HH22 ARG A 85 2.984 -18.339 -6.546 1.00 0.00 H new ATOM 1173 N ILE A 86 -0.004 -9.823 -7.643 1.00 0.00 N ATOM 1174 CA ILE A 86 -0.946 -9.035 -8.428 1.00 0.00 C ATOM 1175 C ILE A 86 -1.541 -9.860 -9.563 1.00 0.00 C ATOM 1176 O ILE A 86 -0.821 -10.338 -10.439 1.00 0.00 O ATOM 1177 CB ILE A 86 -0.274 -7.780 -9.018 1.00 0.00 C ATOM 1178 CG1 ILE A 86 0.340 -6.932 -7.902 1.00 0.00 C ATOM 1179 CG2 ILE A 86 -1.282 -6.967 -9.816 1.00 0.00 C ATOM 1180 CD1 ILE A 86 1.389 -5.958 -8.392 1.00 0.00 C ATOM 0 H ILE A 86 0.976 -9.584 -7.795 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.742 -8.727 -7.750 1.00 0.00 H new ATOM 0 HB ILE A 86 0.524 -8.094 -9.691 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.453 -6.378 -7.400 1.00 0.00 H new ATOM 0 HG13 ILE A 86 0.787 -7.592 -7.159 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.793 -6.084 -10.227 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -1.677 -7.575 -10.630 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.099 -6.659 -9.164 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.781 -5.390 -7.548 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.201 -6.507 -8.869 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.942 -5.274 -9.113 1.00 0.00 H new ATOM 1192 N GLN A 87 -2.860 -10.021 -9.541 1.00 0.00 N ATOM 1193 CA GLN A 87 -3.553 -10.788 -10.570 1.00 0.00 C ATOM 1194 C GLN A 87 -4.276 -9.864 -11.544 1.00 0.00 C ATOM 1195 O GLN A 87 -4.250 -10.081 -12.755 1.00 0.00 O ATOM 1196 CB GLN A 87 -4.551 -11.755 -9.930 1.00 0.00 C ATOM 1197 CG GLN A 87 -3.923 -12.690 -8.909 1.00 0.00 C ATOM 1198 CD GLN A 87 -3.408 -13.973 -9.531 1.00 0.00 C ATOM 1199 OE1 GLN A 87 -2.937 -13.980 -10.668 1.00 0.00 O ATOM 1200 NE2 GLN A 87 -3.496 -15.069 -8.786 1.00 0.00 N ATOM 0 H GLN A 87 -3.470 -9.631 -8.823 1.00 0.00 H new ATOM 0 HA GLN A 87 -2.808 -11.359 -11.124 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -5.342 -11.181 -9.447 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -5.022 -12.349 -10.713 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -3.101 -12.177 -8.410 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -4.659 -12.932 -8.143 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -3.894 -15.018 -7.848 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -3.166 -15.962 -9.152 1.00 0.00 H new ATOM 1209 N GLU A 88 -4.921 -8.833 -11.006 1.00 0.00 N ATOM 1210 CA GLU A 88 -5.651 -7.877 -11.829 1.00 0.00 C ATOM 1211 C GLU A 88 -5.369 -6.445 -11.381 1.00 0.00 C ATOM 1212 O GLU A 88 -4.736 -6.219 -10.349 1.00 0.00 O ATOM 1213 CB GLU A 88 -7.154 -8.157 -11.763 1.00 0.00 C ATOM 1214 CG GLU A 88 -7.558 -9.468 -12.416 1.00 0.00 C ATOM 1215 CD GLU A 88 -9.002 -9.468 -12.880 1.00 0.00 C ATOM 1216 OE1 GLU A 88 -9.490 -8.397 -13.298 1.00 0.00 O ATOM 1217 OE2 GLU A 88 -9.643 -10.538 -12.825 1.00 0.00 O ATOM 0 H GLU A 88 -4.952 -8.639 -10.005 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.312 -7.990 -12.859 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.467 -8.169 -10.719 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.689 -7.340 -12.247 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.906 -9.661 -13.268 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.408 -10.283 -11.709 1.00 0.00 H new ATOM 1224 N THR A 89 -5.844 -5.482 -12.164 1.00 0.00 N ATOM 1225 CA THR A 89 -5.642 -4.073 -11.850 1.00 0.00 C ATOM 1226 C THR A 89 -6.843 -3.237 -12.277 1.00 0.00 C ATOM 1227 O THR A 89 -7.125 -3.103 -13.469 1.00 0.00 O ATOM 1228 CB THR A 89 -4.377 -3.520 -12.533 1.00 0.00 C ATOM 1229 OG1 THR A 89 -3.235 -4.294 -12.148 1.00 0.00 O ATOM 1230 CG2 THR A 89 -4.156 -2.062 -12.163 1.00 0.00 C ATOM 0 H THR A 89 -6.371 -5.652 -13.020 1.00 0.00 H new ATOM 0 HA THR A 89 -5.521 -4.005 -10.769 1.00 0.00 H new ATOM 0 HB THR A 89 -4.514 -3.587 -13.612 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.743 -3.823 -11.443 1.00 0.00 H new ATOM 0 HG21 THR A 89 -3.257 -1.693 -12.657 1.00 0.00 H new ATOM 0 HG22 THR A 89 -5.014 -1.471 -12.483 1.00 0.00 H new ATOM 0 HG23 THR A 89 -4.038 -1.975 -11.083 1.00 0.00 H new ATOM 1238 N CYS A 90 -7.546 -2.676 -11.300 1.00 0.00 N ATOM 1239 CA CYS A 90 -8.718 -1.852 -11.576 1.00 0.00 C ATOM 1240 C CYS A 90 -8.517 -0.432 -11.058 1.00 0.00 C ATOM 1241 O CYS A 90 -8.067 -0.228 -9.932 1.00 0.00 O ATOM 1242 CB CYS A 90 -9.963 -2.469 -10.937 1.00 0.00 C ATOM 1243 SG CYS A 90 -11.486 -1.545 -11.246 1.00 0.00 S ATOM 0 H CYS A 90 -7.325 -2.776 -10.309 1.00 0.00 H new ATOM 0 HA CYS A 90 -8.856 -1.810 -12.656 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -10.085 -3.485 -11.312 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -9.807 -2.543 -9.861 1.00 0.00 H new ATOM 0 HG CYS A 90 -12.483 -2.146 -10.668 1.00 0.00 H new ATOM 1249 N GLY A 91 -8.853 0.549 -11.891 1.00 0.00 N ATOM 1250 CA GLY A 91 -8.701 1.939 -11.501 1.00 0.00 C ATOM 1251 C GLY A 91 -7.393 2.199 -10.781 1.00 0.00 C ATOM 1252 O GLY A 91 -6.327 1.806 -11.255 1.00 0.00 O ATOM 0 H GLY A 91 -9.228 0.406 -12.829 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.756 2.570 -12.388 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.531 2.225 -10.855 1.00 0.00 H new ATOM 1256 N ASP A 92 -7.474 2.863 -9.633 1.00 0.00 N ATOM 1257 CA ASP A 92 -6.287 3.176 -8.846 1.00 0.00 C ATOM 1258 C ASP A 92 -6.131 2.199 -7.685 1.00 0.00 C ATOM 1259 O ASP A 92 -5.696 2.577 -6.597 1.00 0.00 O ATOM 1260 CB ASP A 92 -6.363 4.609 -8.317 1.00 0.00 C ATOM 1261 CG ASP A 92 -6.560 5.626 -9.424 1.00 0.00 C ATOM 1262 OD1 ASP A 92 -5.766 5.616 -10.388 1.00 0.00 O ATOM 1263 OD2 ASP A 92 -7.511 6.430 -9.328 1.00 0.00 O ATOM 0 H ASP A 92 -8.349 3.195 -9.227 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.416 3.082 -9.495 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -7.185 4.687 -7.605 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.447 4.841 -7.773 1.00 0.00 H new ATOM 1268 N TRP A 93 -6.492 0.943 -7.923 1.00 0.00 N ATOM 1269 CA TRP A 93 -6.393 -0.088 -6.896 1.00 0.00 C ATOM 1270 C TRP A 93 -6.020 -1.433 -7.509 1.00 0.00 C ATOM 1271 O TRP A 93 -6.487 -1.782 -8.593 1.00 0.00 O ATOM 1272 CB TRP A 93 -7.716 -0.208 -6.137 1.00 0.00 C ATOM 1273 CG TRP A 93 -8.076 1.028 -5.370 1.00 0.00 C ATOM 1274 CD1 TRP A 93 -8.427 2.241 -5.889 1.00 0.00 C ATOM 1275 CD2 TRP A 93 -8.117 1.171 -3.946 1.00 0.00 C ATOM 1276 NE1 TRP A 93 -8.684 3.130 -4.874 1.00 0.00 N ATOM 1277 CE2 TRP A 93 -8.502 2.498 -3.672 1.00 0.00 C ATOM 1278 CE3 TRP A 93 -7.869 0.307 -2.876 1.00 0.00 C ATOM 1279 CZ2 TRP A 93 -8.642 2.979 -2.373 1.00 0.00 C ATOM 1280 CZ3 TRP A 93 -8.008 0.786 -1.588 1.00 0.00 C ATOM 1281 CH2 TRP A 93 -8.393 2.111 -1.344 1.00 0.00 C ATOM 0 H TRP A 93 -6.856 0.614 -8.817 1.00 0.00 H new ATOM 0 HA TRP A 93 -5.607 0.202 -6.199 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -8.514 -0.432 -6.845 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -7.656 -1.050 -5.447 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -8.493 2.468 -6.943 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -8.965 4.103 -4.995 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -7.574 -0.717 -3.053 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -8.937 4.001 -2.184 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -7.816 0.127 -0.754 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -8.495 2.454 -0.325 1.00 0.00 H new ATOM 1292 N TYR A 94 -5.176 -2.183 -6.809 1.00 0.00 N ATOM 1293 CA TYR A 94 -4.739 -3.489 -7.287 1.00 0.00 C ATOM 1294 C TYR A 94 -5.616 -4.600 -6.715 1.00 0.00 C ATOM 1295 O TYR A 94 -6.309 -4.407 -5.717 1.00 0.00 O ATOM 1296 CB TYR A 94 -3.278 -3.732 -6.906 1.00 0.00 C ATOM 1297 CG TYR A 94 -2.293 -2.994 -7.784 1.00 0.00 C ATOM 1298 CD1 TYR A 94 -2.215 -3.255 -9.147 1.00 0.00 C ATOM 1299 CD2 TYR A 94 -1.440 -2.035 -7.251 1.00 0.00 C ATOM 1300 CE1 TYR A 94 -1.316 -2.583 -9.952 1.00 0.00 C ATOM 1301 CE2 TYR A 94 -0.539 -1.357 -8.050 1.00 0.00 C ATOM 1302 CZ TYR A 94 -0.480 -1.636 -9.400 1.00 0.00 C ATOM 1303 OH TYR A 94 0.415 -0.964 -10.199 1.00 0.00 O ATOM 0 H TYR A 94 -4.781 -1.909 -5.909 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.832 -3.500 -8.373 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -3.126 -3.429 -5.870 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -3.070 -4.801 -6.960 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.868 -3.996 -9.584 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -1.482 -1.816 -6.194 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -1.268 -2.799 -11.009 1.00 0.00 H new ATOM 0 HE2 TYR A 94 0.115 -0.613 -7.620 1.00 0.00 H new ATOM 0 HH TYR A 94 0.928 -0.331 -9.655 1.00 0.00 H new ATOM 1313 N ARG A 95 -5.579 -5.763 -7.357 1.00 0.00 N ATOM 1314 CA ARG A 95 -6.370 -6.905 -6.915 1.00 0.00 C ATOM 1315 C ARG A 95 -5.496 -8.147 -6.767 1.00 0.00 C ATOM 1316 O ARG A 95 -4.893 -8.613 -7.733 1.00 0.00 O ATOM 1317 CB ARG A 95 -7.504 -7.181 -7.904 1.00 0.00 C ATOM 1318 CG ARG A 95 -8.719 -7.838 -7.270 1.00 0.00 C ATOM 1319 CD ARG A 95 -8.440 -9.286 -6.900 1.00 0.00 C ATOM 1320 NE ARG A 95 -9.637 -9.967 -6.415 1.00 0.00 N ATOM 1321 CZ ARG A 95 -9.606 -11.070 -5.674 1.00 0.00 C ATOM 1322 NH1 ARG A 95 -8.445 -11.613 -5.336 1.00 0.00 N ATOM 1323 NH2 ARG A 95 -10.739 -11.632 -5.271 1.00 0.00 N ATOM 0 H ARG A 95 -5.010 -5.939 -8.185 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.797 -6.664 -5.942 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.809 -6.242 -8.365 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.130 -7.822 -8.703 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -9.010 -7.283 -6.378 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.560 -7.794 -7.962 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.050 -9.814 -7.770 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -7.667 -9.322 -6.133 1.00 0.00 H new ATOM 0 HE ARG A 95 -10.547 -9.575 -6.658 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -7.572 -11.184 -5.645 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -8.424 -12.459 -4.767 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -11.634 -11.217 -5.530 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -10.714 -12.478 -4.702 1.00 0.00 H new ATOM 1337 N GLY A 96 -5.432 -8.678 -5.550 1.00 0.00 N ATOM 1338 CA GLY A 96 -4.629 -9.860 -5.297 1.00 0.00 C ATOM 1339 C GLY A 96 -4.697 -10.310 -3.851 1.00 0.00 C ATOM 1340 O GLY A 96 -5.737 -10.186 -3.204 1.00 0.00 O ATOM 0 H GLY A 96 -5.922 -8.311 -4.734 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.968 -10.670 -5.943 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.592 -9.654 -5.562 1.00 0.00 H new ATOM 1344 N TYR A 97 -3.588 -10.835 -3.344 1.00 0.00 N ATOM 1345 CA TYR A 97 -3.527 -11.308 -1.966 1.00 0.00 C ATOM 1346 C TYR A 97 -2.086 -11.349 -1.467 1.00 0.00 C ATOM 1347 O TYR A 97 -1.142 -11.215 -2.247 1.00 0.00 O ATOM 1348 CB TYR A 97 -4.157 -12.698 -1.854 1.00 0.00 C ATOM 1349 CG TYR A 97 -3.405 -13.767 -2.615 1.00 0.00 C ATOM 1350 CD1 TYR A 97 -2.122 -14.144 -2.236 1.00 0.00 C ATOM 1351 CD2 TYR A 97 -3.977 -14.399 -3.712 1.00 0.00 C ATOM 1352 CE1 TYR A 97 -1.431 -15.120 -2.928 1.00 0.00 C ATOM 1353 CE2 TYR A 97 -3.294 -15.376 -4.409 1.00 0.00 C ATOM 1354 CZ TYR A 97 -2.021 -15.733 -4.014 1.00 0.00 C ATOM 1355 OH TYR A 97 -1.337 -16.705 -4.706 1.00 0.00 O ATOM 0 H TYR A 97 -2.719 -10.944 -3.866 1.00 0.00 H new ATOM 0 HA TYR A 97 -4.088 -10.610 -1.344 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -4.209 -12.981 -0.803 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -5.182 -12.654 -2.223 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.657 -13.666 -1.386 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -4.973 -14.121 -4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.435 -15.401 -2.621 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -3.754 -15.858 -5.259 1.00 0.00 H new ATOM 0 HH TYR A 97 -1.894 -17.036 -5.442 1.00 0.00 H new ATOM 1365 N LEU A 98 -1.924 -11.537 -0.162 1.00 0.00 N ATOM 1366 CA LEU A 98 -0.598 -11.597 0.443 1.00 0.00 C ATOM 1367 C LEU A 98 0.056 -12.951 0.188 1.00 0.00 C ATOM 1368 O LEU A 98 -0.397 -13.976 0.698 1.00 0.00 O ATOM 1369 CB LEU A 98 -0.690 -11.338 1.948 1.00 0.00 C ATOM 1370 CG LEU A 98 0.528 -10.674 2.591 1.00 0.00 C ATOM 1371 CD1 LEU A 98 0.774 -9.304 1.979 1.00 0.00 C ATOM 1372 CD2 LEU A 98 0.341 -10.562 4.097 1.00 0.00 C ATOM 0 H LEU A 98 -2.694 -11.650 0.497 1.00 0.00 H new ATOM 0 HA LEU A 98 0.019 -10.824 -0.016 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.562 -10.711 2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.867 -12.289 2.450 1.00 0.00 H new ATOM 0 HG LEU A 98 1.402 -11.297 2.399 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.645 -8.847 2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.953 -9.410 0.909 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.099 -8.672 2.140 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.217 -10.087 4.538 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.543 -9.961 4.310 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.215 -11.557 4.523 1.00 0.00 H new ATOM 1384 N ILE A 99 1.125 -12.947 -0.602 1.00 0.00 N ATOM 1385 CA ILE A 99 1.843 -14.174 -0.921 1.00 0.00 C ATOM 1386 C ILE A 99 2.284 -14.899 0.346 1.00 0.00 C ATOM 1387 O ILE A 99 2.168 -16.121 0.448 1.00 0.00 O ATOM 1388 CB ILE A 99 3.080 -13.892 -1.794 1.00 0.00 C ATOM 1389 CG1 ILE A 99 2.679 -13.113 -3.049 1.00 0.00 C ATOM 1390 CG2 ILE A 99 3.771 -15.194 -2.170 1.00 0.00 C ATOM 1391 CD1 ILE A 99 3.829 -12.368 -3.691 1.00 0.00 C ATOM 0 H ILE A 99 1.512 -12.107 -1.033 1.00 0.00 H new ATOM 0 HA ILE A 99 1.152 -14.807 -1.477 1.00 0.00 H new ATOM 0 HB ILE A 99 3.780 -13.285 -1.221 1.00 0.00 H new ATOM 0 HG12 ILE A 99 2.254 -13.805 -3.776 1.00 0.00 H new ATOM 0 HG13 ILE A 99 1.895 -12.401 -2.790 1.00 0.00 H new ATOM 0 HG21 ILE A 99 4.643 -14.978 -2.787 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.086 -15.713 -1.265 1.00 0.00 H new ATOM 0 HG23 ILE A 99 3.079 -15.825 -2.728 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.472 -11.839 -4.574 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.240 -11.651 -2.980 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.605 -13.077 -3.981 1.00 0.00 H new ATOM 1403 N LYS A 100 2.788 -14.138 1.311 1.00 0.00 N ATOM 1404 CA LYS A 100 3.244 -14.706 2.574 1.00 0.00 C ATOM 1405 C LYS A 100 2.068 -15.238 3.387 1.00 0.00 C ATOM 1406 O LYS A 100 2.189 -16.243 4.088 1.00 0.00 O ATOM 1407 CB LYS A 100 4.004 -13.654 3.385 1.00 0.00 C ATOM 1408 CG LYS A 100 3.288 -12.317 3.469 1.00 0.00 C ATOM 1409 CD LYS A 100 3.938 -11.400 4.492 1.00 0.00 C ATOM 1410 CE LYS A 100 5.159 -10.699 3.917 1.00 0.00 C ATOM 1411 NZ LYS A 100 5.971 -10.041 4.977 1.00 0.00 N ATOM 0 H LYS A 100 2.891 -13.126 1.243 1.00 0.00 H new ATOM 0 HA LYS A 100 3.913 -15.536 2.350 1.00 0.00 H new ATOM 0 HB2 LYS A 100 4.167 -14.033 4.394 1.00 0.00 H new ATOM 0 HB3 LYS A 100 4.987 -13.503 2.938 1.00 0.00 H new ATOM 0 HG2 LYS A 100 3.297 -11.836 2.491 1.00 0.00 H new ATOM 0 HG3 LYS A 100 2.244 -12.479 3.735 1.00 0.00 H new ATOM 0 HD2 LYS A 100 3.215 -10.657 4.827 1.00 0.00 H new ATOM 0 HD3 LYS A 100 4.229 -11.979 5.368 1.00 0.00 H new ATOM 0 HE2 LYS A 100 5.776 -11.423 3.384 1.00 0.00 H new ATOM 0 HE3 LYS A 100 4.840 -9.954 3.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 6.513 -9.257 4.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 5.341 -9.673 5.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 6.627 -10.733 5.392 1.00 0.00 H new ATOM 1425 N HIS A 101 0.930 -14.558 3.288 1.00 0.00 N ATOM 1426 CA HIS A 101 -0.269 -14.964 4.013 1.00 0.00 C ATOM 1427 C HIS A 101 -1.495 -14.913 3.107 1.00 0.00 C ATOM 1428 O HIS A 101 -2.219 -13.918 3.080 1.00 0.00 O ATOM 1429 CB HIS A 101 -0.483 -14.065 5.232 1.00 0.00 C ATOM 1430 CG HIS A 101 0.627 -14.141 6.234 1.00 0.00 C ATOM 1431 ND1 HIS A 101 0.843 -15.242 7.036 1.00 0.00 N ATOM 1432 CD2 HIS A 101 1.588 -13.245 6.561 1.00 0.00 C ATOM 1433 CE1 HIS A 101 1.887 -15.019 7.815 1.00 0.00 C ATOM 1434 NE2 HIS A 101 2.357 -13.814 7.546 1.00 0.00 N ATOM 0 H HIS A 101 0.813 -13.724 2.713 1.00 0.00 H new ATOM 0 HA HIS A 101 -0.130 -15.992 4.349 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -0.590 -13.033 4.898 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -1.419 -14.341 5.717 1.00 0.00 H new ATOM 0 HD2 HIS A 101 1.724 -12.265 6.128 1.00 0.00 H new ATOM 0 HE1 HIS A 101 2.288 -15.705 8.547 1.00 0.00 H new ATOM 0 HE2 HIS A 101 3.161 -13.377 7.997 1.00 0.00 H new ATOM 1443 N LYS A 102 -1.721 -15.992 2.365 1.00 0.00 N ATOM 1444 CA LYS A 102 -2.860 -16.072 1.458 1.00 0.00 C ATOM 1445 C LYS A 102 -4.175 -16.037 2.230 1.00 0.00 C ATOM 1446 O LYS A 102 -5.218 -15.682 1.682 1.00 0.00 O ATOM 1447 CB LYS A 102 -2.782 -17.350 0.619 1.00 0.00 C ATOM 1448 CG LYS A 102 -1.550 -17.422 -0.266 1.00 0.00 C ATOM 1449 CD LYS A 102 -0.310 -17.788 0.532 1.00 0.00 C ATOM 1450 CE LYS A 102 0.696 -18.548 -0.319 1.00 0.00 C ATOM 1451 NZ LYS A 102 0.159 -19.860 -0.774 1.00 0.00 N ATOM 0 H LYS A 102 -1.130 -16.823 2.374 1.00 0.00 H new ATOM 0 HA LYS A 102 -2.826 -15.207 0.795 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.792 -18.213 1.285 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -3.672 -17.419 -0.006 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.709 -18.160 -1.052 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.397 -16.461 -0.757 1.00 0.00 H new ATOM 0 HD2 LYS A 102 0.153 -16.882 0.923 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.595 -18.396 1.391 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.966 -17.946 -1.186 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.609 -18.709 0.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.945 -20.526 -0.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -0.489 -20.239 -0.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -0.355 -19.733 -1.669 1.00 0.00 H new ATOM 1465 N MET A 103 -4.117 -16.407 3.505 1.00 0.00 N ATOM 1466 CA MET A 103 -5.303 -16.415 4.353 1.00 0.00 C ATOM 1467 C MET A 103 -6.074 -15.105 4.223 1.00 0.00 C ATOM 1468 O MET A 103 -7.261 -15.036 4.544 1.00 0.00 O ATOM 1469 CB MET A 103 -4.912 -16.647 5.813 1.00 0.00 C ATOM 1470 CG MET A 103 -3.786 -15.744 6.291 1.00 0.00 C ATOM 1471 SD MET A 103 -2.824 -16.481 7.627 1.00 0.00 S ATOM 1472 CE MET A 103 -4.123 -16.912 8.782 1.00 0.00 C ATOM 0 H MET A 103 -3.261 -16.705 3.974 1.00 0.00 H new ATOM 0 HA MET A 103 -5.948 -17.230 4.024 1.00 0.00 H new ATOM 0 HB2 MET A 103 -5.786 -16.489 6.444 1.00 0.00 H new ATOM 0 HB3 MET A 103 -4.611 -17.687 5.939 1.00 0.00 H new ATOM 0 HG2 MET A 103 -3.125 -15.520 5.454 1.00 0.00 H new ATOM 0 HG3 MET A 103 -4.204 -14.796 6.630 1.00 0.00 H new ATOM 0 HE1 MET A 103 -3.685 -17.145 9.752 1.00 0.00 H new ATOM 0 HE2 MET A 103 -4.810 -16.072 8.887 1.00 0.00 H new ATOM 0 HE3 MET A 103 -4.666 -17.781 8.411 1.00 0.00 H new ATOM 1482 N LEU A 104 -5.392 -14.067 3.750 1.00 0.00 N ATOM 1483 CA LEU A 104 -6.012 -12.758 3.578 1.00 0.00 C ATOM 1484 C LEU A 104 -5.951 -12.314 2.120 1.00 0.00 C ATOM 1485 O LEU A 104 -4.878 -12.277 1.518 1.00 0.00 O ATOM 1486 CB LEU A 104 -5.321 -11.724 4.468 1.00 0.00 C ATOM 1487 CG LEU A 104 -4.713 -12.254 5.766 1.00 0.00 C ATOM 1488 CD1 LEU A 104 -3.266 -12.669 5.548 1.00 0.00 C ATOM 1489 CD2 LEU A 104 -4.809 -11.208 6.867 1.00 0.00 C ATOM 0 H LEU A 104 -4.410 -14.107 3.479 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.059 -12.838 3.870 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.531 -11.246 3.889 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.045 -10.949 4.720 1.00 0.00 H new ATOM 0 HG LEU A 104 -5.279 -13.132 6.077 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -2.850 -13.044 6.483 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.222 -13.453 4.792 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.687 -11.808 5.213 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.371 -11.603 7.784 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.269 -10.311 6.564 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.856 -10.960 7.043 1.00 0.00 H new ATOM 1501 N GLN A 105 -7.108 -11.977 1.560 1.00 0.00 N ATOM 1502 CA GLN A 105 -7.185 -11.534 0.174 1.00 0.00 C ATOM 1503 C GLN A 105 -8.077 -10.303 0.044 1.00 0.00 C ATOM 1504 O GLN A 105 -8.988 -10.098 0.844 1.00 0.00 O ATOM 1505 CB GLN A 105 -7.717 -12.660 -0.715 1.00 0.00 C ATOM 1506 CG GLN A 105 -7.003 -13.986 -0.509 1.00 0.00 C ATOM 1507 CD GLN A 105 -7.639 -15.119 -1.291 1.00 0.00 C ATOM 1508 OE1 GLN A 105 -8.835 -15.092 -1.582 1.00 0.00 O ATOM 1509 NE2 GLN A 105 -6.841 -16.122 -1.635 1.00 0.00 N ATOM 0 H GLN A 105 -8.005 -12.002 2.045 1.00 0.00 H new ATOM 0 HA GLN A 105 -6.180 -11.268 -0.152 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -8.781 -12.795 -0.519 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.621 -12.363 -1.759 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -5.960 -13.883 -0.809 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -7.006 -14.235 0.552 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -5.856 -16.103 -1.373 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -7.213 -16.912 -2.162 1.00 0.00 H new ATOM 1518 N GLY A 106 -7.807 -9.487 -0.971 1.00 0.00 N ATOM 1519 CA GLY A 106 -8.594 -8.287 -1.186 1.00 0.00 C ATOM 1520 C GLY A 106 -7.938 -7.332 -2.164 1.00 0.00 C ATOM 1521 O GLY A 106 -7.274 -7.760 -3.109 1.00 0.00 O ATOM 0 H GLY A 106 -7.058 -9.636 -1.647 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -9.580 -8.565 -1.559 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.745 -7.780 -0.233 1.00 0.00 H new ATOM 1525 N ILE A 107 -8.125 -6.036 -1.939 1.00 0.00 N ATOM 1526 CA ILE A 107 -7.547 -5.019 -2.808 1.00 0.00 C ATOM 1527 C ILE A 107 -6.757 -3.993 -2.003 1.00 0.00 C ATOM 1528 O ILE A 107 -6.848 -3.946 -0.776 1.00 0.00 O ATOM 1529 CB ILE A 107 -8.633 -4.290 -3.622 1.00 0.00 C ATOM 1530 CG1 ILE A 107 -9.702 -3.718 -2.689 1.00 0.00 C ATOM 1531 CG2 ILE A 107 -9.259 -5.236 -4.636 1.00 0.00 C ATOM 1532 CD1 ILE A 107 -10.705 -2.829 -3.392 1.00 0.00 C ATOM 0 H ILE A 107 -8.672 -5.666 -1.162 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.875 -5.535 -3.494 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.169 -3.465 -4.162 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.232 -4.541 -2.209 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.215 -3.148 -1.898 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -10.024 -4.707 -5.203 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.490 -5.601 -5.317 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.712 -6.080 -4.115 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -11.433 -2.459 -2.670 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -10.187 -1.986 -3.849 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -11.219 -3.401 -4.165 1.00 0.00 H new ATOM 1544 N PHE A 108 -5.982 -3.170 -2.702 1.00 0.00 N ATOM 1545 CA PHE A 108 -5.175 -2.143 -2.053 1.00 0.00 C ATOM 1546 C PHE A 108 -4.793 -1.046 -3.042 1.00 0.00 C ATOM 1547 O PHE A 108 -4.838 -1.229 -4.259 1.00 0.00 O ATOM 1548 CB PHE A 108 -3.914 -2.762 -1.448 1.00 0.00 C ATOM 1549 CG PHE A 108 -3.422 -3.970 -2.193 1.00 0.00 C ATOM 1550 CD1 PHE A 108 -3.921 -5.230 -1.903 1.00 0.00 C ATOM 1551 CD2 PHE A 108 -2.461 -3.846 -3.184 1.00 0.00 C ATOM 1552 CE1 PHE A 108 -3.470 -6.343 -2.587 1.00 0.00 C ATOM 1553 CE2 PHE A 108 -2.007 -4.956 -3.872 1.00 0.00 C ATOM 1554 CZ PHE A 108 -2.512 -6.206 -3.573 1.00 0.00 C ATOM 0 H PHE A 108 -5.896 -3.194 -3.718 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.771 -1.698 -1.256 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -3.124 -2.011 -1.428 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.116 -3.040 -0.414 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -4.671 -5.343 -1.134 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -2.062 -2.871 -3.422 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -3.866 -7.320 -2.351 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -1.258 -4.846 -4.642 1.00 0.00 H new ATOM 0 HZ PHE A 108 -2.159 -7.075 -4.109 1.00 0.00 H new ATOM 1564 N PRO A 109 -4.409 0.123 -2.509 1.00 0.00 N ATOM 1565 CA PRO A 109 -4.012 1.274 -3.326 1.00 0.00 C ATOM 1566 C PRO A 109 -2.681 1.048 -4.036 1.00 0.00 C ATOM 1567 O PRO A 109 -1.711 0.593 -3.430 1.00 0.00 O ATOM 1568 CB PRO A 109 -3.888 2.408 -2.305 1.00 0.00 C ATOM 1569 CG PRO A 109 -3.601 1.724 -1.013 1.00 0.00 C ATOM 1570 CD PRO A 109 -4.332 0.412 -1.067 1.00 0.00 C ATOM 0 HA PRO A 109 -4.729 1.476 -4.122 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -3.088 3.098 -2.574 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -4.807 2.992 -2.248 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -2.530 1.569 -0.883 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -3.940 2.325 -0.170 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -3.795 -0.369 -0.529 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -5.323 0.485 -0.618 1.00 0.00 H new ATOM 1578 N LYS A 110 -2.642 1.370 -5.325 1.00 0.00 N ATOM 1579 CA LYS A 110 -1.430 1.205 -6.118 1.00 0.00 C ATOM 1580 C LYS A 110 -0.318 2.118 -5.610 1.00 0.00 C ATOM 1581 O LYS A 110 0.865 1.819 -5.771 1.00 0.00 O ATOM 1582 CB LYS A 110 -1.716 1.504 -7.592 1.00 0.00 C ATOM 1583 CG LYS A 110 -2.921 0.760 -8.140 1.00 0.00 C ATOM 1584 CD LYS A 110 -3.460 1.421 -9.398 1.00 0.00 C ATOM 1585 CE LYS A 110 -2.693 0.976 -10.634 1.00 0.00 C ATOM 1586 NZ LYS A 110 -3.067 1.773 -11.835 1.00 0.00 N ATOM 0 H LYS A 110 -3.436 1.747 -5.842 1.00 0.00 H new ATOM 0 HA LYS A 110 -1.100 0.171 -6.020 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -1.875 2.576 -7.713 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.839 1.244 -8.184 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -2.644 -0.271 -8.360 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -3.704 0.725 -7.382 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.515 1.176 -9.516 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.394 2.504 -9.298 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.623 1.074 -10.452 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.889 -0.079 -10.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -2.758 1.274 -12.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -4.099 1.899 -11.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.606 2.704 -11.791 1.00 0.00 H new ATOM 1600 N SER A 111 -0.707 3.230 -4.995 1.00 0.00 N ATOM 1601 CA SER A 111 0.258 4.187 -4.465 1.00 0.00 C ATOM 1602 C SER A 111 1.040 3.583 -3.304 1.00 0.00 C ATOM 1603 O SER A 111 2.056 4.130 -2.873 1.00 0.00 O ATOM 1604 CB SER A 111 -0.455 5.461 -4.007 1.00 0.00 C ATOM 1605 OG SER A 111 -0.656 6.351 -5.092 1.00 0.00 O ATOM 0 H SER A 111 -1.683 3.491 -4.851 1.00 0.00 H new ATOM 0 HA SER A 111 0.959 4.438 -5.261 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.416 5.204 -3.561 1.00 0.00 H new ATOM 0 HB3 SER A 111 0.134 5.953 -3.233 1.00 0.00 H new ATOM 0 HG SER A 111 -1.115 7.156 -4.774 1.00 0.00 H new ATOM 1611 N PHE A 112 0.560 2.451 -2.800 1.00 0.00 N ATOM 1612 CA PHE A 112 1.213 1.772 -1.687 1.00 0.00 C ATOM 1613 C PHE A 112 1.990 0.552 -2.175 1.00 0.00 C ATOM 1614 O PHE A 112 2.818 0.000 -1.450 1.00 0.00 O ATOM 1615 CB PHE A 112 0.178 1.347 -0.643 1.00 0.00 C ATOM 1616 CG PHE A 112 -0.351 2.490 0.175 1.00 0.00 C ATOM 1617 CD1 PHE A 112 -0.927 3.591 -0.439 1.00 0.00 C ATOM 1618 CD2 PHE A 112 -0.273 2.464 1.558 1.00 0.00 C ATOM 1619 CE1 PHE A 112 -1.414 4.644 0.312 1.00 0.00 C ATOM 1620 CE2 PHE A 112 -0.759 3.514 2.314 1.00 0.00 C ATOM 1621 CZ PHE A 112 -1.331 4.605 1.690 1.00 0.00 C ATOM 0 H PHE A 112 -0.279 1.984 -3.145 1.00 0.00 H new ATOM 0 HA PHE A 112 1.915 2.469 -1.230 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.654 0.855 -1.147 1.00 0.00 H new ATOM 0 HB3 PHE A 112 0.627 0.611 0.024 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -0.996 3.626 -1.516 1.00 0.00 H new ATOM 0 HD2 PHE A 112 0.173 1.613 2.051 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -1.859 5.497 -0.178 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -0.691 3.481 3.391 1.00 0.00 H new ATOM 0 HZ PHE A 112 -1.713 5.426 2.278 1.00 0.00 H new ATOM 1631 N ILE A 113 1.715 0.137 -3.407 1.00 0.00 N ATOM 1632 CA ILE A 113 2.388 -1.016 -3.991 1.00 0.00 C ATOM 1633 C ILE A 113 3.532 -0.582 -4.902 1.00 0.00 C ATOM 1634 O ILE A 113 3.336 0.201 -5.832 1.00 0.00 O ATOM 1635 CB ILE A 113 1.409 -1.890 -4.797 1.00 0.00 C ATOM 1636 CG1 ILE A 113 0.260 -2.363 -3.904 1.00 0.00 C ATOM 1637 CG2 ILE A 113 2.138 -3.079 -5.406 1.00 0.00 C ATOM 1638 CD1 ILE A 113 0.723 -3.022 -2.623 1.00 0.00 C ATOM 0 H ILE A 113 1.031 0.582 -4.019 1.00 0.00 H new ATOM 0 HA ILE A 113 2.788 -1.601 -3.163 1.00 0.00 H new ATOM 0 HB ILE A 113 0.992 -1.291 -5.607 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.372 -1.510 -3.657 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.358 -3.066 -4.462 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.433 -3.687 -5.972 1.00 0.00 H new ATOM 0 HG22 ILE A 113 2.925 -2.722 -6.071 1.00 0.00 H new ATOM 0 HG23 ILE A 113 2.580 -3.681 -4.612 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -0.144 -3.332 -2.039 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.331 -3.895 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.316 -2.314 -2.044 1.00 0.00 H new ATOM 1650 N HIS A 114 4.727 -1.097 -4.629 1.00 0.00 N ATOM 1651 CA HIS A 114 5.903 -0.765 -5.425 1.00 0.00 C ATOM 1652 C HIS A 114 6.188 -1.855 -6.454 1.00 0.00 C ATOM 1653 O HIS A 114 6.790 -2.880 -6.135 1.00 0.00 O ATOM 1654 CB HIS A 114 7.119 -0.571 -4.520 1.00 0.00 C ATOM 1655 CG HIS A 114 8.370 -0.217 -5.265 1.00 0.00 C ATOM 1656 ND1 HIS A 114 8.519 0.958 -5.970 1.00 0.00 N ATOM 1657 CD2 HIS A 114 9.534 -0.892 -5.411 1.00 0.00 C ATOM 1658 CE1 HIS A 114 9.720 0.991 -6.519 1.00 0.00 C ATOM 1659 NE2 HIS A 114 10.356 -0.121 -6.195 1.00 0.00 N ATOM 0 H HIS A 114 4.906 -1.746 -3.863 1.00 0.00 H new ATOM 0 HA HIS A 114 5.702 0.166 -5.955 1.00 0.00 H new ATOM 0 HB2 HIS A 114 6.902 0.215 -3.797 1.00 0.00 H new ATOM 0 HB3 HIS A 114 7.290 -1.487 -3.954 1.00 0.00 H new ATOM 0 HD2 HIS A 114 9.772 -1.857 -4.989 1.00 0.00 H new ATOM 0 HE1 HIS A 114 10.115 1.790 -7.129 1.00 0.00 H new ATOM 0 HE2 HIS A 114 11.304 -0.367 -6.481 1.00 0.00 H new ATOM 1668 N ILE A 115 5.751 -1.626 -7.688 1.00 0.00 N ATOM 1669 CA ILE A 115 5.960 -2.588 -8.763 1.00 0.00 C ATOM 1670 C ILE A 115 7.438 -2.704 -9.117 1.00 0.00 C ATOM 1671 O ILE A 115 8.033 -1.773 -9.661 1.00 0.00 O ATOM 1672 CB ILE A 115 5.169 -2.201 -10.027 1.00 0.00 C ATOM 1673 CG1 ILE A 115 3.684 -2.041 -9.697 1.00 0.00 C ATOM 1674 CG2 ILE A 115 5.366 -3.245 -11.115 1.00 0.00 C ATOM 1675 CD1 ILE A 115 3.088 -3.241 -8.994 1.00 0.00 C ATOM 0 H ILE A 115 5.250 -0.783 -7.968 1.00 0.00 H new ATOM 0 HA ILE A 115 5.599 -3.550 -8.400 1.00 0.00 H new ATOM 0 HB ILE A 115 5.545 -1.246 -10.395 1.00 0.00 H new ATOM 0 HG12 ILE A 115 3.553 -1.160 -9.069 1.00 0.00 H new ATOM 0 HG13 ILE A 115 3.133 -1.860 -10.620 1.00 0.00 H new ATOM 0 HG21 ILE A 115 4.801 -2.958 -12.002 1.00 0.00 H new ATOM 0 HG22 ILE A 115 6.425 -3.314 -11.366 1.00 0.00 H new ATOM 0 HG23 ILE A 115 5.014 -4.213 -10.758 1.00 0.00 H new ATOM 0 HD11 ILE A 115 2.033 -3.057 -8.791 1.00 0.00 H new ATOM 0 HD12 ILE A 115 3.187 -4.121 -9.629 1.00 0.00 H new ATOM 0 HD13 ILE A 115 3.614 -3.410 -8.054 1.00 0.00 H new ATOM 1687 N LYS A 116 8.027 -3.855 -8.807 1.00 0.00 N ATOM 1688 CA LYS A 116 9.435 -4.096 -9.095 1.00 0.00 C ATOM 1689 C LYS A 116 9.621 -4.595 -10.524 1.00 0.00 C ATOM 1690 O LYS A 116 8.968 -5.547 -10.948 1.00 0.00 O ATOM 1691 CB LYS A 116 10.011 -5.115 -8.109 1.00 0.00 C ATOM 1692 CG LYS A 116 9.773 -4.754 -6.653 1.00 0.00 C ATOM 1693 CD LYS A 116 9.766 -5.988 -5.766 1.00 0.00 C ATOM 1694 CE LYS A 116 11.162 -6.324 -5.266 1.00 0.00 C ATOM 1695 NZ LYS A 116 11.146 -7.446 -4.287 1.00 0.00 N ATOM 0 H LYS A 116 7.550 -4.635 -8.356 1.00 0.00 H new ATOM 0 HA LYS A 116 9.969 -3.152 -8.986 1.00 0.00 H new ATOM 0 HB2 LYS A 116 9.570 -6.091 -8.309 1.00 0.00 H new ATOM 0 HB3 LYS A 116 11.083 -5.208 -8.281 1.00 0.00 H new ATOM 0 HG2 LYS A 116 10.549 -4.067 -6.316 1.00 0.00 H new ATOM 0 HG3 LYS A 116 8.821 -4.231 -6.558 1.00 0.00 H new ATOM 0 HD2 LYS A 116 9.104 -5.822 -4.916 1.00 0.00 H new ATOM 0 HD3 LYS A 116 9.364 -6.835 -6.322 1.00 0.00 H new ATOM 0 HE2 LYS A 116 11.796 -6.589 -6.112 1.00 0.00 H new ATOM 0 HE3 LYS A 116 11.603 -5.442 -4.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 12.005 -7.409 -3.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 10.308 -7.363 -3.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 11.114 -8.352 -4.797 1.00 0.00 H new ATOM 1709 N GLU A 117 10.517 -3.945 -11.261 1.00 0.00 N ATOM 1710 CA GLU A 117 10.788 -4.325 -12.642 1.00 0.00 C ATOM 1711 C GLU A 117 12.289 -4.447 -12.889 1.00 0.00 C ATOM 1712 O GLU A 117 12.810 -3.938 -13.881 1.00 0.00 O ATOM 1713 CB GLU A 117 10.184 -3.300 -13.604 1.00 0.00 C ATOM 1714 CG GLU A 117 8.828 -2.776 -13.163 1.00 0.00 C ATOM 1715 CD GLU A 117 7.678 -3.602 -13.707 1.00 0.00 C ATOM 1716 OE1 GLU A 117 7.867 -4.819 -13.914 1.00 0.00 O ATOM 1717 OE2 GLU A 117 6.589 -3.031 -13.925 1.00 0.00 O ATOM 0 H GLU A 117 11.066 -3.154 -10.925 1.00 0.00 H new ATOM 0 HA GLU A 117 10.328 -5.297 -12.821 1.00 0.00 H new ATOM 0 HB2 GLU A 117 10.872 -2.461 -13.707 1.00 0.00 H new ATOM 0 HB3 GLU A 117 10.085 -3.754 -14.590 1.00 0.00 H new ATOM 0 HG2 GLU A 117 8.782 -2.769 -12.074 1.00 0.00 H new ATOM 0 HG3 GLU A 117 8.717 -1.743 -13.493 1.00 0.00 H new ATOM 1724 N VAL A 118 12.979 -5.125 -11.977 1.00 0.00 N ATOM 1725 CA VAL A 118 14.420 -5.315 -12.095 1.00 0.00 C ATOM 1726 C VAL A 118 14.769 -6.120 -13.341 1.00 0.00 C ATOM 1727 O VAL A 118 15.936 -6.225 -13.721 1.00 0.00 O ATOM 1728 CB VAL A 118 14.995 -6.030 -10.857 1.00 0.00 C ATOM 1729 CG1 VAL A 118 14.953 -5.114 -9.644 1.00 0.00 C ATOM 1730 CG2 VAL A 118 14.235 -7.320 -10.588 1.00 0.00 C ATOM 0 H VAL A 118 12.564 -5.552 -11.149 1.00 0.00 H new ATOM 0 HA VAL A 118 14.864 -4.323 -12.172 1.00 0.00 H new ATOM 0 HB VAL A 118 16.037 -6.283 -11.055 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.363 -5.636 -8.779 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.545 -4.220 -9.842 1.00 0.00 H new ATOM 0 HG13 VAL A 118 13.921 -4.828 -9.439 1.00 0.00 H new ATOM 0 HG21 VAL A 118 14.654 -7.813 -9.710 1.00 0.00 H new ATOM 0 HG22 VAL A 118 13.184 -7.093 -10.410 1.00 0.00 H new ATOM 0 HG23 VAL A 118 14.322 -7.980 -11.451 1.00 0.00 H new ATOM 1740 N THR A 119 13.748 -6.689 -13.976 1.00 0.00 N ATOM 1741 CA THR A 119 13.946 -7.486 -15.180 1.00 0.00 C ATOM 1742 C THR A 119 13.794 -6.634 -16.435 1.00 0.00 C ATOM 1743 O THR A 119 12.680 -6.375 -16.891 1.00 0.00 O ATOM 1744 CB THR A 119 12.951 -8.659 -15.247 1.00 0.00 C ATOM 1745 OG1 THR A 119 11.733 -8.308 -14.579 1.00 0.00 O ATOM 1746 CG2 THR A 119 13.542 -9.907 -14.609 1.00 0.00 C ATOM 0 H THR A 119 12.776 -6.612 -13.676 1.00 0.00 H new ATOM 0 HA THR A 119 14.961 -7.882 -15.133 1.00 0.00 H new ATOM 0 HB THR A 119 12.742 -8.869 -16.296 1.00 0.00 H new ATOM 0 HG1 THR A 119 11.105 -9.059 -14.628 1.00 0.00 H new ATOM 0 HG21 THR A 119 12.821 -10.722 -14.668 1.00 0.00 H new ATOM 0 HG22 THR A 119 14.453 -10.189 -15.137 1.00 0.00 H new ATOM 0 HG23 THR A 119 13.776 -9.705 -13.564 1.00 0.00 H new TER 1754 THR A 119