USER MOD reduce.3.24.130724 H: found=0, std=0, add=595, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 598 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 141 LYS NZ :NH3+ 140:sc= 0.398 (180deg=0.00303) USER MOD Set 1.2: A 143 MET CE :methyl -133:sc= -0.0866 (180deg=-2.31!) USER MOD Set 2.1: A 121 ASN : amide:sc= -6.61! C(o=-6.4!,f=-4.7!) USER MOD Set 2.2: A 140 THR OG1 : rot 100:sc= 0.163 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -0.239 X(o=-0.24,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -3.67 K(o=-3.7,f=-7.6!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 44:sc= -3.16! USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 108 GLN : amide:sc=-0.00846 K(o=-0.0085,f=-0.55) USER MOD Single : A 110 SER OG : rot 180:sc= -0.706 USER MOD Single : A 112 HIS : no HD1:sc= -1.94 K(o=-1.9,f=-3.6!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc=-0.00157 X(o=-0.0016,f=0) USER MOD Single : A 126 THR OG1 : rot -84:sc= 0.913 USER MOD Single : A 127 ASN : amide:sc= -1.04 K(o=-1,f=-0.17) USER MOD Single : A 128 HIS : no HD1:sc= -4.83! K(o=-4.8!,f=-1) USER MOD Single : A 129 SER OG : rot 180:sc=0.000665 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 GLN : amide:sc= -2.39 K(o=-2.4,f=-6!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 MET CE :methyl -152:sc= -3.34 (180deg=-5.67!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 SER OG : rot 180:sc= -2.07 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -5.13 K(o=-5.1,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 69 13.729 0.310 6.351 1.00 0.00 N ATOM 2 CA VAL A 69 12.504 0.054 5.548 1.00 0.00 C ATOM 3 C VAL A 69 11.644 -1.028 6.188 1.00 0.00 C ATOM 4 O VAL A 69 12.028 -1.637 7.187 1.00 0.00 O ATOM 5 CB VAL A 69 12.851 -0.373 4.108 1.00 0.00 C ATOM 6 CG1 VAL A 69 13.553 0.757 3.368 1.00 0.00 C ATOM 7 CG2 VAL A 69 13.706 -1.632 4.111 1.00 0.00 C ATOM 0 HA VAL A 69 11.947 0.991 5.518 1.00 0.00 H new ATOM 0 HB VAL A 69 11.922 -0.597 3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 69 13.790 0.436 2.354 1.00 0.00 H new ATOM 0 HG12 VAL A 69 12.899 1.628 3.330 1.00 0.00 H new ATOM 0 HG13 VAL A 69 14.474 1.017 3.890 1.00 0.00 H new ATOM 0 HG21 VAL A 69 13.939 -1.916 3.085 1.00 0.00 H new ATOM 0 HG22 VAL A 69 14.632 -1.442 4.654 1.00 0.00 H new ATOM 0 HG23 VAL A 69 13.160 -2.441 4.596 1.00 0.00 H new ATOM 17 N ARG A 70 10.477 -1.261 5.602 1.00 0.00 N ATOM 18 CA ARG A 70 9.548 -2.268 6.100 1.00 0.00 C ATOM 19 C ARG A 70 8.671 -2.769 4.959 1.00 0.00 C ATOM 20 O ARG A 70 8.597 -2.132 3.912 1.00 0.00 O ATOM 21 CB ARG A 70 8.701 -1.680 7.247 1.00 0.00 C ATOM 22 CG ARG A 70 7.238 -1.417 6.904 1.00 0.00 C ATOM 23 CD ARG A 70 6.346 -2.571 7.338 1.00 0.00 C ATOM 24 NE ARG A 70 5.937 -2.449 8.736 1.00 0.00 N ATOM 25 CZ ARG A 70 6.533 -3.081 9.748 1.00 0.00 C ATOM 26 NH1 ARG A 70 7.557 -3.896 9.528 1.00 0.00 N ATOM 27 NH2 ARG A 70 6.098 -2.898 10.987 1.00 0.00 N ATOM 0 H ARG A 70 10.149 -0.762 4.775 1.00 0.00 H new ATOM 0 HA ARG A 70 10.105 -3.117 6.496 1.00 0.00 H new ATOM 0 HB2 ARG A 70 8.742 -2.364 8.095 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.156 -0.744 7.570 1.00 0.00 H new ATOM 0 HG2 ARG A 70 6.909 -0.499 7.390 1.00 0.00 H new ATOM 0 HG3 ARG A 70 7.137 -1.262 5.830 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.461 -2.604 6.703 1.00 0.00 H new ATOM 0 HD3 ARG A 70 6.876 -3.513 7.196 1.00 0.00 H new ATOM 0 HE ARG A 70 5.146 -1.842 8.951 1.00 0.00 H new ATOM 0 HH11 ARG A 70 7.896 -4.044 8.577 1.00 0.00 H new ATOM 0 HH12 ARG A 70 8.005 -4.374 10.310 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.310 -2.275 11.164 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.552 -3.380 11.763 1.00 0.00 H new ATOM 41 N LEU A 71 8.011 -3.905 5.153 1.00 0.00 N ATOM 42 CA LEU A 71 7.152 -4.450 4.110 1.00 0.00 C ATOM 43 C LEU A 71 5.827 -4.950 4.684 1.00 0.00 C ATOM 44 O LEU A 71 5.752 -5.359 5.843 1.00 0.00 O ATOM 45 CB LEU A 71 7.883 -5.566 3.343 1.00 0.00 C ATOM 46 CG LEU A 71 7.531 -7.011 3.731 1.00 0.00 C ATOM 47 CD1 LEU A 71 7.100 -7.798 2.504 1.00 0.00 C ATOM 48 CD2 LEU A 71 8.713 -7.686 4.411 1.00 0.00 C ATOM 0 H LEU A 71 8.053 -4.459 6.009 1.00 0.00 H new ATOM 0 HA LEU A 71 6.919 -3.648 3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.679 -5.439 2.280 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.955 -5.428 3.480 1.00 0.00 H new ATOM 0 HG LEU A 71 6.700 -6.987 4.436 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.854 -8.819 2.795 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.224 -7.327 2.059 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.913 -7.813 1.778 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.444 -8.708 4.678 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.564 -7.701 3.731 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.978 -7.133 5.312 1.00 0.00 H new ATOM 60 N ILE A 72 4.790 -4.920 3.855 1.00 0.00 N ATOM 61 CA ILE A 72 3.465 -5.375 4.257 1.00 0.00 C ATOM 62 C ILE A 72 2.949 -6.421 3.278 1.00 0.00 C ATOM 63 O ILE A 72 2.883 -6.173 2.075 1.00 0.00 O ATOM 64 CB ILE A 72 2.463 -4.206 4.319 1.00 0.00 C ATOM 65 CG1 ILE A 72 3.049 -3.048 5.131 1.00 0.00 C ATOM 66 CG2 ILE A 72 1.140 -4.671 4.912 1.00 0.00 C ATOM 67 CD1 ILE A 72 3.101 -3.311 6.621 1.00 0.00 C ATOM 0 H ILE A 72 4.843 -4.583 2.894 1.00 0.00 H new ATOM 0 HA ILE A 72 3.556 -5.810 5.252 1.00 0.00 H new ATOM 0 HB ILE A 72 2.274 -3.852 3.306 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.057 -2.839 4.773 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.455 -2.152 4.950 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.443 -3.833 4.949 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.722 -5.464 4.292 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.306 -5.049 5.921 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.528 -2.446 7.128 1.00 0.00 H new ATOM 0 HD12 ILE A 72 2.093 -3.490 6.994 1.00 0.00 H new ATOM 0 HD13 ILE A 72 3.720 -4.187 6.814 1.00 0.00 H new ATOM 79 N GLN A 73 2.593 -7.593 3.792 1.00 0.00 N ATOM 80 CA GLN A 73 2.097 -8.667 2.944 1.00 0.00 C ATOM 81 C GLN A 73 0.645 -9.000 3.256 1.00 0.00 C ATOM 82 O GLN A 73 0.318 -9.416 4.368 1.00 0.00 O ATOM 83 CB GLN A 73 2.960 -9.918 3.114 1.00 0.00 C ATOM 84 CG GLN A 73 4.103 -10.008 2.121 1.00 0.00 C ATOM 85 CD GLN A 73 4.587 -11.431 1.916 1.00 0.00 C ATOM 86 OE1 GLN A 73 5.144 -12.046 2.823 1.00 0.00 O ATOM 87 NE2 GLN A 73 4.372 -11.960 0.716 1.00 0.00 N ATOM 0 H GLN A 73 2.639 -7.821 4.785 1.00 0.00 H new ATOM 0 HA GLN A 73 2.153 -8.323 1.911 1.00 0.00 H new ATOM 0 HB2 GLN A 73 3.366 -9.934 4.125 1.00 0.00 H new ATOM 0 HB3 GLN A 73 2.329 -10.801 3.010 1.00 0.00 H new ATOM 0 HG2 GLN A 73 3.782 -9.596 1.164 1.00 0.00 H new ATOM 0 HG3 GLN A 73 4.932 -9.393 2.470 1.00 0.00 H new ATOM 0 HE21 GLN A 73 3.906 -11.412 -0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 73 4.673 -12.914 0.518 1.00 0.00 H new ATOM 96 N PHE A 74 -0.219 -8.832 2.263 1.00 0.00 N ATOM 97 CA PHE A 74 -1.635 -9.137 2.433 1.00 0.00 C ATOM 98 C PHE A 74 -2.149 -9.962 1.260 1.00 0.00 C ATOM 99 O PHE A 74 -1.389 -10.305 0.355 1.00 0.00 O ATOM 100 CB PHE A 74 -2.463 -7.857 2.599 1.00 0.00 C ATOM 101 CG PHE A 74 -2.401 -6.913 1.429 1.00 0.00 C ATOM 102 CD1 PHE A 74 -2.879 -7.287 0.182 1.00 0.00 C ATOM 103 CD2 PHE A 74 -1.872 -5.642 1.584 1.00 0.00 C ATOM 104 CE1 PHE A 74 -2.830 -6.411 -0.886 1.00 0.00 C ATOM 105 CE2 PHE A 74 -1.820 -4.763 0.520 1.00 0.00 C ATOM 106 CZ PHE A 74 -2.300 -5.147 -0.715 1.00 0.00 C ATOM 0 H PHE A 74 0.033 -8.488 1.336 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.745 -9.725 3.344 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -3.503 -8.133 2.771 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -2.121 -7.332 3.491 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -3.294 -8.274 0.044 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -1.496 -5.335 2.549 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -3.205 -6.714 -1.852 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -1.404 -3.776 0.655 1.00 0.00 H new ATOM 0 HZ PHE A 74 -2.261 -4.460 -1.547 1.00 0.00 H new ATOM 116 N GLU A 75 -3.438 -10.288 1.280 1.00 0.00 N ATOM 117 CA GLU A 75 -4.037 -11.083 0.213 1.00 0.00 C ATOM 118 C GLU A 75 -5.334 -10.459 -0.294 1.00 0.00 C ATOM 119 O GLU A 75 -6.046 -9.785 0.451 1.00 0.00 O ATOM 120 CB GLU A 75 -4.308 -12.509 0.705 1.00 0.00 C ATOM 121 CG GLU A 75 -5.518 -12.625 1.621 1.00 0.00 C ATOM 122 CD GLU A 75 -5.760 -14.046 2.092 1.00 0.00 C ATOM 123 OE1 GLU A 75 -5.626 -14.975 1.268 1.00 0.00 O ATOM 124 OE2 GLU A 75 -6.081 -14.229 3.284 1.00 0.00 O ATOM 0 H GLU A 75 -4.085 -10.015 2.020 1.00 0.00 H new ATOM 0 HA GLU A 75 -3.328 -11.110 -0.615 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.454 -13.159 -0.158 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.428 -12.874 1.234 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.376 -11.978 2.487 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.402 -12.265 1.096 1.00 0.00 H new ATOM 244 N GLY A 83 -8.682 -2.492 1.185 1.00 0.00 N ATOM 245 CA GLY A 83 -9.306 -1.223 0.856 1.00 0.00 C ATOM 246 C GLY A 83 -8.547 -0.030 1.405 1.00 0.00 C ATOM 247 O GLY A 83 -9.028 0.656 2.305 1.00 0.00 O ATOM 0 HA2 GLY A 83 -9.381 -1.131 -0.228 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.323 -1.212 1.248 1.00 0.00 H new ATOM 251 N ILE A 84 -7.363 0.226 0.857 1.00 0.00 N ATOM 252 CA ILE A 84 -6.548 1.353 1.297 1.00 0.00 C ATOM 253 C ILE A 84 -6.226 2.282 0.133 1.00 0.00 C ATOM 254 O ILE A 84 -5.925 1.834 -0.974 1.00 0.00 O ATOM 255 CB ILE A 84 -5.227 0.886 1.953 1.00 0.00 C ATOM 256 CG1 ILE A 84 -4.246 2.054 2.109 1.00 0.00 C ATOM 257 CG2 ILE A 84 -4.597 -0.230 1.137 1.00 0.00 C ATOM 258 CD1 ILE A 84 -3.443 2.002 3.390 1.00 0.00 C ATOM 0 H ILE A 84 -6.948 -0.330 0.110 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.135 1.892 2.041 1.00 0.00 H new ATOM 0 HB ILE A 84 -5.459 0.505 2.948 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -3.562 2.059 1.261 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.801 2.991 2.076 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.668 -0.548 1.611 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.284 -1.074 1.083 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.385 0.130 0.130 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.770 2.859 3.433 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.119 2.028 4.245 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.860 1.081 3.417 1.00 0.00 H new ATOM 270 N THR A 85 -6.279 3.578 0.403 1.00 0.00 N ATOM 271 CA THR A 85 -5.981 4.586 -0.602 1.00 0.00 C ATOM 272 C THR A 85 -4.782 5.415 -0.161 1.00 0.00 C ATOM 273 O THR A 85 -4.474 5.488 1.028 1.00 0.00 O ATOM 274 CB THR A 85 -7.192 5.492 -0.831 1.00 0.00 C ATOM 275 OG1 THR A 85 -8.343 4.723 -1.128 1.00 0.00 O ATOM 276 CG2 THR A 85 -6.994 6.478 -1.960 1.00 0.00 C ATOM 0 H THR A 85 -6.528 3.957 1.317 1.00 0.00 H new ATOM 0 HA THR A 85 -5.745 4.085 -1.541 1.00 0.00 H new ATOM 0 HB THR A 85 -7.318 6.048 0.098 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.107 5.320 -1.270 1.00 0.00 H new ATOM 0 HG21 THR A 85 -7.889 7.090 -2.070 1.00 0.00 H new ATOM 0 HG22 THR A 85 -6.141 7.119 -1.738 1.00 0.00 H new ATOM 0 HG23 THR A 85 -6.809 5.937 -2.888 1.00 0.00 H new ATOM 284 N LEU A 86 -4.103 6.034 -1.117 1.00 0.00 N ATOM 285 CA LEU A 86 -2.936 6.846 -0.800 1.00 0.00 C ATOM 286 C LEU A 86 -2.904 8.125 -1.629 1.00 0.00 C ATOM 287 O LEU A 86 -3.460 8.186 -2.725 1.00 0.00 O ATOM 288 CB LEU A 86 -1.643 6.036 -0.998 1.00 0.00 C ATOM 289 CG LEU A 86 -1.309 5.628 -2.427 1.00 0.00 C ATOM 290 CD1 LEU A 86 -2.453 4.835 -3.035 1.00 0.00 C ATOM 291 CD2 LEU A 86 -0.971 6.854 -3.253 1.00 0.00 C ATOM 0 H LEU A 86 -4.337 5.991 -2.109 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.007 7.135 0.249 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.811 6.621 -0.607 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.710 5.132 -0.392 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.433 4.980 -2.419 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.197 4.552 -4.056 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.629 3.937 -2.443 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.355 5.446 -3.043 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.734 6.551 -4.273 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -1.825 7.531 -3.265 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.111 7.362 -2.816 1.00 0.00 H new ATOM 303 N LYS A 87 -2.246 9.145 -1.088 1.00 0.00 N ATOM 304 CA LYS A 87 -2.126 10.430 -1.762 1.00 0.00 C ATOM 305 C LYS A 87 -0.667 10.870 -1.813 1.00 0.00 C ATOM 306 O LYS A 87 0.057 10.783 -0.820 1.00 0.00 O ATOM 307 CB LYS A 87 -2.970 11.485 -1.045 1.00 0.00 C ATOM 308 CG LYS A 87 -4.464 11.338 -1.292 1.00 0.00 C ATOM 309 CD LYS A 87 -5.256 11.412 0.004 1.00 0.00 C ATOM 310 CE LYS A 87 -6.657 10.841 -0.163 1.00 0.00 C ATOM 311 NZ LYS A 87 -7.704 11.794 0.299 1.00 0.00 N ATOM 0 H LYS A 87 -1.785 9.104 -0.179 1.00 0.00 H new ATOM 0 HA LYS A 87 -2.493 10.321 -2.783 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -2.779 11.425 0.026 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -2.652 12.476 -1.370 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -4.800 12.123 -1.970 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.660 10.386 -1.785 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.729 10.863 0.785 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.322 12.449 0.332 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.826 10.596 -1.211 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.739 9.911 0.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.644 11.368 0.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.558 12.009 1.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.643 12.672 -0.255 1.00 0.00 H new ATOM 325 N LEU A 88 -0.232 11.329 -2.978 1.00 0.00 N ATOM 326 CA LEU A 88 1.144 11.775 -3.154 1.00 0.00 C ATOM 327 C LEU A 88 1.207 13.137 -3.839 1.00 0.00 C ATOM 328 O LEU A 88 0.266 13.546 -4.518 1.00 0.00 O ATOM 329 CB LEU A 88 1.937 10.743 -3.942 1.00 0.00 C ATOM 330 CG LEU A 88 1.375 10.407 -5.322 1.00 0.00 C ATOM 331 CD1 LEU A 88 2.465 10.513 -6.368 1.00 0.00 C ATOM 332 CD2 LEU A 88 0.771 9.012 -5.328 1.00 0.00 C ATOM 0 H LEU A 88 -0.811 11.403 -3.815 1.00 0.00 H new ATOM 0 HA LEU A 88 1.590 11.882 -2.165 1.00 0.00 H new ATOM 0 HB2 LEU A 88 2.958 11.106 -4.061 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.992 9.825 -3.356 1.00 0.00 H new ATOM 0 HG LEU A 88 0.588 11.123 -5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 88 2.054 10.271 -7.348 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.860 11.529 -6.381 1.00 0.00 H new ATOM 0 HD13 LEU A 88 3.267 9.815 -6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.376 8.791 -6.320 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.539 8.282 -5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.036 8.962 -4.597 1.00 0.00 H new ATOM 344 N ASN A 89 2.324 13.835 -3.651 1.00 0.00 N ATOM 345 CA ASN A 89 2.514 15.154 -4.246 1.00 0.00 C ATOM 346 C ASN A 89 3.124 15.044 -5.642 1.00 0.00 C ATOM 347 O ASN A 89 3.147 13.968 -6.237 1.00 0.00 O ATOM 348 CB ASN A 89 3.408 16.015 -3.351 1.00 0.00 C ATOM 349 CG ASN A 89 3.006 15.946 -1.890 1.00 0.00 C ATOM 350 OD1 ASN A 89 2.248 16.784 -1.403 1.00 0.00 O ATOM 351 ND2 ASN A 89 3.515 14.942 -1.184 1.00 0.00 N ATOM 0 H ASN A 89 3.111 13.509 -3.091 1.00 0.00 H new ATOM 0 HA ASN A 89 1.536 15.627 -4.336 1.00 0.00 H new ATOM 0 HB2 ASN A 89 4.443 15.689 -3.456 1.00 0.00 H new ATOM 0 HB3 ASN A 89 3.364 17.051 -3.688 1.00 0.00 H new ATOM 0 HD21 ASN A 89 3.281 14.843 -0.196 1.00 0.00 H new ATOM 0 HD22 ASN A 89 4.140 14.270 -1.630 1.00 0.00 H new ATOM 358 N GLU A 90 3.615 16.168 -6.159 1.00 0.00 N ATOM 359 CA GLU A 90 4.224 16.202 -7.486 1.00 0.00 C ATOM 360 C GLU A 90 5.551 15.445 -7.512 1.00 0.00 C ATOM 361 O GLU A 90 6.093 15.169 -8.583 1.00 0.00 O ATOM 362 CB GLU A 90 4.444 17.650 -7.928 1.00 0.00 C ATOM 363 CG GLU A 90 5.451 18.402 -7.073 1.00 0.00 C ATOM 364 CD GLU A 90 5.913 19.695 -7.717 1.00 0.00 C ATOM 365 OE1 GLU A 90 6.497 19.633 -8.819 1.00 0.00 O ATOM 366 OE2 GLU A 90 5.690 20.768 -7.119 1.00 0.00 O ATOM 0 H GLU A 90 3.603 17.068 -5.679 1.00 0.00 H new ATOM 0 HA GLU A 90 3.540 15.711 -8.178 1.00 0.00 H new ATOM 0 HB2 GLU A 90 4.783 17.657 -8.964 1.00 0.00 H new ATOM 0 HB3 GLU A 90 3.491 18.178 -7.901 1.00 0.00 H new ATOM 0 HG2 GLU A 90 5.005 18.623 -6.103 1.00 0.00 H new ATOM 0 HG3 GLU A 90 6.315 17.763 -6.889 1.00 0.00 H new ATOM 373 N LYS A 91 6.072 15.108 -6.335 1.00 0.00 N ATOM 374 CA LYS A 91 7.334 14.381 -6.238 1.00 0.00 C ATOM 375 C LYS A 91 7.139 12.886 -6.493 1.00 0.00 C ATOM 376 O LYS A 91 8.092 12.109 -6.425 1.00 0.00 O ATOM 377 CB LYS A 91 7.964 14.595 -4.859 1.00 0.00 C ATOM 378 CG LYS A 91 9.052 15.658 -4.844 1.00 0.00 C ATOM 379 CD LYS A 91 8.549 16.984 -5.394 1.00 0.00 C ATOM 380 CE LYS A 91 9.149 17.285 -6.759 1.00 0.00 C ATOM 381 NZ LYS A 91 10.570 17.719 -6.657 1.00 0.00 N ATOM 0 H LYS A 91 5.641 15.326 -5.437 1.00 0.00 H new ATOM 0 HA LYS A 91 8.002 14.772 -7.006 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.183 14.876 -4.152 1.00 0.00 H new ATOM 0 HB3 LYS A 91 8.385 13.652 -4.511 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.409 15.799 -3.824 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.902 15.317 -5.435 1.00 0.00 H new ATOM 0 HD2 LYS A 91 7.462 16.958 -5.471 1.00 0.00 H new ATOM 0 HD3 LYS A 91 8.801 17.786 -4.700 1.00 0.00 H new ATOM 0 HE2 LYS A 91 9.085 16.397 -7.388 1.00 0.00 H new ATOM 0 HE3 LYS A 91 8.565 18.065 -7.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 10.942 17.915 -7.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.629 18.581 -6.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 11.132 16.965 -6.213 1.00 0.00 H new ATOM 395 N GLN A 92 5.905 12.486 -6.786 1.00 0.00 N ATOM 396 CA GLN A 92 5.595 11.092 -7.048 1.00 0.00 C ATOM 397 C GLN A 92 5.897 10.228 -5.835 1.00 0.00 C ATOM 398 O GLN A 92 6.486 9.153 -5.953 1.00 0.00 O ATOM 399 CB GLN A 92 6.366 10.594 -8.266 1.00 0.00 C ATOM 400 CG GLN A 92 5.556 10.677 -9.542 1.00 0.00 C ATOM 401 CD GLN A 92 4.880 9.365 -9.890 1.00 0.00 C ATOM 402 OE1 GLN A 92 5.222 8.315 -9.348 1.00 0.00 O ATOM 403 NE2 GLN A 92 3.912 9.421 -10.797 1.00 0.00 N ATOM 0 H GLN A 92 5.103 13.114 -6.847 1.00 0.00 H new ATOM 0 HA GLN A 92 4.528 11.016 -7.257 1.00 0.00 H new ATOM 0 HB2 GLN A 92 7.277 11.181 -8.380 1.00 0.00 H new ATOM 0 HB3 GLN A 92 6.671 9.561 -8.101 1.00 0.00 H new ATOM 0 HG2 GLN A 92 4.800 11.455 -9.438 1.00 0.00 H new ATOM 0 HG3 GLN A 92 6.208 10.975 -10.363 1.00 0.00 H new ATOM 0 HE21 GLN A 92 3.661 10.314 -11.221 1.00 0.00 H new ATOM 0 HE22 GLN A 92 3.419 8.571 -11.070 1.00 0.00 H new ATOM 412 N SER A 93 5.483 10.700 -4.667 1.00 0.00 N ATOM 413 CA SER A 93 5.704 9.963 -3.436 1.00 0.00 C ATOM 414 C SER A 93 4.403 9.409 -2.886 1.00 0.00 C ATOM 415 O SER A 93 3.746 10.025 -2.047 1.00 0.00 O ATOM 416 CB SER A 93 6.354 10.836 -2.386 1.00 0.00 C ATOM 417 OG SER A 93 6.907 12.010 -2.954 1.00 0.00 O ATOM 0 H SER A 93 4.994 11.587 -4.549 1.00 0.00 H new ATOM 0 HA SER A 93 6.371 9.135 -3.676 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.616 11.109 -1.631 1.00 0.00 H new ATOM 0 HB3 SER A 93 7.137 10.273 -1.878 1.00 0.00 H new ATOM 0 HG SER A 93 7.318 12.553 -2.249 1.00 0.00 H new ATOM 423 N CYS A 94 4.056 8.237 -3.364 1.00 0.00 N ATOM 424 CA CYS A 94 2.840 7.545 -2.941 1.00 0.00 C ATOM 425 C CYS A 94 2.750 7.468 -1.423 1.00 0.00 C ATOM 426 O CYS A 94 3.211 6.500 -0.818 1.00 0.00 O ATOM 427 CB CYS A 94 2.796 6.127 -3.519 1.00 0.00 C ATOM 428 SG CYS A 94 4.393 5.280 -3.540 1.00 0.00 S ATOM 0 H CYS A 94 4.603 7.728 -4.058 1.00 0.00 H new ATOM 0 HA CYS A 94 1.992 8.118 -3.317 1.00 0.00 H new ATOM 0 HB2 CYS A 94 2.091 5.533 -2.938 1.00 0.00 H new ATOM 0 HB3 CYS A 94 2.410 6.174 -4.537 1.00 0.00 H new ATOM 0 HG CYS A 94 5.003 5.475 -2.409 1.00 0.00 H new ATOM 434 N THR A 95 2.146 8.479 -0.805 1.00 0.00 N ATOM 435 CA THR A 95 2.001 8.484 0.639 1.00 0.00 C ATOM 436 C THR A 95 0.629 7.958 1.023 1.00 0.00 C ATOM 437 O THR A 95 -0.388 8.562 0.692 1.00 0.00 O ATOM 438 CB THR A 95 2.208 9.890 1.212 1.00 0.00 C ATOM 439 OG1 THR A 95 3.587 10.208 1.268 1.00 0.00 O ATOM 440 CG2 THR A 95 1.640 10.064 2.608 1.00 0.00 C ATOM 0 H THR A 95 1.755 9.294 -1.278 1.00 0.00 H new ATOM 0 HA THR A 95 2.767 7.833 1.061 1.00 0.00 H new ATOM 0 HB THR A 95 1.673 10.557 0.536 1.00 0.00 H new ATOM 0 HG1 THR A 95 3.700 11.110 1.635 1.00 0.00 H new ATOM 0 HG21 THR A 95 1.822 11.083 2.951 1.00 0.00 H new ATOM 0 HG22 THR A 95 0.567 9.874 2.591 1.00 0.00 H new ATOM 0 HG23 THR A 95 2.122 9.361 3.287 1.00 0.00 H new ATOM 448 N VAL A 96 0.617 6.833 1.723 1.00 0.00 N ATOM 449 CA VAL A 96 -0.623 6.210 2.169 1.00 0.00 C ATOM 450 C VAL A 96 -1.629 7.269 2.622 1.00 0.00 C ATOM 451 O VAL A 96 -1.237 8.372 3.001 1.00 0.00 O ATOM 452 CB VAL A 96 -0.332 5.225 3.314 1.00 0.00 C ATOM 453 CG1 VAL A 96 -1.592 4.490 3.733 1.00 0.00 C ATOM 454 CG2 VAL A 96 0.767 4.252 2.896 1.00 0.00 C ATOM 0 H VAL A 96 1.460 6.328 1.997 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.058 5.664 1.332 1.00 0.00 H new ATOM 0 HB VAL A 96 0.017 5.787 4.180 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.358 3.800 4.544 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.337 5.210 4.072 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -1.987 3.932 2.884 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.968 3.558 3.712 1.00 0.00 H new ATOM 0 HG22 VAL A 96 0.445 3.695 2.016 1.00 0.00 H new ATOM 0 HG23 VAL A 96 1.675 4.808 2.661 1.00 0.00 H new ATOM 464 N ALA A 97 -2.923 6.959 2.549 1.00 0.00 N ATOM 465 CA ALA A 97 -3.937 7.944 2.922 1.00 0.00 C ATOM 466 C ALA A 97 -5.020 7.383 3.837 1.00 0.00 C ATOM 467 O ALA A 97 -5.045 7.677 5.031 1.00 0.00 O ATOM 468 CB ALA A 97 -4.570 8.531 1.670 1.00 0.00 C ATOM 0 H ALA A 97 -3.288 6.057 2.243 1.00 0.00 H new ATOM 0 HA ALA A 97 -3.424 8.721 3.489 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.325 9.264 1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.802 9.015 1.067 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -5.037 7.735 1.091 1.00 0.00 H new ATOM 474 N ARG A 98 -5.941 6.612 3.273 1.00 0.00 N ATOM 475 CA ARG A 98 -7.044 6.063 4.055 1.00 0.00 C ATOM 476 C ARG A 98 -7.131 4.546 3.944 1.00 0.00 C ATOM 477 O ARG A 98 -6.553 3.938 3.043 1.00 0.00 O ATOM 478 CB ARG A 98 -8.369 6.694 3.613 1.00 0.00 C ATOM 479 CG ARG A 98 -8.465 6.949 2.114 1.00 0.00 C ATOM 480 CD ARG A 98 -9.525 7.988 1.788 1.00 0.00 C ATOM 481 NE ARG A 98 -9.403 9.180 2.623 1.00 0.00 N ATOM 482 CZ ARG A 98 -10.378 10.071 2.790 1.00 0.00 C ATOM 483 NH1 ARG A 98 -11.545 9.911 2.180 1.00 0.00 N ATOM 484 NH2 ARG A 98 -10.183 11.127 3.570 1.00 0.00 N ATOM 0 H ARG A 98 -5.948 6.354 2.286 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.851 6.305 5.100 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -9.188 6.041 3.913 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -8.504 7.638 4.141 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.498 7.285 1.739 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.699 6.017 1.600 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -9.443 8.271 0.739 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -10.514 7.551 1.924 1.00 0.00 H new ATOM 0 HE ARG A 98 -8.519 9.339 3.106 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -11.699 9.102 1.579 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -12.288 10.597 2.312 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -9.287 11.255 4.040 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -10.929 11.811 3.699 1.00 0.00 H new ATOM 498 N ILE A 99 -7.870 3.948 4.874 1.00 0.00 N ATOM 499 CA ILE A 99 -8.059 2.504 4.909 1.00 0.00 C ATOM 500 C ILE A 99 -9.526 2.160 5.156 1.00 0.00 C ATOM 501 O ILE A 99 -10.259 2.931 5.774 1.00 0.00 O ATOM 502 CB ILE A 99 -7.190 1.855 6.008 1.00 0.00 C ATOM 503 CG1 ILE A 99 -5.705 2.100 5.729 1.00 0.00 C ATOM 504 CG2 ILE A 99 -7.474 0.362 6.112 1.00 0.00 C ATOM 505 CD1 ILE A 99 -4.937 2.599 6.934 1.00 0.00 C ATOM 0 H ILE A 99 -8.352 4.449 5.620 1.00 0.00 H new ATOM 0 HA ILE A 99 -7.753 2.110 3.940 1.00 0.00 H new ATOM 0 HB ILE A 99 -7.445 2.317 6.962 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -5.252 1.173 5.378 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.610 2.826 4.922 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.850 -0.074 6.893 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.524 0.208 6.359 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.251 -0.118 5.159 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -3.892 2.751 6.662 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -5.364 3.543 7.273 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.000 1.864 7.736 1.00 0.00 H new ATOM 517 N LEU A 100 -9.945 0.995 4.673 1.00 0.00 N ATOM 518 CA LEU A 100 -11.321 0.548 4.845 1.00 0.00 C ATOM 519 C LEU A 100 -11.581 0.161 6.300 1.00 0.00 C ATOM 520 O LEU A 100 -10.731 -0.440 6.955 1.00 0.00 O ATOM 521 CB LEU A 100 -11.611 -0.631 3.904 1.00 0.00 C ATOM 522 CG LEU A 100 -12.476 -1.756 4.482 1.00 0.00 C ATOM 523 CD1 LEU A 100 -13.134 -2.550 3.364 1.00 0.00 C ATOM 524 CD2 LEU A 100 -11.638 -2.671 5.367 1.00 0.00 C ATOM 0 H LEU A 100 -9.351 0.344 4.160 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.993 1.368 4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.102 -0.245 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -10.660 -1.058 3.586 1.00 0.00 H new ATOM 0 HG LEU A 100 -13.260 -1.309 5.093 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -13.744 -3.345 3.793 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -13.765 -1.888 2.770 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -12.365 -2.987 2.727 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -12.268 -3.464 5.769 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -10.833 -3.110 4.777 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -11.213 -2.094 6.188 1.00 0.00 H new ATOM 585 N ILE A 105 -5.311 -3.861 6.452 1.00 0.00 N ATOM 586 CA ILE A 105 -4.381 -2.789 6.787 1.00 0.00 C ATOM 587 C ILE A 105 -4.577 -2.328 8.226 1.00 0.00 C ATOM 588 O ILE A 105 -3.651 -2.373 9.036 1.00 0.00 O ATOM 589 CB ILE A 105 -4.551 -1.583 5.844 1.00 0.00 C ATOM 590 CG1 ILE A 105 -4.467 -2.030 4.382 1.00 0.00 C ATOM 591 CG2 ILE A 105 -3.504 -0.518 6.141 1.00 0.00 C ATOM 592 CD1 ILE A 105 -3.186 -2.764 4.045 1.00 0.00 C ATOM 0 HA ILE A 105 -3.375 -3.191 6.669 1.00 0.00 H new ATOM 0 HB ILE A 105 -5.536 -1.149 6.015 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -5.316 -2.677 4.159 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -4.555 -1.155 3.738 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -3.641 0.326 5.464 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.613 -0.178 7.171 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -2.508 -0.938 6.000 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -3.197 -3.050 2.993 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -2.333 -2.113 4.235 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -3.105 -3.658 4.663 1.00 0.00 H new ATOM 604 N HIS A 106 -5.790 -1.886 8.542 1.00 0.00 N ATOM 605 CA HIS A 106 -6.106 -1.419 9.887 1.00 0.00 C ATOM 606 C HIS A 106 -5.818 -2.503 10.922 1.00 0.00 C ATOM 607 O HIS A 106 -5.531 -2.207 12.082 1.00 0.00 O ATOM 608 CB HIS A 106 -7.574 -0.996 9.971 1.00 0.00 C ATOM 609 CG HIS A 106 -7.816 0.139 10.917 1.00 0.00 C ATOM 610 ND1 HIS A 106 -8.374 -0.027 12.167 1.00 0.00 N ATOM 611 CD2 HIS A 106 -7.566 1.465 10.793 1.00 0.00 C ATOM 612 CE1 HIS A 106 -8.461 1.145 12.770 1.00 0.00 C ATOM 613 NE2 HIS A 106 -7.976 2.066 11.957 1.00 0.00 N ATOM 0 H HIS A 106 -6.570 -1.841 7.886 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.473 -0.558 10.103 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -7.919 -0.710 8.977 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -8.173 -1.852 10.282 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -7.126 1.957 9.938 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -8.860 1.320 13.758 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -7.916 3.064 12.161 1.00 0.00 H new ATOM 622 N ARG A 107 -5.894 -3.761 10.494 1.00 0.00 N ATOM 623 CA ARG A 107 -5.640 -4.889 11.383 1.00 0.00 C ATOM 624 C ARG A 107 -4.153 -5.233 11.424 1.00 0.00 C ATOM 625 O ARG A 107 -3.657 -5.761 12.418 1.00 0.00 O ATOM 626 CB ARG A 107 -6.447 -6.109 10.932 1.00 0.00 C ATOM 627 CG ARG A 107 -7.779 -6.255 11.648 1.00 0.00 C ATOM 628 CD ARG A 107 -7.611 -6.898 13.015 1.00 0.00 C ATOM 629 NE ARG A 107 -8.892 -7.288 13.600 1.00 0.00 N ATOM 630 CZ ARG A 107 -9.637 -8.294 13.147 1.00 0.00 C ATOM 631 NH1 ARG A 107 -9.234 -9.012 12.106 1.00 0.00 N ATOM 632 NH2 ARG A 107 -10.789 -8.583 13.738 1.00 0.00 N ATOM 0 H ARG A 107 -6.129 -4.024 9.537 1.00 0.00 H new ATOM 0 HA ARG A 107 -5.952 -4.604 12.388 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -6.626 -6.039 9.859 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.854 -7.008 11.098 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -8.242 -5.275 11.761 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -8.455 -6.858 11.042 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.971 -7.776 12.926 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -7.105 -6.201 13.683 1.00 0.00 H new ATOM 0 HE ARG A 107 -9.235 -6.759 14.402 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -8.349 -8.794 11.648 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -9.809 -9.782 11.764 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -11.103 -8.035 14.539 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -11.361 -9.354 13.392 1.00 0.00 H new ATOM 646 N GLN A 108 -3.447 -4.933 10.335 1.00 0.00 N ATOM 647 CA GLN A 108 -2.017 -5.215 10.248 1.00 0.00 C ATOM 648 C GLN A 108 -1.268 -4.624 11.438 1.00 0.00 C ATOM 649 O GLN A 108 -0.531 -5.326 12.131 1.00 0.00 O ATOM 650 CB GLN A 108 -1.442 -4.662 8.942 1.00 0.00 C ATOM 651 CG GLN A 108 -1.475 -5.656 7.793 1.00 0.00 C ATOM 652 CD GLN A 108 -0.375 -6.695 7.890 1.00 0.00 C ATOM 653 OE1 GLN A 108 0.771 -6.377 8.205 1.00 0.00 O ATOM 654 NE2 GLN A 108 -0.721 -7.950 7.620 1.00 0.00 N ATOM 0 H GLN A 108 -3.842 -4.495 9.503 1.00 0.00 H new ATOM 0 HA GLN A 108 -1.888 -6.297 10.264 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -2.002 -3.771 8.657 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -0.412 -4.350 9.112 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -2.443 -6.157 7.778 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -1.380 -5.119 6.849 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -1.683 -8.170 7.363 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -0.024 -8.693 7.670 1.00 0.00 H new ATOM 663 N GLY A 109 -1.461 -3.330 11.670 1.00 0.00 N ATOM 664 CA GLY A 109 -0.796 -2.669 12.778 1.00 0.00 C ATOM 665 C GLY A 109 0.581 -2.157 12.404 1.00 0.00 C ATOM 666 O GLY A 109 0.901 -0.990 12.633 1.00 0.00 O ATOM 0 H GLY A 109 -2.065 -2.728 11.111 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.409 -1.836 13.121 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.708 -3.365 13.612 1.00 0.00 H new ATOM 670 N SER A 110 1.400 -3.032 11.828 1.00 0.00 N ATOM 671 CA SER A 110 2.752 -2.667 11.420 1.00 0.00 C ATOM 672 C SER A 110 2.740 -1.439 10.513 1.00 0.00 C ATOM 673 O SER A 110 3.711 -0.684 10.462 1.00 0.00 O ATOM 674 CB SER A 110 3.423 -3.837 10.698 1.00 0.00 C ATOM 675 OG SER A 110 4.188 -4.620 11.599 1.00 0.00 O ATOM 0 H SER A 110 1.150 -4.001 11.633 1.00 0.00 H new ATOM 0 HA SER A 110 3.319 -2.426 12.319 1.00 0.00 H new ATOM 0 HB2 SER A 110 2.664 -4.459 10.224 1.00 0.00 H new ATOM 0 HB3 SER A 110 4.066 -3.458 9.904 1.00 0.00 H new ATOM 0 HG SER A 110 4.605 -5.362 11.114 1.00 0.00 H new ATOM 681 N LEU A 111 1.635 -1.246 9.800 1.00 0.00 N ATOM 682 CA LEU A 111 1.500 -0.110 8.897 1.00 0.00 C ATOM 683 C LEU A 111 1.316 1.188 9.675 1.00 0.00 C ATOM 684 O LEU A 111 1.221 1.182 10.902 1.00 0.00 O ATOM 685 CB LEU A 111 0.321 -0.322 7.944 1.00 0.00 C ATOM 686 CG LEU A 111 0.711 -0.657 6.505 1.00 0.00 C ATOM 687 CD1 LEU A 111 -0.485 -1.197 5.735 1.00 0.00 C ATOM 688 CD2 LEU A 111 1.282 0.572 5.811 1.00 0.00 C ATOM 0 H LEU A 111 0.822 -1.861 9.830 1.00 0.00 H new ATOM 0 HA LEU A 111 2.418 -0.034 8.314 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -0.302 -1.127 8.333 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -0.290 0.580 7.939 1.00 0.00 H new ATOM 0 HG LEU A 111 1.479 -1.431 6.528 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.185 -1.429 4.713 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.852 -2.102 6.220 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.276 -0.448 5.720 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.555 0.318 4.787 1.00 0.00 H new ATOM 0 HD22 LEU A 111 0.534 1.365 5.801 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.166 0.915 6.348 1.00 0.00 H new ATOM 700 N HIS A 112 1.266 2.298 8.949 1.00 0.00 N ATOM 701 CA HIS A 112 1.091 3.607 9.564 1.00 0.00 C ATOM 702 C HIS A 112 0.756 4.655 8.510 1.00 0.00 C ATOM 703 O HIS A 112 1.647 5.201 7.860 1.00 0.00 O ATOM 704 CB HIS A 112 2.356 4.016 10.323 1.00 0.00 C ATOM 705 CG HIS A 112 2.369 3.580 11.757 1.00 0.00 C ATOM 706 ND1 HIS A 112 1.223 3.305 12.475 1.00 0.00 N ATOM 707 CD2 HIS A 112 3.401 3.371 12.608 1.00 0.00 C ATOM 708 CE1 HIS A 112 1.551 2.949 13.704 1.00 0.00 C ATOM 709 NE2 HIS A 112 2.865 2.980 13.811 1.00 0.00 N ATOM 0 H HIS A 112 1.344 2.317 7.932 1.00 0.00 H new ATOM 0 HA HIS A 112 0.262 3.543 10.269 1.00 0.00 H new ATOM 0 HB2 HIS A 112 3.224 3.594 9.817 1.00 0.00 H new ATOM 0 HB3 HIS A 112 2.459 5.100 10.282 1.00 0.00 H new ATOM 0 HD2 HIS A 112 4.451 3.490 12.383 1.00 0.00 H new ATOM 0 HE1 HIS A 112 0.860 2.678 14.489 1.00 0.00 H new ATOM 0 HE2 HIS A 112 3.397 2.751 14.651 1.00 0.00 H new ATOM 718 N VAL A 113 -0.537 4.927 8.347 1.00 0.00 N ATOM 719 CA VAL A 113 -1.010 5.910 7.373 1.00 0.00 C ATOM 720 C VAL A 113 -0.125 7.148 7.358 1.00 0.00 C ATOM 721 O VAL A 113 0.454 7.529 8.375 1.00 0.00 O ATOM 722 CB VAL A 113 -2.464 6.325 7.669 1.00 0.00 C ATOM 723 CG1 VAL A 113 -2.954 7.345 6.652 1.00 0.00 C ATOM 724 CG2 VAL A 113 -3.372 5.103 7.690 1.00 0.00 C ATOM 0 H VAL A 113 -1.281 4.477 8.881 1.00 0.00 H new ATOM 0 HA VAL A 113 -0.965 5.435 6.393 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.493 6.792 8.654 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -3.983 7.623 6.882 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.321 8.232 6.692 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.910 6.912 5.652 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -4.395 5.414 7.900 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -3.336 4.606 6.721 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -3.036 4.413 8.464 1.00 0.00 H new ATOM 734 N GLY A 114 -0.012 7.760 6.186 1.00 0.00 N ATOM 735 CA GLY A 114 0.818 8.936 6.044 1.00 0.00 C ATOM 736 C GLY A 114 2.274 8.580 5.819 1.00 0.00 C ATOM 737 O GLY A 114 3.113 9.461 5.628 1.00 0.00 O ATOM 0 H GLY A 114 -0.482 7.461 5.331 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.458 9.535 5.208 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.730 9.552 6.939 1.00 0.00 H new ATOM 741 N ASP A 115 2.575 7.283 5.835 1.00 0.00 N ATOM 742 CA ASP A 115 3.937 6.815 5.623 1.00 0.00 C ATOM 743 C ASP A 115 4.315 6.950 4.156 1.00 0.00 C ATOM 744 O ASP A 115 3.575 7.540 3.370 1.00 0.00 O ATOM 745 CB ASP A 115 4.077 5.356 6.070 1.00 0.00 C ATOM 746 CG ASP A 115 3.201 4.415 5.268 1.00 0.00 C ATOM 747 OD1 ASP A 115 2.002 4.295 5.594 1.00 0.00 O ATOM 748 OD2 ASP A 115 3.715 3.797 4.313 1.00 0.00 O ATOM 0 H ASP A 115 1.893 6.541 5.993 1.00 0.00 H new ATOM 0 HA ASP A 115 4.612 7.429 6.220 1.00 0.00 H new ATOM 0 HB2 ASP A 115 5.118 5.048 5.973 1.00 0.00 H new ATOM 0 HB3 ASP A 115 3.818 5.277 7.126 1.00 0.00 H new ATOM 753 N GLU A 116 5.463 6.398 3.784 1.00 0.00 N ATOM 754 CA GLU A 116 5.913 6.466 2.404 1.00 0.00 C ATOM 755 C GLU A 116 6.141 5.069 1.833 1.00 0.00 C ATOM 756 O GLU A 116 6.680 4.185 2.504 1.00 0.00 O ATOM 757 CB GLU A 116 7.185 7.322 2.290 1.00 0.00 C ATOM 758 CG GLU A 116 8.484 6.548 2.457 1.00 0.00 C ATOM 759 CD GLU A 116 9.480 7.265 3.347 1.00 0.00 C ATOM 760 OE1 GLU A 116 9.106 7.631 4.482 1.00 0.00 O ATOM 761 OE2 GLU A 116 10.633 7.463 2.909 1.00 0.00 O ATOM 0 H GLU A 116 6.093 5.903 4.414 1.00 0.00 H new ATOM 0 HA GLU A 116 5.129 6.942 1.815 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.192 7.812 1.316 1.00 0.00 H new ATOM 0 HB3 GLU A 116 7.147 8.109 3.043 1.00 0.00 H new ATOM 0 HG2 GLU A 116 8.266 5.567 2.879 1.00 0.00 H new ATOM 0 HG3 GLU A 116 8.932 6.382 1.477 1.00 0.00 H new ATOM 768 N ILE A 117 5.719 4.889 0.590 1.00 0.00 N ATOM 769 CA ILE A 117 5.861 3.619 -0.107 1.00 0.00 C ATOM 770 C ILE A 117 6.848 3.765 -1.263 1.00 0.00 C ATOM 771 O ILE A 117 6.805 4.747 -2.004 1.00 0.00 O ATOM 772 CB ILE A 117 4.493 3.126 -0.634 1.00 0.00 C ATOM 773 CG1 ILE A 117 3.530 2.905 0.531 1.00 0.00 C ATOM 774 CG2 ILE A 117 4.650 1.845 -1.444 1.00 0.00 C ATOM 775 CD1 ILE A 117 2.089 2.740 0.101 1.00 0.00 C ATOM 0 H ILE A 117 5.269 5.618 0.037 1.00 0.00 H new ATOM 0 HA ILE A 117 6.243 2.880 0.597 1.00 0.00 H new ATOM 0 HB ILE A 117 4.082 3.892 -1.291 1.00 0.00 H new ATOM 0 HG12 ILE A 117 3.839 2.018 1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.602 3.750 1.216 1.00 0.00 H new ATOM 0 HG21 ILE A 117 3.674 1.520 -1.803 1.00 0.00 H new ATOM 0 HG22 ILE A 117 5.306 2.030 -2.295 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.083 1.067 -0.815 1.00 0.00 H new ATOM 0 HD11 ILE A 117 1.462 2.587 0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.762 3.636 -0.426 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.003 1.878 -0.560 1.00 0.00 H new ATOM 787 N LEU A 118 7.753 2.801 -1.398 1.00 0.00 N ATOM 788 CA LEU A 118 8.764 2.850 -2.451 1.00 0.00 C ATOM 789 C LEU A 118 8.458 1.884 -3.586 1.00 0.00 C ATOM 790 O LEU A 118 8.710 2.184 -4.752 1.00 0.00 O ATOM 791 CB LEU A 118 10.139 2.539 -1.875 1.00 0.00 C ATOM 792 CG LEU A 118 10.209 1.283 -1.001 1.00 0.00 C ATOM 793 CD1 LEU A 118 11.360 0.389 -1.436 1.00 0.00 C ATOM 794 CD2 LEU A 118 10.353 1.661 0.467 1.00 0.00 C ATOM 0 H LEU A 118 7.808 1.980 -0.795 1.00 0.00 H new ATOM 0 HA LEU A 118 8.753 3.860 -2.860 1.00 0.00 H new ATOM 0 HB2 LEU A 118 10.844 2.429 -2.699 1.00 0.00 H new ATOM 0 HB3 LEU A 118 10.470 3.393 -1.284 1.00 0.00 H new ATOM 0 HG LEU A 118 9.279 0.728 -1.125 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.392 -0.497 -0.802 1.00 0.00 H new ATOM 0 HD12 LEU A 118 11.215 0.088 -2.474 1.00 0.00 H new ATOM 0 HD13 LEU A 118 12.299 0.935 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 118 10.401 0.756 1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 118 11.266 2.240 0.606 1.00 0.00 H new ATOM 0 HD23 LEU A 118 9.495 2.258 0.775 1.00 0.00 H new ATOM 806 N GLU A 119 7.922 0.723 -3.243 1.00 0.00 N ATOM 807 CA GLU A 119 7.592 -0.282 -4.239 1.00 0.00 C ATOM 808 C GLU A 119 6.687 -1.349 -3.656 1.00 0.00 C ATOM 809 O GLU A 119 6.928 -1.866 -2.566 1.00 0.00 O ATOM 810 CB GLU A 119 8.856 -0.927 -4.799 1.00 0.00 C ATOM 811 CG GLU A 119 9.689 -1.639 -3.749 1.00 0.00 C ATOM 812 CD GLU A 119 11.160 -1.694 -4.111 1.00 0.00 C ATOM 813 OE1 GLU A 119 11.742 -0.627 -4.396 1.00 0.00 O ATOM 814 OE2 GLU A 119 11.732 -2.806 -4.109 1.00 0.00 O ATOM 0 H GLU A 119 7.707 0.454 -2.283 1.00 0.00 H new ATOM 0 HA GLU A 119 7.063 0.220 -5.050 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.577 -1.640 -5.575 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.466 -0.159 -5.276 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.573 -1.130 -2.792 1.00 0.00 H new ATOM 0 HG3 GLU A 119 9.313 -2.654 -3.618 1.00 0.00 H new ATOM 821 N ILE A 120 5.649 -1.672 -4.402 1.00 0.00 N ATOM 822 CA ILE A 120 4.691 -2.687 -3.982 1.00 0.00 C ATOM 823 C ILE A 120 4.778 -3.918 -4.870 1.00 0.00 C ATOM 824 O ILE A 120 5.003 -3.824 -6.075 1.00 0.00 O ATOM 825 CB ILE A 120 3.235 -2.150 -3.945 1.00 0.00 C ATOM 826 CG1 ILE A 120 2.438 -2.542 -5.197 1.00 0.00 C ATOM 827 CG2 ILE A 120 3.239 -0.647 -3.769 1.00 0.00 C ATOM 828 CD1 ILE A 120 3.023 -2.018 -6.488 1.00 0.00 C ATOM 0 H ILE A 120 5.443 -1.247 -5.306 1.00 0.00 H new ATOM 0 HA ILE A 120 4.959 -2.966 -2.963 1.00 0.00 H new ATOM 0 HB ILE A 120 2.738 -2.612 -3.092 1.00 0.00 H new ATOM 0 HG12 ILE A 120 2.379 -3.629 -5.252 1.00 0.00 H new ATOM 0 HG13 ILE A 120 1.418 -2.172 -5.096 1.00 0.00 H new ATOM 0 HG21 ILE A 120 2.213 -0.281 -3.744 1.00 0.00 H new ATOM 0 HG22 ILE A 120 3.738 -0.391 -2.834 1.00 0.00 H new ATOM 0 HG23 ILE A 120 3.769 -0.185 -4.602 1.00 0.00 H new ATOM 0 HD11 ILE A 120 2.402 -2.338 -7.325 1.00 0.00 H new ATOM 0 HD12 ILE A 120 3.057 -0.929 -6.457 1.00 0.00 H new ATOM 0 HD13 ILE A 120 4.033 -2.409 -6.615 1.00 0.00 H new ATOM 840 N ASN A 121 4.599 -5.070 -4.250 1.00 0.00 N ATOM 841 CA ASN A 121 4.655 -6.351 -4.953 1.00 0.00 C ATOM 842 C ASN A 121 5.819 -6.401 -5.947 1.00 0.00 C ATOM 843 O ASN A 121 5.745 -7.089 -6.965 1.00 0.00 O ATOM 844 CB ASN A 121 3.337 -6.616 -5.682 1.00 0.00 C ATOM 845 CG ASN A 121 2.802 -8.008 -5.413 1.00 0.00 C ATOM 846 OD1 ASN A 121 3.228 -8.678 -4.472 1.00 0.00 O ATOM 847 ND2 ASN A 121 1.865 -8.453 -6.240 1.00 0.00 N ATOM 0 H ASN A 121 4.411 -5.151 -3.251 1.00 0.00 H new ATOM 0 HA ASN A 121 4.817 -7.128 -4.206 1.00 0.00 H new ATOM 0 HB2 ASN A 121 2.597 -5.878 -5.371 1.00 0.00 H new ATOM 0 HB3 ASN A 121 3.485 -6.487 -6.754 1.00 0.00 H new ATOM 0 HD21 ASN A 121 1.469 -9.384 -6.109 1.00 0.00 H new ATOM 0 HD22 ASN A 121 1.541 -7.864 -7.007 1.00 0.00 H new ATOM 854 N GLY A 122 6.892 -5.673 -5.645 1.00 0.00 N ATOM 855 CA GLY A 122 8.048 -5.660 -6.525 1.00 0.00 C ATOM 856 C GLY A 122 7.872 -4.738 -7.718 1.00 0.00 C ATOM 857 O GLY A 122 8.435 -4.979 -8.785 1.00 0.00 O ATOM 0 H GLY A 122 6.981 -5.094 -4.810 1.00 0.00 H new ATOM 0 HA2 GLY A 122 8.926 -5.349 -5.959 1.00 0.00 H new ATOM 0 HA3 GLY A 122 8.239 -6.673 -6.880 1.00 0.00 H new ATOM 861 N THR A 123 7.084 -3.681 -7.541 1.00 0.00 N ATOM 862 CA THR A 123 6.831 -2.723 -8.615 1.00 0.00 C ATOM 863 C THR A 123 7.192 -1.306 -8.178 1.00 0.00 C ATOM 864 O THR A 123 6.897 -0.897 -7.055 1.00 0.00 O ATOM 865 CB THR A 123 5.359 -2.783 -9.039 1.00 0.00 C ATOM 866 OG1 THR A 123 5.062 -4.031 -9.639 1.00 0.00 O ATOM 867 CG2 THR A 123 4.964 -1.698 -10.021 1.00 0.00 C ATOM 0 H THR A 123 6.609 -3.466 -6.664 1.00 0.00 H new ATOM 0 HA THR A 123 7.459 -2.990 -9.465 1.00 0.00 H new ATOM 0 HB THR A 123 4.792 -2.637 -8.119 1.00 0.00 H new ATOM 0 HG1 THR A 123 4.118 -4.051 -9.901 1.00 0.00 H new ATOM 0 HG21 THR A 123 3.909 -1.804 -10.275 1.00 0.00 H new ATOM 0 HG22 THR A 123 5.132 -0.720 -9.570 1.00 0.00 H new ATOM 0 HG23 THR A 123 5.566 -1.789 -10.925 1.00 0.00 H new ATOM 875 N ASN A 124 7.822 -0.556 -9.078 1.00 0.00 N ATOM 876 CA ASN A 124 8.212 0.818 -8.789 1.00 0.00 C ATOM 877 C ASN A 124 6.976 1.691 -8.605 1.00 0.00 C ATOM 878 O ASN A 124 6.486 2.301 -9.554 1.00 0.00 O ATOM 879 CB ASN A 124 9.086 1.373 -9.916 1.00 0.00 C ATOM 880 CG ASN A 124 10.564 1.322 -9.579 1.00 0.00 C ATOM 881 OD1 ASN A 124 11.312 0.525 -10.143 1.00 0.00 O ATOM 882 ND2 ASN A 124 10.990 2.173 -8.653 1.00 0.00 N ATOM 0 H ASN A 124 8.073 -0.878 -10.013 1.00 0.00 H new ATOM 0 HA ASN A 124 8.789 0.827 -7.864 1.00 0.00 H new ATOM 0 HB2 ASN A 124 8.904 0.804 -10.827 1.00 0.00 H new ATOM 0 HB3 ASN A 124 8.798 2.404 -10.121 1.00 0.00 H new ATOM 0 HD21 ASN A 124 11.974 2.183 -8.383 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.334 2.817 -8.211 1.00 0.00 H new ATOM 889 N VAL A 125 6.474 1.740 -7.377 1.00 0.00 N ATOM 890 CA VAL A 125 5.291 2.528 -7.064 1.00 0.00 C ATOM 891 C VAL A 125 5.641 4.000 -6.848 1.00 0.00 C ATOM 892 O VAL A 125 4.760 4.839 -6.656 1.00 0.00 O ATOM 893 CB VAL A 125 4.576 1.965 -5.822 1.00 0.00 C ATOM 894 CG1 VAL A 125 5.506 1.985 -4.631 1.00 0.00 C ATOM 895 CG2 VAL A 125 3.294 2.726 -5.525 1.00 0.00 C ATOM 0 H VAL A 125 6.870 1.241 -6.580 1.00 0.00 H new ATOM 0 HA VAL A 125 4.618 2.463 -7.919 1.00 0.00 H new ATOM 0 HB VAL A 125 4.298 0.932 -6.030 1.00 0.00 H new ATOM 0 HG11 VAL A 125 4.989 1.585 -3.759 1.00 0.00 H new ATOM 0 HG12 VAL A 125 6.384 1.375 -4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 125 5.817 3.010 -4.429 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.815 2.302 -4.642 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.527 3.775 -5.343 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.619 2.647 -6.377 1.00 0.00 H new ATOM 905 N THR A 126 6.931 4.311 -6.894 1.00 0.00 N ATOM 906 CA THR A 126 7.392 5.680 -6.716 1.00 0.00 C ATOM 907 C THR A 126 7.762 6.309 -8.057 1.00 0.00 C ATOM 908 O THR A 126 8.630 7.179 -8.125 1.00 0.00 O ATOM 909 CB THR A 126 8.599 5.717 -5.778 1.00 0.00 C ATOM 910 OG1 THR A 126 9.461 4.620 -6.026 1.00 0.00 O ATOM 911 CG2 THR A 126 8.221 5.680 -4.314 1.00 0.00 C ATOM 0 H THR A 126 7.676 3.632 -7.053 1.00 0.00 H new ATOM 0 HA THR A 126 6.578 6.255 -6.275 1.00 0.00 H new ATOM 0 HB THR A 126 9.096 6.665 -5.985 1.00 0.00 H new ATOM 0 HG1 THR A 126 9.139 3.834 -5.538 1.00 0.00 H new ATOM 0 HG21 THR A 126 9.124 5.709 -3.704 1.00 0.00 H new ATOM 0 HG22 THR A 126 7.596 6.541 -4.078 1.00 0.00 H new ATOM 0 HG23 THR A 126 7.670 4.763 -4.103 1.00 0.00 H new ATOM 919 N ASN A 127 7.102 5.862 -9.123 1.00 0.00 N ATOM 920 CA ASN A 127 7.371 6.385 -10.460 1.00 0.00 C ATOM 921 C ASN A 127 6.082 6.554 -11.260 1.00 0.00 C ATOM 922 O ASN A 127 5.805 7.631 -11.786 1.00 0.00 O ATOM 923 CB ASN A 127 8.331 5.457 -11.207 1.00 0.00 C ATOM 924 CG ASN A 127 9.755 5.571 -10.702 1.00 0.00 C ATOM 925 OD1 ASN A 127 10.616 6.151 -11.364 1.00 0.00 O ATOM 926 ND2 ASN A 127 10.011 5.017 -9.522 1.00 0.00 N ATOM 0 H ASN A 127 6.380 5.142 -9.088 1.00 0.00 H new ATOM 0 HA ASN A 127 7.832 7.366 -10.349 1.00 0.00 H new ATOM 0 HB2 ASN A 127 7.992 4.426 -11.101 1.00 0.00 H new ATOM 0 HB3 ASN A 127 8.306 5.693 -12.271 1.00 0.00 H new ATOM 0 HD21 ASN A 127 10.952 5.063 -9.131 1.00 0.00 H new ATOM 0 HD22 ASN A 127 9.267 4.546 -9.007 1.00 0.00 H new ATOM 933 N HIS A 128 5.297 5.485 -11.350 1.00 0.00 N ATOM 934 CA HIS A 128 4.036 5.525 -12.089 1.00 0.00 C ATOM 935 C HIS A 128 2.929 6.122 -11.231 1.00 0.00 C ATOM 936 O HIS A 128 3.036 6.163 -10.006 1.00 0.00 O ATOM 937 CB HIS A 128 3.621 4.120 -12.551 1.00 0.00 C ATOM 938 CG HIS A 128 4.756 3.148 -12.663 1.00 0.00 C ATOM 939 ND1 HIS A 128 5.682 3.184 -13.685 1.00 0.00 N ATOM 940 CD2 HIS A 128 5.110 2.106 -11.875 1.00 0.00 C ATOM 941 CE1 HIS A 128 6.554 2.206 -13.522 1.00 0.00 C ATOM 942 NE2 HIS A 128 6.231 1.538 -12.430 1.00 0.00 N ATOM 0 H HIS A 128 5.509 4.583 -10.923 1.00 0.00 H new ATOM 0 HA HIS A 128 4.190 6.153 -12.966 1.00 0.00 H new ATOM 0 HB2 HIS A 128 2.885 3.723 -11.852 1.00 0.00 H new ATOM 0 HB3 HIS A 128 3.129 4.199 -13.520 1.00 0.00 H new ATOM 0 HD2 HIS A 128 4.605 1.782 -10.977 1.00 0.00 H new ATOM 0 HE1 HIS A 128 7.389 1.989 -14.171 1.00 0.00 H new ATOM 0 HE2 HIS A 128 6.732 0.731 -12.059 1.00 0.00 H new ATOM 951 N SER A 129 1.857 6.576 -11.876 1.00 0.00 N ATOM 952 CA SER A 129 0.732 7.156 -11.155 1.00 0.00 C ATOM 953 C SER A 129 0.169 6.151 -10.169 1.00 0.00 C ATOM 954 O SER A 129 0.190 4.948 -10.418 1.00 0.00 O ATOM 955 CB SER A 129 -0.373 7.581 -12.113 1.00 0.00 C ATOM 956 OG SER A 129 0.151 8.274 -13.232 1.00 0.00 O ATOM 0 H SER A 129 1.746 6.553 -12.890 1.00 0.00 H new ATOM 0 HA SER A 129 1.097 8.035 -10.623 1.00 0.00 H new ATOM 0 HB2 SER A 129 -0.921 6.702 -12.452 1.00 0.00 H new ATOM 0 HB3 SER A 129 -1.085 8.218 -11.589 1.00 0.00 H new ATOM 0 HG SER A 129 -0.582 8.532 -13.829 1.00 0.00 H new ATOM 962 N VAL A 130 -0.334 6.644 -9.050 1.00 0.00 N ATOM 963 CA VAL A 130 -0.891 5.770 -8.035 1.00 0.00 C ATOM 964 C VAL A 130 -2.024 4.920 -8.593 1.00 0.00 C ATOM 965 O VAL A 130 -2.203 3.775 -8.187 1.00 0.00 O ATOM 966 CB VAL A 130 -1.386 6.564 -6.816 1.00 0.00 C ATOM 967 CG1 VAL A 130 -2.446 7.575 -7.223 1.00 0.00 C ATOM 968 CG2 VAL A 130 -1.917 5.631 -5.736 1.00 0.00 C ATOM 0 H VAL A 130 -0.368 7.638 -8.823 1.00 0.00 H new ATOM 0 HA VAL A 130 -0.086 5.109 -7.713 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.537 7.109 -6.403 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.781 8.125 -6.344 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -2.025 8.272 -7.948 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -3.293 7.054 -7.670 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.261 6.218 -4.885 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -2.748 5.049 -6.134 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -1.123 4.957 -5.415 1.00 0.00 H new ATOM 978 N ASP A 131 -2.776 5.472 -9.532 1.00 0.00 N ATOM 979 CA ASP A 131 -3.875 4.734 -10.143 1.00 0.00 C ATOM 980 C ASP A 131 -3.340 3.493 -10.848 1.00 0.00 C ATOM 981 O ASP A 131 -3.991 2.446 -10.875 1.00 0.00 O ATOM 982 CB ASP A 131 -4.632 5.623 -11.132 1.00 0.00 C ATOM 983 CG ASP A 131 -5.968 6.089 -10.586 1.00 0.00 C ATOM 984 OD1 ASP A 131 -5.996 6.614 -9.453 1.00 0.00 O ATOM 985 OD2 ASP A 131 -6.987 5.929 -11.291 1.00 0.00 O ATOM 0 H ASP A 131 -2.649 6.420 -9.887 1.00 0.00 H new ATOM 0 HA ASP A 131 -4.567 4.424 -9.360 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -4.020 6.491 -11.378 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -4.793 5.074 -12.060 1.00 0.00 H new ATOM 990 N GLN A 132 -2.143 3.620 -11.410 1.00 0.00 N ATOM 991 CA GLN A 132 -1.502 2.515 -12.111 1.00 0.00 C ATOM 992 C GLN A 132 -1.082 1.425 -11.133 1.00 0.00 C ATOM 993 O GLN A 132 -1.273 0.238 -11.394 1.00 0.00 O ATOM 994 CB GLN A 132 -0.279 3.013 -12.882 1.00 0.00 C ATOM 995 CG GLN A 132 -0.614 4.020 -13.970 1.00 0.00 C ATOM 996 CD GLN A 132 -0.496 3.435 -15.363 1.00 0.00 C ATOM 997 OE1 GLN A 132 -1.433 2.820 -15.872 1.00 0.00 O ATOM 998 NE2 GLN A 132 0.660 3.624 -15.989 1.00 0.00 N ATOM 0 H GLN A 132 -1.596 4.481 -11.393 1.00 0.00 H new ATOM 0 HA GLN A 132 -2.223 2.097 -12.813 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.422 3.467 -12.181 1.00 0.00 H new ATOM 0 HB3 GLN A 132 0.229 2.160 -13.332 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.629 4.388 -13.819 1.00 0.00 H new ATOM 0 HG3 GLN A 132 0.052 4.878 -13.883 1.00 0.00 H new ATOM 0 HE21 GLN A 132 1.410 4.140 -15.530 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.797 3.253 -16.929 1.00 0.00 H new ATOM 1007 N LEU A 133 -0.505 1.837 -10.007 1.00 0.00 N ATOM 1008 CA LEU A 133 -0.053 0.892 -8.995 1.00 0.00 C ATOM 1009 C LEU A 133 -1.234 0.250 -8.284 1.00 0.00 C ATOM 1010 O LEU A 133 -1.287 -0.968 -8.128 1.00 0.00 O ATOM 1011 CB LEU A 133 0.849 1.577 -7.980 1.00 0.00 C ATOM 1012 CG LEU A 133 2.182 2.071 -8.525 1.00 0.00 C ATOM 1013 CD1 LEU A 133 2.853 1.005 -9.378 1.00 0.00 C ATOM 1014 CD2 LEU A 133 1.965 3.339 -9.315 1.00 0.00 C ATOM 0 H LEU A 133 -0.341 2.816 -9.775 1.00 0.00 H new ATOM 0 HA LEU A 133 0.516 0.112 -9.502 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.312 2.425 -7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 133 1.044 0.882 -7.164 1.00 0.00 H new ATOM 0 HG LEU A 133 2.848 2.284 -7.689 1.00 0.00 H new ATOM 0 HD11 LEU A 133 3.803 1.385 -9.754 1.00 0.00 H new ATOM 0 HD12 LEU A 133 3.031 0.115 -8.774 1.00 0.00 H new ATOM 0 HD13 LEU A 133 2.206 0.750 -10.217 1.00 0.00 H new ATOM 0 HD21 LEU A 133 2.919 3.693 -9.705 1.00 0.00 H new ATOM 0 HD22 LEU A 133 1.286 3.140 -10.144 1.00 0.00 H new ATOM 0 HD23 LEU A 133 1.533 4.102 -8.667 1.00 0.00 H new ATOM 1026 N GLN A 134 -2.192 1.076 -7.862 1.00 0.00 N ATOM 1027 CA GLN A 134 -3.382 0.574 -7.183 1.00 0.00 C ATOM 1028 C GLN A 134 -3.941 -0.606 -7.966 1.00 0.00 C ATOM 1029 O GLN A 134 -4.169 -1.688 -7.415 1.00 0.00 O ATOM 1030 CB GLN A 134 -4.432 1.680 -7.046 1.00 0.00 C ATOM 1031 CG GLN A 134 -4.169 2.631 -5.885 1.00 0.00 C ATOM 1032 CD GLN A 134 -4.368 1.972 -4.534 1.00 0.00 C ATOM 1033 OE1 GLN A 134 -4.333 0.747 -4.415 1.00 0.00 O ATOM 1034 NE2 GLN A 134 -4.579 2.786 -3.506 1.00 0.00 N ATOM 0 H GLN A 134 -2.166 2.089 -7.978 1.00 0.00 H new ATOM 0 HA GLN A 134 -3.114 0.245 -6.179 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -4.467 2.253 -7.973 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -5.413 1.224 -6.916 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -3.149 3.009 -5.954 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -4.834 3.491 -5.967 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -4.600 3.795 -3.651 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -4.720 2.402 -2.572 1.00 0.00 H new ATOM 1043 N LYS A 135 -4.106 -0.407 -9.269 1.00 0.00 N ATOM 1044 CA LYS A 135 -4.578 -1.473 -10.131 1.00 0.00 C ATOM 1045 C LYS A 135 -3.476 -2.518 -10.264 1.00 0.00 C ATOM 1046 O LYS A 135 -3.746 -3.716 -10.346 1.00 0.00 O ATOM 1047 CB LYS A 135 -4.973 -0.929 -11.504 1.00 0.00 C ATOM 1048 CG LYS A 135 -5.295 -2.017 -12.512 1.00 0.00 C ATOM 1049 CD LYS A 135 -4.080 -2.353 -13.359 1.00 0.00 C ATOM 1050 CE LYS A 135 -4.441 -3.272 -14.515 1.00 0.00 C ATOM 1051 NZ LYS A 135 -3.668 -2.947 -15.746 1.00 0.00 N ATOM 0 H LYS A 135 -3.921 0.476 -9.744 1.00 0.00 H new ATOM 0 HA LYS A 135 -5.466 -1.929 -9.692 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -5.840 -0.278 -11.393 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.160 -0.314 -11.891 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -5.637 -2.911 -11.990 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -6.112 -1.691 -13.155 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -3.641 -1.434 -13.747 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -3.323 -2.830 -12.737 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -4.250 -4.307 -14.229 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -5.508 -3.190 -14.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -3.943 -3.596 -16.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -3.869 -1.968 -16.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -2.651 -3.050 -15.554 1.00 0.00 H new ATOM 1065 N ALA A 136 -2.224 -2.050 -10.251 1.00 0.00 N ATOM 1066 CA ALA A 136 -1.072 -2.941 -10.334 1.00 0.00 C ATOM 1067 C ALA A 136 -1.114 -3.948 -9.194 1.00 0.00 C ATOM 1068 O ALA A 136 -0.667 -5.087 -9.333 1.00 0.00 O ATOM 1069 CB ALA A 136 0.223 -2.143 -10.289 1.00 0.00 C ATOM 0 H ALA A 136 -1.987 -1.060 -10.184 1.00 0.00 H new ATOM 0 HA ALA A 136 -1.110 -3.478 -11.282 1.00 0.00 H new ATOM 0 HB1 ALA A 136 1.072 -2.824 -10.352 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.252 -1.448 -11.128 1.00 0.00 H new ATOM 0 HB3 ALA A 136 0.274 -1.585 -9.354 1.00 0.00 H new ATOM 1075 N MET A 137 -1.681 -3.520 -8.072 1.00 0.00 N ATOM 1076 CA MET A 137 -1.819 -4.382 -6.911 1.00 0.00 C ATOM 1077 C MET A 137 -2.873 -5.435 -7.212 1.00 0.00 C ATOM 1078 O MET A 137 -2.650 -6.631 -7.028 1.00 0.00 O ATOM 1079 CB MET A 137 -2.220 -3.569 -5.677 1.00 0.00 C ATOM 1080 CG MET A 137 -1.220 -2.486 -5.308 1.00 0.00 C ATOM 1081 SD MET A 137 -1.936 -1.211 -4.253 1.00 0.00 S ATOM 1082 CE MET A 137 -0.466 -0.323 -3.747 1.00 0.00 C ATOM 0 H MET A 137 -2.052 -2.579 -7.945 1.00 0.00 H new ATOM 0 HA MET A 137 -0.863 -4.861 -6.698 1.00 0.00 H new ATOM 0 HB2 MET A 137 -3.191 -3.108 -5.856 1.00 0.00 H new ATOM 0 HB3 MET A 137 -2.339 -4.245 -4.830 1.00 0.00 H new ATOM 0 HG2 MET A 137 -0.370 -2.940 -4.798 1.00 0.00 H new ATOM 0 HG3 MET A 137 -0.836 -2.026 -6.218 1.00 0.00 H new ATOM 0 HE1 MET A 137 -0.634 0.133 -2.771 1.00 0.00 H new ATOM 0 HE2 MET A 137 0.374 -1.015 -3.685 1.00 0.00 H new ATOM 0 HE3 MET A 137 -0.242 0.455 -4.477 1.00 0.00 H new ATOM 1092 N LYS A 138 -4.016 -4.972 -7.712 1.00 0.00 N ATOM 1093 CA LYS A 138 -5.104 -5.865 -8.084 1.00 0.00 C ATOM 1094 C LYS A 138 -4.671 -6.752 -9.249 1.00 0.00 C ATOM 1095 O LYS A 138 -5.197 -7.847 -9.445 1.00 0.00 O ATOM 1096 CB LYS A 138 -6.344 -5.058 -8.479 1.00 0.00 C ATOM 1097 CG LYS A 138 -7.045 -4.404 -7.298 1.00 0.00 C ATOM 1098 CD LYS A 138 -7.074 -2.890 -7.430 1.00 0.00 C ATOM 1099 CE LYS A 138 -7.165 -2.213 -6.072 1.00 0.00 C ATOM 1100 NZ LYS A 138 -8.140 -1.088 -6.076 1.00 0.00 N ATOM 0 H LYS A 138 -4.210 -3.983 -7.868 1.00 0.00 H new ATOM 0 HA LYS A 138 -5.352 -6.491 -7.227 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.053 -4.286 -9.192 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.048 -5.715 -8.990 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -8.065 -4.783 -7.225 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -6.536 -4.679 -6.374 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -6.176 -2.552 -7.947 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -7.925 -2.594 -8.043 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -7.459 -2.945 -5.320 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -6.182 -1.840 -5.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -8.172 -0.653 -5.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -7.846 -0.376 -6.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -9.084 -1.448 -6.324 1.00 0.00 H new ATOM 1114 N GLU A 139 -3.699 -6.259 -10.015 1.00 0.00 N ATOM 1115 CA GLU A 139 -3.169 -6.983 -11.163 1.00 0.00 C ATOM 1116 C GLU A 139 -2.705 -8.381 -10.761 1.00 0.00 C ATOM 1117 O GLU A 139 -3.093 -9.376 -11.374 1.00 0.00 O ATOM 1118 CB GLU A 139 -2.005 -6.196 -11.770 1.00 0.00 C ATOM 1119 CG GLU A 139 -2.286 -5.674 -13.168 1.00 0.00 C ATOM 1120 CD GLU A 139 -1.073 -5.748 -14.074 1.00 0.00 C ATOM 1121 OE1 GLU A 139 -0.747 -6.861 -14.540 1.00 0.00 O ATOM 1122 OE2 GLU A 139 -0.449 -4.695 -14.318 1.00 0.00 O ATOM 0 H GLU A 139 -3.261 -5.352 -9.857 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.962 -7.091 -11.903 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -1.767 -5.355 -11.118 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -1.122 -6.835 -11.801 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.100 -6.249 -13.609 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.624 -4.640 -13.104 1.00 0.00 H new ATOM 1129 N THR A 140 -1.871 -8.444 -9.728 1.00 0.00 N ATOM 1130 CA THR A 140 -1.348 -9.716 -9.239 1.00 0.00 C ATOM 1131 C THR A 140 -2.471 -10.614 -8.732 1.00 0.00 C ATOM 1132 O THR A 140 -3.570 -10.145 -8.439 1.00 0.00 O ATOM 1133 CB THR A 140 -0.324 -9.479 -8.127 1.00 0.00 C ATOM 1134 OG1 THR A 140 0.166 -8.151 -8.168 1.00 0.00 O ATOM 1135 CG2 THR A 140 0.864 -10.412 -8.204 1.00 0.00 C ATOM 0 H THR A 140 -1.542 -7.628 -9.212 1.00 0.00 H new ATOM 0 HA THR A 140 -0.858 -10.219 -10.073 1.00 0.00 H new ATOM 0 HB THR A 140 -0.858 -9.671 -7.196 1.00 0.00 H new ATOM 0 HG1 THR A 140 -0.296 -7.611 -7.493 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.553 -10.192 -7.388 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.522 -11.444 -8.123 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.375 -10.273 -9.157 1.00 0.00 H new ATOM 1143 N LYS A 141 -2.182 -11.912 -8.641 1.00 0.00 N ATOM 1144 CA LYS A 141 -3.158 -12.900 -8.177 1.00 0.00 C ATOM 1145 C LYS A 141 -3.992 -12.371 -7.011 1.00 0.00 C ATOM 1146 O LYS A 141 -5.209 -12.552 -6.978 1.00 0.00 O ATOM 1147 CB LYS A 141 -2.444 -14.188 -7.761 1.00 0.00 C ATOM 1148 CG LYS A 141 -1.236 -13.952 -6.866 1.00 0.00 C ATOM 1149 CD LYS A 141 -0.008 -14.688 -7.376 1.00 0.00 C ATOM 1150 CE LYS A 141 1.275 -13.991 -6.955 1.00 0.00 C ATOM 1151 NZ LYS A 141 2.326 -14.961 -6.541 1.00 0.00 N ATOM 0 H LYS A 141 -1.273 -12.307 -8.884 1.00 0.00 H new ATOM 0 HA LYS A 141 -3.836 -13.107 -9.005 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -3.151 -14.834 -7.240 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -2.124 -14.722 -8.656 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -1.025 -12.884 -6.814 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -1.464 -14.282 -5.852 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.010 -15.709 -6.995 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -0.048 -14.754 -8.463 1.00 0.00 H new ATOM 0 HE2 LYS A 141 1.646 -13.385 -7.781 1.00 0.00 H new ATOM 0 HE3 LYS A 141 1.064 -13.311 -6.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 3.250 -14.645 -6.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 2.357 -15.017 -5.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 2.106 -15.899 -6.932 1.00 0.00 H new ATOM 1165 N GLY A 142 -3.335 -11.716 -6.058 1.00 0.00 N ATOM 1166 CA GLY A 142 -4.046 -11.177 -4.913 1.00 0.00 C ATOM 1167 C GLY A 142 -3.122 -10.738 -3.792 1.00 0.00 C ATOM 1168 O GLY A 142 -3.463 -9.845 -3.016 1.00 0.00 O ATOM 0 H GLY A 142 -2.329 -11.550 -6.058 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -4.648 -10.327 -5.234 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -4.736 -11.931 -4.533 1.00 0.00 H new ATOM 1172 N MET A 143 -1.955 -11.369 -3.698 1.00 0.00 N ATOM 1173 CA MET A 143 -0.990 -11.033 -2.654 1.00 0.00 C ATOM 1174 C MET A 143 -0.129 -9.843 -3.065 1.00 0.00 C ATOM 1175 O MET A 143 0.281 -9.730 -4.219 1.00 0.00 O ATOM 1176 CB MET A 143 -0.101 -12.240 -2.345 1.00 0.00 C ATOM 1177 CG MET A 143 0.809 -12.636 -3.495 1.00 0.00 C ATOM 1178 SD MET A 143 1.500 -14.290 -3.299 1.00 0.00 S ATOM 1179 CE MET A 143 0.069 -15.301 -3.669 1.00 0.00 C ATOM 0 H MET A 143 -1.655 -12.112 -4.329 1.00 0.00 H new ATOM 0 HA MET A 143 -1.546 -10.760 -1.757 1.00 0.00 H new ATOM 0 HB2 MET A 143 0.510 -12.016 -1.470 1.00 0.00 H new ATOM 0 HB3 MET A 143 -0.733 -13.089 -2.084 1.00 0.00 H new ATOM 0 HG2 MET A 143 0.249 -12.589 -4.429 1.00 0.00 H new ATOM 0 HG3 MET A 143 1.622 -11.914 -3.575 1.00 0.00 H new ATOM 0 HE1 MET A 143 -0.032 -16.079 -2.912 1.00 0.00 H new ATOM 0 HE2 MET A 143 -0.826 -14.678 -3.672 1.00 0.00 H new ATOM 0 HE3 MET A 143 0.193 -15.762 -4.649 1.00 0.00 H new ATOM 1189 N ILE A 144 0.146 -8.958 -2.109 1.00 0.00 N ATOM 1190 CA ILE A 144 0.962 -7.780 -2.377 1.00 0.00 C ATOM 1191 C ILE A 144 2.007 -7.566 -1.289 1.00 0.00 C ATOM 1192 O ILE A 144 1.802 -7.932 -0.131 1.00 0.00 O ATOM 1193 CB ILE A 144 0.104 -6.507 -2.498 1.00 0.00 C ATOM 1194 CG1 ILE A 144 -1.067 -6.746 -3.449 1.00 0.00 C ATOM 1195 CG2 ILE A 144 0.954 -5.339 -2.978 1.00 0.00 C ATOM 1196 CD1 ILE A 144 -0.636 -7.179 -4.833 1.00 0.00 C ATOM 0 H ILE A 144 -0.183 -9.035 -1.147 1.00 0.00 H new ATOM 0 HA ILE A 144 1.462 -7.965 -3.328 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.295 -6.260 -1.514 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -1.721 -7.508 -3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -1.654 -5.831 -3.529 1.00 0.00 H new ATOM 0 HG21 ILE A 144 0.334 -4.446 -3.059 1.00 0.00 H new ATOM 0 HG22 ILE A 144 1.759 -5.158 -2.266 1.00 0.00 H new ATOM 0 HG23 ILE A 144 1.379 -5.575 -3.954 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -1.516 -7.331 -5.457 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -0.006 -6.407 -5.276 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -0.074 -8.111 -4.764 1.00 0.00 H new ATOM 1208 N SER A 145 3.127 -6.965 -1.682 1.00 0.00 N ATOM 1209 CA SER A 145 4.229 -6.683 -0.768 1.00 0.00 C ATOM 1210 C SER A 145 4.657 -5.222 -0.893 1.00 0.00 C ATOM 1211 O SER A 145 5.457 -4.876 -1.763 1.00 0.00 O ATOM 1212 CB SER A 145 5.413 -7.602 -1.083 1.00 0.00 C ATOM 1213 OG SER A 145 5.894 -8.246 0.084 1.00 0.00 O ATOM 0 H SER A 145 3.296 -6.661 -2.641 1.00 0.00 H new ATOM 0 HA SER A 145 3.896 -6.865 0.254 1.00 0.00 H new ATOM 0 HB2 SER A 145 5.109 -8.351 -1.814 1.00 0.00 H new ATOM 0 HB3 SER A 145 6.216 -7.021 -1.536 1.00 0.00 H new ATOM 0 HG SER A 145 6.648 -8.827 -0.150 1.00 0.00 H new ATOM 1219 N LEU A 146 4.113 -4.366 -0.037 1.00 0.00 N ATOM 1220 CA LEU A 146 4.435 -2.941 -0.076 1.00 0.00 C ATOM 1221 C LEU A 146 5.590 -2.600 0.853 1.00 0.00 C ATOM 1222 O LEU A 146 5.552 -2.901 2.044 1.00 0.00 O ATOM 1223 CB LEU A 146 3.220 -2.100 0.319 1.00 0.00 C ATOM 1224 CG LEU A 146 1.913 -2.470 -0.386 1.00 0.00 C ATOM 1225 CD1 LEU A 146 0.824 -2.773 0.632 1.00 0.00 C ATOM 1226 CD2 LEU A 146 1.479 -1.350 -1.319 1.00 0.00 C ATOM 0 H LEU A 146 3.449 -4.630 0.691 1.00 0.00 H new ATOM 0 HA LEU A 146 4.727 -2.711 -1.101 1.00 0.00 H new ATOM 0 HB2 LEU A 146 3.071 -2.189 1.395 1.00 0.00 H new ATOM 0 HB3 LEU A 146 3.441 -1.053 0.113 1.00 0.00 H new ATOM 0 HG LEU A 146 2.083 -3.367 -0.981 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -0.098 -3.034 0.112 1.00 0.00 H new ATOM 0 HD12 LEU A 146 1.135 -3.608 1.260 1.00 0.00 H new ATOM 0 HD13 LEU A 146 0.653 -1.895 1.254 1.00 0.00 H new ATOM 0 HD21 LEU A 146 0.548 -1.628 -1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 146 1.326 -0.436 -0.744 1.00 0.00 H new ATOM 0 HD23 LEU A 146 2.252 -1.182 -2.069 1.00 0.00 H new ATOM 1238 N LYS A 147 6.602 -1.942 0.300 1.00 0.00 N ATOM 1239 CA LYS A 147 7.759 -1.528 1.081 1.00 0.00 C ATOM 1240 C LYS A 147 7.557 -0.101 1.575 1.00 0.00 C ATOM 1241 O LYS A 147 7.409 0.823 0.776 1.00 0.00 O ATOM 1242 CB LYS A 147 9.036 -1.621 0.245 1.00 0.00 C ATOM 1243 CG LYS A 147 9.522 -3.047 0.035 1.00 0.00 C ATOM 1244 CD LYS A 147 11.000 -3.195 0.372 1.00 0.00 C ATOM 1245 CE LYS A 147 11.213 -4.097 1.577 1.00 0.00 C ATOM 1246 NZ LYS A 147 12.356 -5.029 1.378 1.00 0.00 N ATOM 0 H LYS A 147 6.644 -1.684 -0.686 1.00 0.00 H new ATOM 0 HA LYS A 147 7.863 -2.195 1.937 1.00 0.00 H new ATOM 0 HB2 LYS A 147 8.859 -1.159 -0.726 1.00 0.00 H new ATOM 0 HB3 LYS A 147 9.823 -1.046 0.733 1.00 0.00 H new ATOM 0 HG2 LYS A 147 8.938 -3.726 0.656 1.00 0.00 H new ATOM 0 HG3 LYS A 147 9.354 -3.340 -1.002 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.530 -3.605 -0.488 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.428 -2.213 0.572 1.00 0.00 H new ATOM 0 HE2 LYS A 147 11.393 -3.485 2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 147 10.306 -4.671 1.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 12.468 -5.626 2.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 12.173 -5.631 0.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 13.227 -4.482 1.223 1.00 0.00 H new ATOM 1260 N VAL A 148 7.529 0.077 2.892 1.00 0.00 N ATOM 1261 CA VAL A 148 7.317 1.399 3.465 1.00 0.00 C ATOM 1262 C VAL A 148 8.345 1.729 4.540 1.00 0.00 C ATOM 1263 O VAL A 148 9.068 0.856 5.020 1.00 0.00 O ATOM 1264 CB VAL A 148 5.898 1.521 4.060 1.00 0.00 C ATOM 1265 CG1 VAL A 148 4.857 1.077 3.043 1.00 0.00 C ATOM 1266 CG2 VAL A 148 5.764 0.709 5.345 1.00 0.00 C ATOM 0 H VAL A 148 7.649 -0.670 3.576 1.00 0.00 H new ATOM 0 HA VAL A 148 7.433 2.114 2.650 1.00 0.00 H new ATOM 0 HB VAL A 148 5.727 2.569 4.306 1.00 0.00 H new ATOM 0 HG11 VAL A 148 3.862 1.169 3.477 1.00 0.00 H new ATOM 0 HG12 VAL A 148 4.925 1.705 2.155 1.00 0.00 H new ATOM 0 HG13 VAL A 148 5.038 0.038 2.767 1.00 0.00 H new ATOM 0 HG21 VAL A 148 4.753 0.816 5.739 1.00 0.00 H new ATOM 0 HG22 VAL A 148 5.962 -0.342 5.134 1.00 0.00 H new ATOM 0 HG23 VAL A 148 6.481 1.072 6.081 1.00 0.00 H new ATOM 1276 N ILE A 149 8.388 3.000 4.919 1.00 0.00 N ATOM 1277 CA ILE A 149 9.309 3.465 5.949 1.00 0.00 C ATOM 1278 C ILE A 149 8.549 3.752 7.245 1.00 0.00 C ATOM 1279 O ILE A 149 7.410 4.218 7.212 1.00 0.00 O ATOM 1280 CB ILE A 149 10.075 4.728 5.482 1.00 0.00 C ATOM 1281 CG1 ILE A 149 11.446 4.335 4.930 1.00 0.00 C ATOM 1282 CG2 ILE A 149 10.229 5.741 6.611 1.00 0.00 C ATOM 1283 CD1 ILE A 149 11.871 5.151 3.729 1.00 0.00 C ATOM 0 H ILE A 149 7.793 3.730 4.527 1.00 0.00 H new ATOM 0 HA ILE A 149 10.039 2.677 6.134 1.00 0.00 H new ATOM 0 HB ILE A 149 9.492 5.201 4.692 1.00 0.00 H new ATOM 0 HG12 ILE A 149 12.191 4.447 5.717 1.00 0.00 H new ATOM 0 HG13 ILE A 149 11.429 3.280 4.655 1.00 0.00 H new ATOM 0 HG21 ILE A 149 10.771 6.613 6.246 1.00 0.00 H new ATOM 0 HG22 ILE A 149 9.244 6.047 6.962 1.00 0.00 H new ATOM 0 HG23 ILE A 149 10.783 5.288 7.433 1.00 0.00 H new ATOM 0 HD11 ILE A 149 12.852 4.818 3.391 1.00 0.00 H new ATOM 0 HD12 ILE A 149 11.147 5.020 2.925 1.00 0.00 H new ATOM 0 HD13 ILE A 149 11.921 6.205 4.004 1.00 0.00 H new ATOM 1295 N PRO A 150 9.165 3.474 8.407 1.00 0.00 N ATOM 1296 CA PRO A 150 8.529 3.704 9.708 1.00 0.00 C ATOM 1297 C PRO A 150 8.238 5.178 9.962 1.00 0.00 C ATOM 1298 O PRO A 150 9.046 6.048 9.636 1.00 0.00 O ATOM 1299 CB PRO A 150 9.557 3.185 10.717 1.00 0.00 C ATOM 1300 CG PRO A 150 10.856 3.191 9.985 1.00 0.00 C ATOM 1301 CD PRO A 150 10.520 2.914 8.547 1.00 0.00 C ATOM 0 HA PRO A 150 7.562 3.205 9.773 1.00 0.00 H new ATOM 0 HB2 PRO A 150 9.599 3.822 11.600 1.00 0.00 H new ATOM 0 HB3 PRO A 150 9.302 2.182 11.059 1.00 0.00 H new ATOM 0 HG2 PRO A 150 11.359 4.152 10.090 1.00 0.00 H new ATOM 0 HG3 PRO A 150 11.531 2.433 10.381 1.00 0.00 H new ATOM 0 HD2 PRO A 150 11.226 3.393 7.869 1.00 0.00 H new ATOM 0 HD3 PRO A 150 10.540 1.847 8.327 1.00 0.00 H new ATOM 1309 N ASN A 151 7.080 5.447 10.551 1.00 0.00 N ATOM 1310 CA ASN A 151 6.675 6.812 10.859 1.00 0.00 C ATOM 1311 C ASN A 151 6.468 6.977 12.359 1.00 0.00 C ATOM 1312 O ASN A 151 5.344 7.161 12.827 1.00 0.00 O ATOM 1313 CB ASN A 151 5.394 7.170 10.104 1.00 0.00 C ATOM 1314 CG ASN A 151 5.631 7.358 8.618 1.00 0.00 C ATOM 1315 OD1 ASN A 151 5.443 8.451 8.082 1.00 0.00 O ATOM 1316 ND2 ASN A 151 6.048 6.292 7.943 1.00 0.00 N ATOM 0 H ASN A 151 6.403 4.735 10.826 1.00 0.00 H new ATOM 0 HA ASN A 151 7.467 7.489 10.540 1.00 0.00 H new ATOM 0 HB2 ASN A 151 4.655 6.383 10.254 1.00 0.00 H new ATOM 0 HB3 ASN A 151 4.974 8.085 10.521 1.00 0.00 H new ATOM 0 HD21 ASN A 151 6.225 6.360 6.941 1.00 0.00 H new ATOM 0 HD22 ASN A 151 6.191 5.406 8.427 1.00 0.00 H new