USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 605 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 110 THR OG1 : rot 180:sc= 0.0045 USER MOD Set 1.2: A 113 HIS : no HD1:sc=-0.00684 X(o=-0.0023,f=-0.16) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -4.92! C(o=-4.9!,f=-7.5!) USER MOD Single : A 96 ASN : amide:sc= -3.3! C(o=-3.3!,f=-8.6!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= -1.08 USER MOD Single : A 101 SER OG : rot 107:sc= 0.367 USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.351 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -0.584 K(o=-0.58,f=-5.5!) USER MOD Single : A 115 LYS NZ :NH3+ -154:sc= 1.17 (180deg=0.868) USER MOD Single : A 116 GLN : amide:sc= -0.72 K(o=-0.72,f=0) USER MOD Single : A 117 GLN : amide:sc= -0.728 K(o=-0.73,f=0) USER MOD Single : A 119 SER OG : rot 69:sc= 0.644 USER MOD Single : A 125 GLN : amide:sc= -1.24! K(o=-1.2!,f=-0.0034) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN : amide:sc= -0.0788 X(o=-0.079,f=0.034) USER MOD Single : A 147 TYR OH : rot 30:sc= -0.246 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot -95:sc= 0.819 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl -136:sc= 0 (180deg=-2.34!) USER MOD Single : A 158 ASN : amide:sc= -2.78 K(o=-2.8,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 86 15.493 -13.914 -5.591 1.00 0.00 N ATOM 2 CA ASP A 86 14.328 -14.584 -6.157 1.00 0.00 C ATOM 3 C ASP A 86 13.333 -13.570 -6.697 1.00 0.00 C ATOM 4 O ASP A 86 13.353 -13.233 -7.884 1.00 0.00 O ATOM 5 CB ASP A 86 13.651 -15.474 -5.110 1.00 0.00 C ATOM 6 CG ASP A 86 14.535 -16.612 -4.650 1.00 0.00 C ATOM 7 OD1 ASP A 86 15.400 -16.383 -3.782 1.00 0.00 O ATOM 8 OD2 ASP A 86 14.373 -17.742 -5.158 1.00 0.00 O ATOM 0 HA ASP A 86 14.670 -15.211 -6.980 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.371 -14.866 -4.249 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.730 -15.881 -5.526 1.00 0.00 H new ATOM 13 N GLU A 87 12.483 -13.070 -5.818 1.00 0.00 N ATOM 14 CA GLU A 87 11.471 -12.100 -6.195 1.00 0.00 C ATOM 15 C GLU A 87 11.028 -11.281 -4.988 1.00 0.00 C ATOM 16 O GLU A 87 10.391 -11.803 -4.071 1.00 0.00 O ATOM 17 CB GLU A 87 10.257 -12.803 -6.814 1.00 0.00 C ATOM 18 CG GLU A 87 9.113 -11.861 -7.171 1.00 0.00 C ATOM 19 CD GLU A 87 9.438 -10.939 -8.330 1.00 0.00 C ATOM 20 OE1 GLU A 87 10.179 -9.954 -8.135 1.00 0.00 O ATOM 21 OE2 GLU A 87 8.945 -11.199 -9.449 1.00 0.00 O ATOM 0 H GLU A 87 12.474 -13.323 -4.830 1.00 0.00 H new ATOM 0 HA GLU A 87 11.910 -11.428 -6.933 1.00 0.00 H new ATOM 0 HB2 GLU A 87 10.575 -13.330 -7.714 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.890 -13.556 -6.116 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.230 -12.450 -7.420 1.00 0.00 H new ATOM 0 HG3 GLU A 87 8.859 -11.260 -6.297 1.00 0.00 H new ATOM 28 N PRO A 88 11.413 -10.004 -4.952 1.00 0.00 N ATOM 29 CA PRO A 88 10.833 -9.039 -4.031 1.00 0.00 C ATOM 30 C PRO A 88 9.523 -8.513 -4.610 1.00 0.00 C ATOM 31 O PRO A 88 8.816 -9.244 -5.302 1.00 0.00 O ATOM 32 CB PRO A 88 11.903 -7.950 -3.971 1.00 0.00 C ATOM 33 CG PRO A 88 12.519 -7.967 -5.327 1.00 0.00 C ATOM 34 CD PRO A 88 12.453 -9.396 -5.805 1.00 0.00 C ATOM 0 HA PRO A 88 10.590 -9.438 -3.046 1.00 0.00 H new ATOM 0 HB2 PRO A 88 11.468 -6.977 -3.743 1.00 0.00 H new ATOM 0 HB3 PRO A 88 12.641 -8.159 -3.196 1.00 0.00 H new ATOM 0 HG2 PRO A 88 11.982 -7.305 -6.006 1.00 0.00 H new ATOM 0 HG3 PRO A 88 13.551 -7.617 -5.290 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.188 -9.453 -6.861 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.412 -9.901 -5.689 1.00 0.00 H new ATOM 42 N LEU A 89 9.179 -7.269 -4.343 1.00 0.00 N ATOM 43 CA LEU A 89 8.013 -6.693 -4.980 1.00 0.00 C ATOM 44 C LEU A 89 8.179 -5.191 -5.136 1.00 0.00 C ATOM 45 O LEU A 89 8.682 -4.517 -4.243 1.00 0.00 O ATOM 46 CB LEU A 89 6.753 -7.022 -4.180 1.00 0.00 C ATOM 47 CG LEU A 89 5.446 -6.887 -4.955 1.00 0.00 C ATOM 48 CD1 LEU A 89 5.501 -7.734 -6.217 1.00 0.00 C ATOM 49 CD2 LEU A 89 4.272 -7.303 -4.082 1.00 0.00 C ATOM 0 H LEU A 89 9.677 -6.650 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 89 7.909 -7.127 -5.974 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.833 -8.043 -3.807 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.712 -6.367 -3.310 1.00 0.00 H new ATOM 0 HG LEU A 89 5.309 -5.844 -5.241 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.564 -7.632 -6.765 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.327 -7.398 -6.845 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.652 -8.779 -5.947 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.345 -7.202 -4.647 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.398 -8.341 -3.773 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.231 -6.665 -3.200 1.00 0.00 H new ATOM 61 N SER A 90 7.770 -4.680 -6.283 1.00 0.00 N ATOM 62 CA SER A 90 7.892 -3.264 -6.579 1.00 0.00 C ATOM 63 C SER A 90 6.528 -2.706 -6.974 1.00 0.00 C ATOM 64 O SER A 90 5.999 -3.041 -8.033 1.00 0.00 O ATOM 65 CB SER A 90 8.909 -3.056 -7.707 1.00 0.00 C ATOM 66 OG SER A 90 9.276 -1.693 -7.841 1.00 0.00 O ATOM 0 H SER A 90 7.347 -5.230 -7.031 1.00 0.00 H new ATOM 0 HA SER A 90 8.244 -2.734 -5.694 1.00 0.00 H new ATOM 0 HB2 SER A 90 9.799 -3.654 -7.509 1.00 0.00 H new ATOM 0 HB3 SER A 90 8.487 -3.413 -8.647 1.00 0.00 H new ATOM 0 HG SER A 90 9.926 -1.599 -8.568 1.00 0.00 H new ATOM 72 N ILE A 91 5.946 -1.886 -6.113 1.00 0.00 N ATOM 73 CA ILE A 91 4.630 -1.325 -6.374 1.00 0.00 C ATOM 74 C ILE A 91 4.706 0.186 -6.510 1.00 0.00 C ATOM 75 O ILE A 91 5.370 0.863 -5.717 1.00 0.00 O ATOM 76 CB ILE A 91 3.617 -1.694 -5.266 1.00 0.00 C ATOM 77 CG1 ILE A 91 4.137 -1.268 -3.890 1.00 0.00 C ATOM 78 CG2 ILE A 91 3.325 -3.186 -5.295 1.00 0.00 C ATOM 79 CD1 ILE A 91 3.149 -1.506 -2.769 1.00 0.00 C ATOM 0 H ILE A 91 6.363 -1.595 -5.229 1.00 0.00 H new ATOM 0 HA ILE A 91 4.281 -1.756 -7.313 1.00 0.00 H new ATOM 0 HB ILE A 91 2.688 -1.156 -5.454 1.00 0.00 H new ATOM 0 HG12 ILE A 91 5.057 -1.812 -3.674 1.00 0.00 H new ATOM 0 HG13 ILE A 91 4.392 -0.209 -3.919 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.610 -3.432 -4.510 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.906 -3.456 -6.264 1.00 0.00 H new ATOM 0 HG23 ILE A 91 4.249 -3.741 -5.132 1.00 0.00 H new ATOM 0 HD11 ILE A 91 3.585 -1.181 -1.824 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.237 -0.941 -2.961 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.912 -2.568 -2.712 1.00 0.00 H new ATOM 91 N LEU A 92 4.041 0.713 -7.523 1.00 0.00 N ATOM 92 CA LEU A 92 4.033 2.145 -7.757 1.00 0.00 C ATOM 93 C LEU A 92 2.812 2.772 -7.106 1.00 0.00 C ATOM 94 O LEU A 92 1.688 2.613 -7.584 1.00 0.00 O ATOM 95 CB LEU A 92 4.058 2.449 -9.258 1.00 0.00 C ATOM 96 CG LEU A 92 4.023 3.933 -9.631 1.00 0.00 C ATOM 97 CD1 LEU A 92 5.207 4.669 -9.025 1.00 0.00 C ATOM 98 CD2 LEU A 92 4.019 4.092 -11.140 1.00 0.00 C ATOM 0 H LEU A 92 3.500 0.170 -8.196 1.00 0.00 H new ATOM 0 HA LEU A 92 4.929 2.576 -7.310 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.957 2.006 -9.686 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.206 1.955 -9.725 1.00 0.00 H new ATOM 0 HG LEU A 92 3.109 4.369 -9.228 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.162 5.722 -9.303 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.175 4.579 -7.939 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.135 4.235 -9.398 1.00 0.00 H new ATOM 0 HD21 LEU A 92 3.994 5.152 -11.394 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.920 3.640 -11.556 1.00 0.00 H new ATOM 0 HD23 LEU A 92 3.140 3.598 -11.556 1.00 0.00 H new ATOM 110 N VAL A 93 3.035 3.464 -6.001 1.00 0.00 N ATOM 111 CA VAL A 93 1.955 4.101 -5.271 1.00 0.00 C ATOM 112 C VAL A 93 1.708 5.506 -5.804 1.00 0.00 C ATOM 113 O VAL A 93 2.482 6.429 -5.544 1.00 0.00 O ATOM 114 CB VAL A 93 2.251 4.159 -3.756 1.00 0.00 C ATOM 115 CG1 VAL A 93 1.117 4.841 -3.002 1.00 0.00 C ATOM 116 CG2 VAL A 93 2.487 2.760 -3.210 1.00 0.00 C ATOM 0 H VAL A 93 3.959 3.598 -5.590 1.00 0.00 H new ATOM 0 HA VAL A 93 1.059 3.498 -5.419 1.00 0.00 H new ATOM 0 HB VAL A 93 3.155 4.750 -3.609 1.00 0.00 H new ATOM 0 HG11 VAL A 93 1.352 4.868 -1.938 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.994 5.859 -3.372 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.192 4.285 -3.155 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.694 2.817 -2.141 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.599 2.150 -3.375 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.337 2.309 -3.721 1.00 0.00 H new ATOM 126 N ARG A 94 0.636 5.657 -6.563 1.00 0.00 N ATOM 127 CA ARG A 94 0.277 6.944 -7.130 1.00 0.00 C ATOM 128 C ARG A 94 -0.691 7.677 -6.223 1.00 0.00 C ATOM 129 O ARG A 94 -1.818 7.233 -6.004 1.00 0.00 O ATOM 130 CB ARG A 94 -0.335 6.783 -8.522 1.00 0.00 C ATOM 131 CG ARG A 94 0.673 6.406 -9.593 1.00 0.00 C ATOM 132 CD ARG A 94 0.016 6.312 -10.959 1.00 0.00 C ATOM 133 NE ARG A 94 0.968 5.957 -12.011 1.00 0.00 N ATOM 134 CZ ARG A 94 0.703 5.101 -12.998 1.00 0.00 C ATOM 135 NH1 ARG A 94 -0.486 4.518 -13.081 1.00 0.00 N ATOM 136 NH2 ARG A 94 1.630 4.839 -13.907 1.00 0.00 N ATOM 0 H ARG A 94 -0.004 4.899 -6.801 1.00 0.00 H new ATOM 0 HA ARG A 94 1.191 7.531 -7.221 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -1.111 6.019 -8.482 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.821 7.717 -8.806 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.472 7.147 -9.621 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.134 5.451 -9.342 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.780 5.568 -10.926 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.450 7.267 -11.202 1.00 0.00 H new ATOM 0 HE ARG A 94 1.891 6.391 -11.988 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.204 4.724 -12.387 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.682 3.864 -13.839 1.00 0.00 H new ATOM 0 HH21 ARG A 94 2.542 5.292 -13.850 1.00 0.00 H new ATOM 0 HH22 ARG A 94 1.432 4.185 -14.664 1.00 0.00 H new ATOM 150 N ASN A 95 -0.234 8.789 -5.682 1.00 0.00 N ATOM 151 CA ASN A 95 -1.074 9.643 -4.854 1.00 0.00 C ATOM 152 C ASN A 95 -1.975 10.474 -5.747 1.00 0.00 C ATOM 153 O ASN A 95 -1.539 10.932 -6.805 1.00 0.00 O ATOM 154 CB ASN A 95 -0.230 10.590 -3.990 1.00 0.00 C ATOM 155 CG ASN A 95 0.646 9.901 -2.958 1.00 0.00 C ATOM 156 OD1 ASN A 95 0.928 10.465 -1.904 1.00 0.00 O ATOM 157 ND2 ASN A 95 1.119 8.705 -3.253 1.00 0.00 N ATOM 0 H ASN A 95 0.721 9.127 -5.800 1.00 0.00 H new ATOM 0 HA ASN A 95 -1.663 9.003 -4.197 1.00 0.00 H new ATOM 0 HB2 ASN A 95 0.405 11.187 -4.644 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -0.897 11.282 -3.476 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.736 8.225 -2.598 1.00 0.00 H new ATOM 0 HD22 ASN A 95 0.868 8.261 -4.136 1.00 0.00 H new ATOM 164 N ASN A 96 -3.214 10.686 -5.325 1.00 0.00 N ATOM 165 CA ASN A 96 -4.149 11.508 -6.094 1.00 0.00 C ATOM 166 C ASN A 96 -3.635 12.943 -6.203 1.00 0.00 C ATOM 167 O ASN A 96 -3.989 13.674 -7.127 1.00 0.00 O ATOM 168 CB ASN A 96 -5.542 11.499 -5.454 1.00 0.00 C ATOM 169 CG ASN A 96 -5.569 12.164 -4.094 1.00 0.00 C ATOM 170 OD1 ASN A 96 -5.328 11.521 -3.076 1.00 0.00 O ATOM 171 ND2 ASN A 96 -5.857 13.454 -4.063 1.00 0.00 N ATOM 0 H ASN A 96 -3.597 10.304 -4.460 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.225 11.082 -7.094 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -6.244 12.007 -6.115 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -5.885 10.469 -5.356 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -5.885 13.949 -3.172 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -6.052 13.954 -4.930 1.00 0.00 H new ATOM 178 N LYS A 97 -2.776 13.332 -5.265 1.00 0.00 N ATOM 179 CA LYS A 97 -2.203 14.671 -5.254 1.00 0.00 C ATOM 180 C LYS A 97 -0.969 14.750 -6.156 1.00 0.00 C ATOM 181 O LYS A 97 -0.188 15.696 -6.070 1.00 0.00 O ATOM 182 CB LYS A 97 -1.855 15.094 -3.820 1.00 0.00 C ATOM 183 CG LYS A 97 -0.946 14.121 -3.076 1.00 0.00 C ATOM 184 CD LYS A 97 -0.651 14.597 -1.658 1.00 0.00 C ATOM 185 CE LYS A 97 -1.923 14.720 -0.830 1.00 0.00 C ATOM 186 NZ LYS A 97 -1.647 15.171 0.560 1.00 0.00 N ATOM 0 H LYS A 97 -2.461 12.735 -4.500 1.00 0.00 H new ATOM 0 HA LYS A 97 -2.949 15.362 -5.647 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.373 16.071 -3.850 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.780 15.212 -3.255 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.417 13.139 -3.040 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -0.010 14.006 -3.623 1.00 0.00 H new ATOM 0 HD2 LYS A 97 0.032 13.899 -1.174 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -0.146 15.562 -1.696 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -2.601 15.425 -1.311 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -2.432 13.756 -0.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -2.541 15.241 1.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -1.021 14.486 1.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -1.185 16.103 0.537 1.00 0.00 H new ATOM 200 N GLY A 98 -0.806 13.749 -7.015 1.00 0.00 N ATOM 201 CA GLY A 98 0.271 13.767 -7.987 1.00 0.00 C ATOM 202 C GLY A 98 1.600 13.335 -7.405 1.00 0.00 C ATOM 203 O GLY A 98 2.582 14.073 -7.479 1.00 0.00 O ATOM 0 H GLY A 98 -1.403 12.923 -7.055 1.00 0.00 H new ATOM 0 HA2 GLY A 98 0.014 13.110 -8.818 1.00 0.00 H new ATOM 0 HA3 GLY A 98 0.369 14.773 -8.394 1.00 0.00 H new ATOM 207 N ARG A 99 1.643 12.145 -6.820 1.00 0.00 N ATOM 208 CA ARG A 99 2.878 11.631 -6.251 1.00 0.00 C ATOM 209 C ARG A 99 2.992 10.135 -6.511 1.00 0.00 C ATOM 210 O ARG A 99 2.406 9.332 -5.795 1.00 0.00 O ATOM 211 CB ARG A 99 2.923 11.914 -4.746 1.00 0.00 C ATOM 212 CG ARG A 99 4.324 11.893 -4.156 1.00 0.00 C ATOM 213 CD ARG A 99 4.670 10.536 -3.567 1.00 0.00 C ATOM 214 NE ARG A 99 3.824 10.208 -2.421 1.00 0.00 N ATOM 215 CZ ARG A 99 4.279 9.705 -1.276 1.00 0.00 C ATOM 216 NH1 ARG A 99 5.574 9.453 -1.125 1.00 0.00 N ATOM 217 NH2 ARG A 99 3.437 9.451 -0.285 1.00 0.00 N ATOM 0 H ARG A 99 0.841 11.522 -6.728 1.00 0.00 H new ATOM 0 HA ARG A 99 3.721 12.133 -6.726 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.474 12.889 -4.556 1.00 0.00 H new ATOM 0 HB3 ARG A 99 2.311 11.175 -4.229 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.048 12.148 -4.930 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.403 12.656 -3.382 1.00 0.00 H new ATOM 0 HD2 ARG A 99 4.558 9.768 -4.333 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.716 10.529 -3.260 1.00 0.00 H new ATOM 0 HE ARG A 99 2.821 10.375 -2.504 1.00 0.00 H new ATOM 0 HH11 ARG A 99 6.223 9.645 -1.888 1.00 0.00 H new ATOM 0 HH12 ARG A 99 5.919 9.067 -0.246 1.00 0.00 H new ATOM 0 HH21 ARG A 99 2.441 9.641 -0.400 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.784 9.065 0.593 1.00 0.00 H new ATOM 231 N SER A 100 3.709 9.767 -7.557 1.00 0.00 N ATOM 232 CA SER A 100 3.924 8.364 -7.871 1.00 0.00 C ATOM 233 C SER A 100 5.229 7.879 -7.242 1.00 0.00 C ATOM 234 O SER A 100 6.312 8.091 -7.792 1.00 0.00 O ATOM 235 CB SER A 100 3.959 8.166 -9.385 1.00 0.00 C ATOM 236 OG SER A 100 2.861 8.822 -10.003 1.00 0.00 O ATOM 0 H SER A 100 4.153 10.419 -8.204 1.00 0.00 H new ATOM 0 HA SER A 100 3.101 7.779 -7.461 1.00 0.00 H new ATOM 0 HB2 SER A 100 4.895 8.556 -9.786 1.00 0.00 H new ATOM 0 HB3 SER A 100 3.931 7.102 -9.618 1.00 0.00 H new ATOM 0 HG SER A 100 2.902 8.685 -10.973 1.00 0.00 H new ATOM 242 N SER A 101 5.122 7.262 -6.076 1.00 0.00 N ATOM 243 CA SER A 101 6.289 6.770 -5.364 1.00 0.00 C ATOM 244 C SER A 101 6.352 5.248 -5.407 1.00 0.00 C ATOM 245 O SER A 101 5.438 4.562 -4.942 1.00 0.00 O ATOM 246 CB SER A 101 6.257 7.268 -3.922 1.00 0.00 C ATOM 247 OG SER A 101 4.957 7.128 -3.370 1.00 0.00 O ATOM 0 H SER A 101 4.235 7.090 -5.602 1.00 0.00 H new ATOM 0 HA SER A 101 7.185 7.152 -5.853 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.974 6.707 -3.323 1.00 0.00 H new ATOM 0 HB3 SER A 101 6.561 8.314 -3.887 1.00 0.00 H new ATOM 0 HG SER A 101 4.954 6.391 -2.724 1.00 0.00 H new ATOM 253 N THR A 102 7.421 4.728 -5.986 1.00 0.00 N ATOM 254 CA THR A 102 7.619 3.292 -6.065 1.00 0.00 C ATOM 255 C THR A 102 8.207 2.764 -4.757 1.00 0.00 C ATOM 256 O THR A 102 9.287 3.184 -4.340 1.00 0.00 O ATOM 257 CB THR A 102 8.568 2.936 -7.226 1.00 0.00 C ATOM 258 OG1 THR A 102 8.212 3.695 -8.391 1.00 0.00 O ATOM 259 CG2 THR A 102 8.505 1.449 -7.548 1.00 0.00 C ATOM 0 H THR A 102 8.166 5.281 -6.409 1.00 0.00 H new ATOM 0 HA THR A 102 6.648 2.828 -6.241 1.00 0.00 H new ATOM 0 HB THR A 102 9.586 3.180 -6.923 1.00 0.00 H new ATOM 0 HG1 THR A 102 8.818 3.468 -9.127 1.00 0.00 H new ATOM 0 HG21 THR A 102 9.184 1.226 -8.371 1.00 0.00 H new ATOM 0 HG22 THR A 102 8.798 0.874 -6.670 1.00 0.00 H new ATOM 0 HG23 THR A 102 7.488 1.182 -7.835 1.00 0.00 H new ATOM 267 N TYR A 103 7.493 1.856 -4.106 1.00 0.00 N ATOM 268 CA TYR A 103 7.968 1.266 -2.860 1.00 0.00 C ATOM 269 C TYR A 103 8.326 -0.200 -3.072 1.00 0.00 C ATOM 270 O TYR A 103 7.589 -0.933 -3.731 1.00 0.00 O ATOM 271 CB TYR A 103 6.903 1.375 -1.763 1.00 0.00 C ATOM 272 CG TYR A 103 6.679 2.778 -1.238 1.00 0.00 C ATOM 273 CD1 TYR A 103 7.543 3.337 -0.301 1.00 0.00 C ATOM 274 CD2 TYR A 103 5.598 3.538 -1.665 1.00 0.00 C ATOM 275 CE1 TYR A 103 7.333 4.612 0.194 1.00 0.00 C ATOM 276 CE2 TYR A 103 5.384 4.814 -1.176 1.00 0.00 C ATOM 277 CZ TYR A 103 6.255 5.345 -0.249 1.00 0.00 C ATOM 278 OH TYR A 103 6.044 6.614 0.239 1.00 0.00 O ATOM 0 H TYR A 103 6.585 1.512 -4.418 1.00 0.00 H new ATOM 0 HA TYR A 103 8.856 1.815 -2.546 1.00 0.00 H new ATOM 0 HB2 TYR A 103 5.959 0.992 -2.152 1.00 0.00 H new ATOM 0 HB3 TYR A 103 7.190 0.732 -0.931 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.392 2.766 0.046 1.00 0.00 H new ATOM 0 HD2 TYR A 103 4.913 3.126 -2.391 1.00 0.00 H new ATOM 0 HE1 TYR A 103 8.011 5.030 0.924 1.00 0.00 H new ATOM 0 HE2 TYR A 103 4.538 5.392 -1.519 1.00 0.00 H new ATOM 0 HH TYR A 103 5.242 6.995 -0.176 1.00 0.00 H new ATOM 288 N GLU A 104 9.459 -0.621 -2.525 1.00 0.00 N ATOM 289 CA GLU A 104 9.841 -2.020 -2.588 1.00 0.00 C ATOM 290 C GLU A 104 9.310 -2.753 -1.361 1.00 0.00 C ATOM 291 O GLU A 104 9.569 -2.371 -0.215 1.00 0.00 O ATOM 292 CB GLU A 104 11.360 -2.183 -2.721 1.00 0.00 C ATOM 293 CG GLU A 104 12.152 -1.707 -1.517 1.00 0.00 C ATOM 294 CD GLU A 104 13.644 -1.885 -1.696 1.00 0.00 C ATOM 295 OE1 GLU A 104 14.086 -3.025 -1.949 1.00 0.00 O ATOM 296 OE2 GLU A 104 14.383 -0.887 -1.593 1.00 0.00 O ATOM 0 H GLU A 104 10.122 -0.018 -2.038 1.00 0.00 H new ATOM 0 HA GLU A 104 9.397 -2.461 -3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.586 -3.235 -2.896 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.696 -1.634 -3.601 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.934 -0.654 -1.336 1.00 0.00 H new ATOM 0 HG3 GLU A 104 11.828 -2.256 -0.633 1.00 0.00 H new ATOM 303 N VAL A 105 8.548 -3.791 -1.617 1.00 0.00 N ATOM 304 CA VAL A 105 7.871 -4.542 -0.574 1.00 0.00 C ATOM 305 C VAL A 105 8.016 -6.036 -0.822 1.00 0.00 C ATOM 306 O VAL A 105 8.685 -6.449 -1.765 1.00 0.00 O ATOM 307 CB VAL A 105 6.372 -4.175 -0.491 1.00 0.00 C ATOM 308 CG1 VAL A 105 6.196 -2.762 0.044 1.00 0.00 C ATOM 309 CG2 VAL A 105 5.708 -4.317 -1.854 1.00 0.00 C ATOM 0 H VAL A 105 8.377 -4.144 -2.559 1.00 0.00 H new ATOM 0 HA VAL A 105 8.340 -4.281 0.375 1.00 0.00 H new ATOM 0 HB VAL A 105 5.889 -4.866 0.199 1.00 0.00 H new ATOM 0 HG11 VAL A 105 5.134 -2.522 0.095 1.00 0.00 H new ATOM 0 HG12 VAL A 105 6.632 -2.693 1.041 1.00 0.00 H new ATOM 0 HG13 VAL A 105 6.696 -2.057 -0.620 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.653 -4.054 -1.774 1.00 0.00 H new ATOM 0 HG22 VAL A 105 6.195 -3.652 -2.567 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.800 -5.347 -2.198 1.00 0.00 H new ATOM 319 N ARG A 106 7.427 -6.839 0.044 1.00 0.00 N ATOM 320 CA ARG A 106 7.454 -8.283 -0.113 1.00 0.00 C ATOM 321 C ARG A 106 6.034 -8.831 -0.055 1.00 0.00 C ATOM 322 O ARG A 106 5.144 -8.192 0.506 1.00 0.00 O ATOM 323 CB ARG A 106 8.296 -8.915 0.994 1.00 0.00 C ATOM 324 CG ARG A 106 9.685 -8.304 1.129 1.00 0.00 C ATOM 325 CD ARG A 106 10.378 -8.784 2.389 1.00 0.00 C ATOM 326 NE ARG A 106 9.569 -8.520 3.580 1.00 0.00 N ATOM 327 CZ ARG A 106 9.499 -9.343 4.628 1.00 0.00 C ATOM 328 NH1 ARG A 106 10.270 -10.425 4.678 1.00 0.00 N ATOM 329 NH2 ARG A 106 8.676 -9.069 5.635 1.00 0.00 N ATOM 0 H ARG A 106 6.921 -6.514 0.868 1.00 0.00 H new ATOM 0 HA ARG A 106 7.897 -8.527 -1.078 1.00 0.00 H new ATOM 0 HB2 ARG A 106 7.769 -8.812 1.943 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.395 -9.983 0.799 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.286 -8.566 0.258 1.00 0.00 H new ATOM 0 HG3 ARG A 106 9.606 -7.217 1.146 1.00 0.00 H new ATOM 0 HD2 ARG A 106 10.576 -9.853 2.312 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.343 -8.287 2.486 1.00 0.00 H new ATOM 0 HE ARG A 106 9.027 -7.656 3.611 1.00 0.00 H new ATOM 0 HH11 ARG A 106 10.916 -10.627 3.915 1.00 0.00 H new ATOM 0 HH12 ARG A 106 10.216 -11.053 5.480 1.00 0.00 H new ATOM 0 HH21 ARG A 106 8.098 -8.229 5.607 1.00 0.00 H new ATOM 0 HH22 ARG A 106 8.623 -9.698 6.436 1.00 0.00 H new ATOM 343 N LEU A 107 5.825 -10.009 -0.632 1.00 0.00 N ATOM 344 CA LEU A 107 4.512 -10.649 -0.606 1.00 0.00 C ATOM 345 C LEU A 107 4.205 -11.170 0.792 1.00 0.00 C ATOM 346 O LEU A 107 3.048 -11.210 1.212 1.00 0.00 O ATOM 347 CB LEU A 107 4.424 -11.805 -1.618 1.00 0.00 C ATOM 348 CG LEU A 107 4.410 -11.405 -3.101 1.00 0.00 C ATOM 349 CD1 LEU A 107 5.775 -10.908 -3.551 1.00 0.00 C ATOM 350 CD2 LEU A 107 3.965 -12.579 -3.959 1.00 0.00 C ATOM 0 H LEU A 107 6.545 -10.540 -1.122 1.00 0.00 H new ATOM 0 HA LEU A 107 3.776 -9.895 -0.885 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.269 -12.473 -1.451 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.520 -12.377 -1.408 1.00 0.00 H new ATOM 0 HG LEU A 107 3.699 -10.588 -3.223 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.733 -10.633 -4.605 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.058 -10.037 -2.960 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.514 -11.697 -3.412 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.960 -12.282 -5.008 1.00 0.00 H new ATOM 0 HD22 LEU A 107 4.654 -13.412 -3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.962 -12.886 -3.664 1.00 0.00 H new ATOM 362 N THR A 108 5.259 -11.547 1.514 1.00 0.00 N ATOM 363 CA THR A 108 5.134 -12.057 2.874 1.00 0.00 C ATOM 364 C THR A 108 4.936 -10.910 3.870 1.00 0.00 C ATOM 365 O THR A 108 5.638 -10.806 4.877 1.00 0.00 O ATOM 366 CB THR A 108 6.386 -12.860 3.269 1.00 0.00 C ATOM 367 OG1 THR A 108 6.899 -13.558 2.126 1.00 0.00 O ATOM 368 CG2 THR A 108 6.065 -13.863 4.369 1.00 0.00 C ATOM 0 H THR A 108 6.219 -11.507 1.172 1.00 0.00 H new ATOM 0 HA THR A 108 4.262 -12.710 2.904 1.00 0.00 H new ATOM 0 HB THR A 108 7.134 -12.160 3.641 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.697 -14.066 2.384 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.966 -14.418 4.630 1.00 0.00 H new ATOM 0 HG22 THR A 108 5.697 -13.334 5.248 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.301 -14.557 4.017 1.00 0.00 H new ATOM 376 N GLN A 109 3.986 -10.042 3.566 1.00 0.00 N ATOM 377 CA GLN A 109 3.643 -8.929 4.435 1.00 0.00 C ATOM 378 C GLN A 109 2.143 -8.747 4.460 1.00 0.00 C ATOM 379 O GLN A 109 1.448 -9.149 3.526 1.00 0.00 O ATOM 380 CB GLN A 109 4.267 -7.617 3.953 1.00 0.00 C ATOM 381 CG GLN A 109 5.779 -7.562 4.016 1.00 0.00 C ATOM 382 CD GLN A 109 6.323 -6.324 3.335 1.00 0.00 C ATOM 383 OE1 GLN A 109 7.446 -6.319 2.839 1.00 0.00 O ATOM 384 NE2 GLN A 109 5.514 -5.271 3.284 1.00 0.00 N ATOM 0 H GLN A 109 3.431 -10.089 2.711 1.00 0.00 H new ATOM 0 HA GLN A 109 4.029 -9.163 5.427 1.00 0.00 H new ATOM 0 HB2 GLN A 109 3.955 -7.442 2.923 1.00 0.00 H new ATOM 0 HB3 GLN A 109 3.864 -6.800 4.552 1.00 0.00 H new ATOM 0 HG2 GLN A 109 6.101 -7.576 5.057 1.00 0.00 H new ATOM 0 HG3 GLN A 109 6.196 -8.451 3.542 1.00 0.00 H new ATOM 0 HE21 GLN A 109 4.588 -5.318 3.709 1.00 0.00 H new ATOM 0 HE22 GLN A 109 5.819 -4.416 2.819 1.00 0.00 H new ATOM 393 N THR A 110 1.650 -8.151 5.522 1.00 0.00 N ATOM 394 CA THR A 110 0.274 -7.715 5.571 1.00 0.00 C ATOM 395 C THR A 110 0.170 -6.323 4.965 1.00 0.00 C ATOM 396 O THR A 110 1.143 -5.558 4.987 1.00 0.00 O ATOM 397 CB THR A 110 -0.241 -7.685 7.019 1.00 0.00 C ATOM 398 OG1 THR A 110 0.679 -6.956 7.848 1.00 0.00 O ATOM 399 CG2 THR A 110 -0.411 -9.097 7.556 1.00 0.00 C ATOM 0 H THR A 110 2.186 -7.957 6.368 1.00 0.00 H new ATOM 0 HA THR A 110 -0.337 -8.418 5.004 1.00 0.00 H new ATOM 0 HB THR A 110 -1.212 -7.189 7.032 1.00 0.00 H new ATOM 0 HG1 THR A 110 0.346 -6.938 8.769 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.776 -9.055 8.582 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.128 -9.638 6.938 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.549 -9.613 7.534 1.00 0.00 H new ATOM 407 N VAL A 111 -0.987 -5.991 4.413 1.00 0.00 N ATOM 408 CA VAL A 111 -1.203 -4.655 3.880 1.00 0.00 C ATOM 409 C VAL A 111 -1.110 -3.624 5.008 1.00 0.00 C ATOM 410 O VAL A 111 -0.794 -2.457 4.776 1.00 0.00 O ATOM 411 CB VAL A 111 -2.564 -4.542 3.153 1.00 0.00 C ATOM 412 CG1 VAL A 111 -2.774 -3.142 2.594 1.00 0.00 C ATOM 413 CG2 VAL A 111 -2.659 -5.576 2.043 1.00 0.00 C ATOM 0 H VAL A 111 -1.784 -6.621 4.323 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.424 -4.455 3.144 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.352 -4.735 3.881 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -3.739 -3.093 2.089 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.754 -2.418 3.409 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.980 -2.911 1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.622 -5.484 1.541 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.857 -5.412 1.323 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.566 -6.575 2.468 1.00 0.00 H new ATOM 423 N ALA A 112 -1.352 -4.080 6.237 1.00 0.00 N ATOM 424 CA ALA A 112 -1.190 -3.245 7.421 1.00 0.00 C ATOM 425 C ALA A 112 0.226 -2.697 7.506 1.00 0.00 C ATOM 426 O ALA A 112 0.427 -1.515 7.773 1.00 0.00 O ATOM 427 CB ALA A 112 -1.511 -4.036 8.679 1.00 0.00 C ATOM 0 H ALA A 112 -1.663 -5.031 6.436 1.00 0.00 H new ATOM 0 HA ALA A 112 -1.885 -2.409 7.340 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -1.385 -3.397 9.553 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -2.541 -4.389 8.634 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -0.838 -4.890 8.754 1.00 0.00 H new ATOM 433 N HIS A 113 1.206 -3.557 7.251 1.00 0.00 N ATOM 434 CA HIS A 113 2.606 -3.160 7.320 1.00 0.00 C ATOM 435 C HIS A 113 2.941 -2.128 6.251 1.00 0.00 C ATOM 436 O HIS A 113 3.768 -1.248 6.472 1.00 0.00 O ATOM 437 CB HIS A 113 3.527 -4.380 7.220 1.00 0.00 C ATOM 438 CG HIS A 113 3.915 -4.920 8.562 1.00 0.00 C ATOM 439 ND1 HIS A 113 4.648 -4.197 9.477 1.00 0.00 N ATOM 440 CD2 HIS A 113 3.652 -6.111 9.154 1.00 0.00 C ATOM 441 CE1 HIS A 113 4.821 -4.916 10.569 1.00 0.00 C ATOM 442 NE2 HIS A 113 4.228 -6.079 10.401 1.00 0.00 N ATOM 0 H HIS A 113 1.056 -4.533 6.995 1.00 0.00 H new ATOM 0 HA HIS A 113 2.773 -2.693 8.291 1.00 0.00 H new ATOM 0 HB2 HIS A 113 3.027 -5.162 6.648 1.00 0.00 H new ATOM 0 HB3 HIS A 113 4.427 -4.107 6.668 1.00 0.00 H new ATOM 0 HD2 HIS A 113 3.094 -6.931 8.726 1.00 0.00 H new ATOM 0 HE1 HIS A 113 5.359 -4.603 11.452 1.00 0.00 H new ATOM 0 HE2 HIS A 113 4.201 -6.834 11.086 1.00 0.00 H new ATOM 451 N LEU A 114 2.289 -2.222 5.099 1.00 0.00 N ATOM 452 CA LEU A 114 2.447 -1.205 4.064 1.00 0.00 C ATOM 453 C LEU A 114 1.763 0.083 4.501 1.00 0.00 C ATOM 454 O LEU A 114 2.348 1.165 4.424 1.00 0.00 O ATOM 455 CB LEU A 114 1.864 -1.670 2.727 1.00 0.00 C ATOM 456 CG LEU A 114 1.966 -0.640 1.597 1.00 0.00 C ATOM 457 CD1 LEU A 114 3.418 -0.406 1.217 1.00 0.00 C ATOM 458 CD2 LEU A 114 1.156 -1.080 0.387 1.00 0.00 C ATOM 0 H LEU A 114 1.653 -2.982 4.858 1.00 0.00 H new ATOM 0 HA LEU A 114 3.514 -1.029 3.924 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.377 -2.581 2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 114 0.815 -1.928 2.873 1.00 0.00 H new ATOM 0 HG LEU A 114 1.550 0.301 1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.470 0.328 0.413 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.966 -0.035 2.083 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.862 -1.343 0.881 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.244 -0.332 -0.401 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.534 -2.036 0.024 1.00 0.00 H new ATOM 0 HD23 LEU A 114 0.109 -1.187 0.670 1.00 0.00 H new ATOM 470 N LYS A 115 0.523 -0.054 4.971 1.00 0.00 N ATOM 471 CA LYS A 115 -0.263 1.082 5.430 1.00 0.00 C ATOM 472 C LYS A 115 0.487 1.865 6.498 1.00 0.00 C ATOM 473 O LYS A 115 0.580 3.080 6.415 1.00 0.00 O ATOM 474 CB LYS A 115 -1.614 0.621 5.991 1.00 0.00 C ATOM 475 CG LYS A 115 -2.485 1.777 6.466 1.00 0.00 C ATOM 476 CD LYS A 115 -3.682 1.308 7.281 1.00 0.00 C ATOM 477 CE LYS A 115 -4.702 0.561 6.438 1.00 0.00 C ATOM 478 NZ LYS A 115 -5.948 0.293 7.205 1.00 0.00 N ATOM 0 H LYS A 115 0.042 -0.950 5.042 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.437 1.729 4.570 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.149 0.062 5.223 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.442 -0.063 6.822 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.883 2.457 7.069 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.836 2.342 5.602 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.337 0.661 8.087 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.161 2.169 7.746 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -4.939 1.145 5.549 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.274 -0.381 6.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -6.422 -0.547 6.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.712 0.125 8.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.583 1.113 7.133 1.00 0.00 H new ATOM 492 N GLN A 116 1.037 1.160 7.480 1.00 0.00 N ATOM 493 CA GLN A 116 1.710 1.799 8.609 1.00 0.00 C ATOM 494 C GLN A 116 2.948 2.582 8.175 1.00 0.00 C ATOM 495 O GLN A 116 3.255 3.624 8.751 1.00 0.00 O ATOM 496 CB GLN A 116 2.077 0.761 9.666 1.00 0.00 C ATOM 497 CG GLN A 116 0.862 0.152 10.348 1.00 0.00 C ATOM 498 CD GLN A 116 1.216 -0.978 11.293 1.00 0.00 C ATOM 499 OE1 GLN A 116 0.428 -1.903 11.492 1.00 0.00 O ATOM 500 NE2 GLN A 116 2.399 -0.914 11.881 1.00 0.00 N ATOM 0 H GLN A 116 1.031 0.141 7.518 1.00 0.00 H new ATOM 0 HA GLN A 116 1.011 2.515 9.040 1.00 0.00 H new ATOM 0 HB2 GLN A 116 2.661 -0.033 9.200 1.00 0.00 H new ATOM 0 HB3 GLN A 116 2.714 1.226 10.418 1.00 0.00 H new ATOM 0 HG2 GLN A 116 0.336 0.929 10.902 1.00 0.00 H new ATOM 0 HG3 GLN A 116 0.174 -0.219 9.588 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.022 -0.130 11.689 1.00 0.00 H new ATOM 0 HE22 GLN A 116 2.688 -1.649 12.527 1.00 0.00 H new ATOM 509 N GLN A 117 3.653 2.097 7.163 1.00 0.00 N ATOM 510 CA GLN A 117 4.799 2.832 6.635 1.00 0.00 C ATOM 511 C GLN A 117 4.325 4.128 5.987 1.00 0.00 C ATOM 512 O GLN A 117 4.858 5.212 6.252 1.00 0.00 O ATOM 513 CB GLN A 117 5.582 1.982 5.634 1.00 0.00 C ATOM 514 CG GLN A 117 6.160 0.713 6.243 1.00 0.00 C ATOM 515 CD GLN A 117 7.048 -0.059 5.287 1.00 0.00 C ATOM 516 OE1 GLN A 117 7.979 -0.748 5.707 1.00 0.00 O ATOM 517 NE2 GLN A 117 6.776 0.053 3.997 1.00 0.00 N ATOM 0 H GLN A 117 3.458 1.212 6.695 1.00 0.00 H new ATOM 0 HA GLN A 117 5.469 3.072 7.460 1.00 0.00 H new ATOM 0 HB2 GLN A 117 4.927 1.713 4.806 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.393 2.579 5.218 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.735 0.974 7.132 1.00 0.00 H new ATOM 0 HG3 GLN A 117 5.343 0.070 6.569 1.00 0.00 H new ATOM 0 HE21 GLN A 117 5.996 0.634 3.689 1.00 0.00 H new ATOM 0 HE22 GLN A 117 7.346 -0.441 3.311 1.00 0.00 H new ATOM 526 N VAL A 118 3.289 4.015 5.165 1.00 0.00 N ATOM 527 CA VAL A 118 2.656 5.185 4.573 1.00 0.00 C ATOM 528 C VAL A 118 2.078 6.070 5.677 1.00 0.00 C ATOM 529 O VAL A 118 2.107 7.294 5.590 1.00 0.00 O ATOM 530 CB VAL A 118 1.538 4.785 3.581 1.00 0.00 C ATOM 531 CG1 VAL A 118 0.903 6.015 2.951 1.00 0.00 C ATOM 532 CG2 VAL A 118 2.084 3.862 2.502 1.00 0.00 C ATOM 0 H VAL A 118 2.870 3.125 4.894 1.00 0.00 H new ATOM 0 HA VAL A 118 3.415 5.736 4.017 1.00 0.00 H new ATOM 0 HB VAL A 118 0.769 4.252 4.140 1.00 0.00 H new ATOM 0 HG11 VAL A 118 0.120 5.706 2.258 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.470 6.641 3.731 1.00 0.00 H new ATOM 0 HG13 VAL A 118 1.663 6.581 2.412 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.283 3.592 1.814 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.876 4.372 1.954 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.485 2.960 2.964 1.00 0.00 H new ATOM 542 N SER A 119 1.589 5.427 6.730 1.00 0.00 N ATOM 543 CA SER A 119 1.022 6.119 7.877 1.00 0.00 C ATOM 544 C SER A 119 2.116 6.649 8.806 1.00 0.00 C ATOM 545 O SER A 119 1.833 7.273 9.829 1.00 0.00 O ATOM 546 CB SER A 119 0.071 5.196 8.638 1.00 0.00 C ATOM 547 OG SER A 119 -1.005 4.785 7.814 1.00 0.00 O ATOM 0 H SER A 119 1.575 4.410 6.811 1.00 0.00 H new ATOM 0 HA SER A 119 0.458 6.976 7.507 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.615 4.322 8.995 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.316 5.711 9.517 1.00 0.00 H new ATOM 0 HG SER A 119 -0.671 4.182 7.117 1.00 0.00 H new ATOM 553 N GLY A 120 3.363 6.386 8.458 1.00 0.00 N ATOM 554 CA GLY A 120 4.459 7.042 9.131 1.00 0.00 C ATOM 555 C GLY A 120 4.803 8.346 8.450 1.00 0.00 C ATOM 556 O GLY A 120 5.128 9.338 9.102 1.00 0.00 O ATOM 0 H GLY A 120 3.635 5.732 7.724 1.00 0.00 H new ATOM 0 HA2 GLY A 120 4.193 7.229 10.171 1.00 0.00 H new ATOM 0 HA3 GLY A 120 5.331 6.389 9.137 1.00 0.00 H new ATOM 560 N LEU A 121 4.707 8.341 7.127 1.00 0.00 N ATOM 561 CA LEU A 121 5.004 9.522 6.324 1.00 0.00 C ATOM 562 C LEU A 121 3.775 10.431 6.184 1.00 0.00 C ATOM 563 O LEU A 121 3.758 11.556 6.683 1.00 0.00 O ATOM 564 CB LEU A 121 5.489 9.087 4.940 1.00 0.00 C ATOM 565 CG LEU A 121 6.651 8.088 4.941 1.00 0.00 C ATOM 566 CD1 LEU A 121 6.919 7.584 3.534 1.00 0.00 C ATOM 567 CD2 LEU A 121 7.907 8.721 5.523 1.00 0.00 C ATOM 0 H LEU A 121 4.424 7.526 6.583 1.00 0.00 H new ATOM 0 HA LEU A 121 5.784 10.092 6.830 1.00 0.00 H new ATOM 0 HB2 LEU A 121 4.651 8.645 4.401 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.793 9.974 4.384 1.00 0.00 H new ATOM 0 HG LEU A 121 6.371 7.241 5.568 1.00 0.00 H new ATOM 0 HD11 LEU A 121 7.747 6.876 3.553 1.00 0.00 H new ATOM 0 HD12 LEU A 121 6.027 7.090 3.149 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.175 8.425 2.889 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.719 7.994 5.514 1.00 0.00 H new ATOM 0 HD22 LEU A 121 8.189 9.587 4.924 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.714 9.036 6.548 1.00 0.00 H new ATOM 579 N GLU A 122 2.746 9.913 5.529 1.00 0.00 N ATOM 580 CA GLU A 122 1.528 10.662 5.207 1.00 0.00 C ATOM 581 C GLU A 122 0.428 10.328 6.209 1.00 0.00 C ATOM 582 O GLU A 122 -0.733 10.673 6.006 1.00 0.00 O ATOM 583 CB GLU A 122 1.057 10.333 3.790 1.00 0.00 C ATOM 584 CG GLU A 122 2.151 10.425 2.735 1.00 0.00 C ATOM 585 CD GLU A 122 2.842 11.773 2.719 1.00 0.00 C ATOM 586 OE1 GLU A 122 2.240 12.752 2.227 1.00 0.00 O ATOM 587 OE2 GLU A 122 3.997 11.857 3.183 1.00 0.00 O ATOM 0 H GLU A 122 2.728 8.948 5.199 1.00 0.00 H new ATOM 0 HA GLU A 122 1.752 11.727 5.263 1.00 0.00 H new ATOM 0 HB2 GLU A 122 0.642 9.325 3.781 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.249 11.013 3.520 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.891 9.645 2.917 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.719 10.232 1.753 1.00 0.00 H new ATOM 594 N GLY A 123 0.845 9.602 7.242 1.00 0.00 N ATOM 595 CA GLY A 123 -0.002 8.967 8.257 1.00 0.00 C ATOM 596 C GLY A 123 -1.163 9.740 8.875 1.00 0.00 C ATOM 597 O GLY A 123 -1.688 9.280 9.883 1.00 0.00 O ATOM 0 H GLY A 123 1.837 9.429 7.406 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.415 8.061 7.813 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.649 8.654 9.073 1.00 0.00 H new ATOM 601 N VAL A 124 -1.512 10.911 8.365 1.00 0.00 N ATOM 602 CA VAL A 124 -2.613 11.708 8.918 1.00 0.00 C ATOM 603 C VAL A 124 -3.953 10.940 8.907 1.00 0.00 C ATOM 604 O VAL A 124 -4.812 11.186 8.064 1.00 0.00 O ATOM 605 CB VAL A 124 -2.792 13.032 8.141 1.00 0.00 C ATOM 606 CG1 VAL A 124 -3.739 13.968 8.881 1.00 0.00 C ATOM 607 CG2 VAL A 124 -1.445 13.695 7.898 1.00 0.00 C ATOM 0 H VAL A 124 -1.049 11.339 7.563 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.341 11.922 9.952 1.00 0.00 H new ATOM 0 HB VAL A 124 -3.236 12.805 7.172 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -3.851 14.894 8.316 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.712 13.490 8.989 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.333 14.191 9.867 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.591 14.626 7.350 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.967 13.908 8.854 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -0.810 13.027 7.316 1.00 0.00 H new ATOM 617 N GLN A 125 -4.087 10.000 9.850 1.00 0.00 N ATOM 618 CA GLN A 125 -5.308 9.220 10.078 1.00 0.00 C ATOM 619 C GLN A 125 -5.688 8.329 8.897 1.00 0.00 C ATOM 620 O GLN A 125 -5.945 8.812 7.794 1.00 0.00 O ATOM 621 CB GLN A 125 -6.475 10.136 10.438 1.00 0.00 C ATOM 622 CG GLN A 125 -6.285 10.864 11.756 1.00 0.00 C ATOM 623 CD GLN A 125 -7.498 11.674 12.165 1.00 0.00 C ATOM 624 OE1 GLN A 125 -7.376 12.711 12.810 1.00 0.00 O ATOM 625 NE2 GLN A 125 -8.682 11.204 11.798 1.00 0.00 N ATOM 0 H GLN A 125 -3.332 9.755 10.490 1.00 0.00 H new ATOM 0 HA GLN A 125 -5.090 8.557 10.915 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -6.611 10.869 9.643 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.390 9.545 10.486 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -6.060 10.138 12.537 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -5.422 11.526 11.678 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.743 10.338 11.262 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.532 11.708 12.051 1.00 0.00 H new ATOM 634 N ASP A 126 -5.771 7.021 9.153 1.00 0.00 N ATOM 635 CA ASP A 126 -6.253 6.054 8.159 1.00 0.00 C ATOM 636 C ASP A 126 -7.770 6.195 8.006 1.00 0.00 C ATOM 637 O ASP A 126 -8.541 5.249 8.172 1.00 0.00 O ATOM 638 CB ASP A 126 -5.878 4.619 8.566 1.00 0.00 C ATOM 639 CG ASP A 126 -6.287 3.584 7.529 1.00 0.00 C ATOM 640 OD1 ASP A 126 -5.813 3.662 6.380 1.00 0.00 O ATOM 641 OD2 ASP A 126 -7.086 2.674 7.858 1.00 0.00 O ATOM 0 H ASP A 126 -5.509 6.604 10.046 1.00 0.00 H new ATOM 0 HA ASP A 126 -5.777 6.261 7.201 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -4.801 4.561 8.725 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -6.354 4.380 9.517 1.00 0.00 H new ATOM 646 N ASP A 127 -8.178 7.412 7.714 1.00 0.00 N ATOM 647 CA ASP A 127 -9.578 7.769 7.576 1.00 0.00 C ATOM 648 C ASP A 127 -9.704 8.845 6.510 1.00 0.00 C ATOM 649 O ASP A 127 -10.648 8.856 5.723 1.00 0.00 O ATOM 650 CB ASP A 127 -10.122 8.280 8.914 1.00 0.00 C ATOM 651 CG ASP A 127 -11.627 8.471 8.915 1.00 0.00 C ATOM 652 OD1 ASP A 127 -12.350 7.495 9.195 1.00 0.00 O ATOM 653 OD2 ASP A 127 -12.095 9.606 8.672 1.00 0.00 O ATOM 0 H ASP A 127 -7.540 8.193 7.563 1.00 0.00 H new ATOM 0 HA ASP A 127 -10.157 6.894 7.282 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -9.851 7.576 9.701 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -9.642 9.228 9.155 1.00 0.00 H new ATOM 658 N LEU A 128 -8.728 9.751 6.491 1.00 0.00 N ATOM 659 CA LEU A 128 -8.656 10.780 5.470 1.00 0.00 C ATOM 660 C LEU A 128 -8.040 10.224 4.190 1.00 0.00 C ATOM 661 O LEU A 128 -8.217 10.790 3.110 1.00 0.00 O ATOM 662 CB LEU A 128 -7.835 11.966 5.975 1.00 0.00 C ATOM 663 CG LEU A 128 -8.396 12.662 7.218 1.00 0.00 C ATOM 664 CD1 LEU A 128 -7.446 13.749 7.692 1.00 0.00 C ATOM 665 CD2 LEU A 128 -9.772 13.248 6.931 1.00 0.00 C ATOM 0 H LEU A 128 -7.975 9.788 7.178 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.668 11.118 5.249 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.825 11.621 6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.753 12.699 5.173 1.00 0.00 H new ATOM 0 HG LEU A 128 -8.497 11.920 8.010 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.860 14.234 8.576 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -6.481 13.307 7.939 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.315 14.488 6.901 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -10.153 13.738 7.827 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -9.696 13.976 6.124 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -10.453 12.450 6.637 1.00 0.00 H new ATOM 677 N PHE A 129 -7.320 9.114 4.312 1.00 0.00 N ATOM 678 CA PHE A 129 -6.718 8.473 3.152 1.00 0.00 C ATOM 679 C PHE A 129 -6.927 6.962 3.203 1.00 0.00 C ATOM 680 O PHE A 129 -7.009 6.372 4.280 1.00 0.00 O ATOM 681 CB PHE A 129 -5.213 8.799 3.050 1.00 0.00 C ATOM 682 CG PHE A 129 -4.324 8.047 4.015 1.00 0.00 C ATOM 683 CD1 PHE A 129 -4.050 8.552 5.277 1.00 0.00 C ATOM 684 CD2 PHE A 129 -3.754 6.835 3.646 1.00 0.00 C ATOM 685 CE1 PHE A 129 -3.226 7.860 6.152 1.00 0.00 C ATOM 686 CE2 PHE A 129 -2.930 6.144 4.517 1.00 0.00 C ATOM 687 CZ PHE A 129 -2.667 6.656 5.770 1.00 0.00 C ATOM 0 H PHE A 129 -7.140 8.642 5.198 1.00 0.00 H new ATOM 0 HA PHE A 129 -7.212 8.866 2.263 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -4.880 8.587 2.034 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -5.077 9.868 3.214 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.483 9.494 5.582 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.957 6.427 2.667 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.021 8.263 7.133 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -2.493 5.204 4.215 1.00 0.00 H new ATOM 0 HZ PHE A 129 -2.025 6.117 6.451 1.00 0.00 H new ATOM 697 N TRP A 130 -7.044 6.355 2.030 1.00 0.00 N ATOM 698 CA TRP A 130 -7.052 4.906 1.902 1.00 0.00 C ATOM 699 C TRP A 130 -6.586 4.553 0.496 1.00 0.00 C ATOM 700 O TRP A 130 -6.737 5.349 -0.425 1.00 0.00 O ATOM 701 CB TRP A 130 -8.443 4.317 2.205 1.00 0.00 C ATOM 702 CG TRP A 130 -9.353 4.191 1.018 1.00 0.00 C ATOM 703 CD1 TRP A 130 -9.650 3.041 0.347 1.00 0.00 C ATOM 704 CD2 TRP A 130 -10.090 5.234 0.368 1.00 0.00 C ATOM 705 NE1 TRP A 130 -10.522 3.302 -0.678 1.00 0.00 N ATOM 706 CE2 TRP A 130 -10.806 4.640 -0.690 1.00 0.00 C ATOM 707 CE3 TRP A 130 -10.214 6.608 0.574 1.00 0.00 C ATOM 708 CZ2 TRP A 130 -11.631 5.371 -1.536 1.00 0.00 C ATOM 709 CZ3 TRP A 130 -11.035 7.333 -0.267 1.00 0.00 C ATOM 710 CH2 TRP A 130 -11.734 6.714 -1.311 1.00 0.00 C ATOM 0 H TRP A 130 -7.136 6.852 1.144 1.00 0.00 H new ATOM 0 HA TRP A 130 -6.374 4.468 2.634 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -8.314 3.331 2.651 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -8.931 4.943 2.952 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -9.255 2.065 0.589 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -10.898 2.610 -1.327 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -9.678 7.095 1.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -12.171 4.895 -2.341 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -11.140 8.397 -0.117 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -12.367 7.311 -1.951 1.00 0.00 H new ATOM 721 N LEU A 131 -5.998 3.384 0.323 1.00 0.00 N ATOM 722 CA LEU A 131 -5.404 3.043 -0.960 1.00 0.00 C ATOM 723 C LEU A 131 -6.213 1.974 -1.685 1.00 0.00 C ATOM 724 O LEU A 131 -6.739 1.044 -1.069 1.00 0.00 O ATOM 725 CB LEU A 131 -3.948 2.581 -0.791 1.00 0.00 C ATOM 726 CG LEU A 131 -2.943 3.658 -0.359 1.00 0.00 C ATOM 727 CD1 LEU A 131 -3.115 4.019 1.111 1.00 0.00 C ATOM 728 CD2 LEU A 131 -1.521 3.191 -0.623 1.00 0.00 C ATOM 0 H LEU A 131 -5.918 2.664 1.041 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.414 3.947 -1.568 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -3.926 1.777 -0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -3.611 2.157 -1.737 1.00 0.00 H new ATOM 0 HG LEU A 131 -3.138 4.553 -0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -2.389 4.784 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -4.123 4.400 1.277 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -2.957 3.132 1.724 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -0.820 3.965 -0.312 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -1.327 2.278 -0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -1.394 2.994 -1.688 1.00 0.00 H new ATOM 740 N THR A 132 -6.308 2.127 -2.997 1.00 0.00 N ATOM 741 CA THR A 132 -7.045 1.204 -3.842 1.00 0.00 C ATOM 742 C THR A 132 -6.139 0.615 -4.923 1.00 0.00 C ATOM 743 O THR A 132 -5.412 1.341 -5.604 1.00 0.00 O ATOM 744 CB THR A 132 -8.236 1.914 -4.514 1.00 0.00 C ATOM 745 OG1 THR A 132 -7.805 3.161 -5.077 1.00 0.00 O ATOM 746 CG2 THR A 132 -9.360 2.162 -3.521 1.00 0.00 C ATOM 0 H THR A 132 -5.874 2.897 -3.506 1.00 0.00 H new ATOM 0 HA THR A 132 -7.415 0.399 -3.207 1.00 0.00 H new ATOM 0 HB THR A 132 -8.615 1.266 -5.304 1.00 0.00 H new ATOM 0 HG1 THR A 132 -8.566 3.607 -5.504 1.00 0.00 H new ATOM 0 HG21 THR A 132 -10.186 2.664 -4.024 1.00 0.00 H new ATOM 0 HG22 THR A 132 -9.706 1.210 -3.118 1.00 0.00 H new ATOM 0 HG23 THR A 132 -8.995 2.790 -2.708 1.00 0.00 H new ATOM 754 N PHE A 133 -6.175 -0.702 -5.075 1.00 0.00 N ATOM 755 CA PHE A 133 -5.442 -1.355 -6.148 1.00 0.00 C ATOM 756 C PHE A 133 -6.374 -1.708 -7.303 1.00 0.00 C ATOM 757 O PHE A 133 -6.224 -1.210 -8.416 1.00 0.00 O ATOM 758 CB PHE A 133 -4.727 -2.621 -5.645 1.00 0.00 C ATOM 759 CG PHE A 133 -4.429 -3.600 -6.749 1.00 0.00 C ATOM 760 CD1 PHE A 133 -3.478 -3.316 -7.716 1.00 0.00 C ATOM 761 CD2 PHE A 133 -5.133 -4.791 -6.835 1.00 0.00 C ATOM 762 CE1 PHE A 133 -3.238 -4.202 -8.749 1.00 0.00 C ATOM 763 CE2 PHE A 133 -4.893 -5.681 -7.861 1.00 0.00 C ATOM 764 CZ PHE A 133 -3.949 -5.385 -8.820 1.00 0.00 C ATOM 0 H PHE A 133 -6.701 -1.335 -4.472 1.00 0.00 H new ATOM 0 HA PHE A 133 -4.688 -0.653 -6.505 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -3.795 -2.337 -5.156 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.346 -3.108 -4.891 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -2.919 -2.393 -7.662 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -5.879 -5.025 -6.089 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.496 -3.970 -9.499 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.444 -6.608 -7.913 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.765 -6.078 -9.628 1.00 0.00 H new ATOM 774 N GLU A 134 -7.344 -2.561 -7.020 1.00 0.00 N ATOM 775 CA GLU A 134 -8.240 -3.075 -8.046 1.00 0.00 C ATOM 776 C GLU A 134 -9.527 -2.244 -8.079 1.00 0.00 C ATOM 777 O GLU A 134 -10.593 -2.728 -8.454 1.00 0.00 O ATOM 778 CB GLU A 134 -8.558 -4.546 -7.752 1.00 0.00 C ATOM 779 CG GLU A 134 -9.121 -5.310 -8.939 1.00 0.00 C ATOM 780 CD GLU A 134 -9.469 -6.742 -8.596 1.00 0.00 C ATOM 781 OE1 GLU A 134 -8.574 -7.608 -8.641 1.00 0.00 O ATOM 782 OE2 GLU A 134 -10.648 -7.009 -8.283 1.00 0.00 O ATOM 0 H GLU A 134 -7.533 -2.915 -6.082 1.00 0.00 H new ATOM 0 HA GLU A 134 -7.759 -3.004 -9.021 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -7.649 -5.042 -7.413 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -9.273 -4.595 -6.931 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -10.013 -4.801 -9.305 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -8.393 -5.301 -9.751 1.00 0.00 H new ATOM 789 N GLY A 135 -9.415 -0.983 -7.683 1.00 0.00 N ATOM 790 CA GLY A 135 -10.588 -0.133 -7.564 1.00 0.00 C ATOM 791 C GLY A 135 -11.303 -0.351 -6.247 1.00 0.00 C ATOM 792 O GLY A 135 -12.359 0.230 -5.989 1.00 0.00 O ATOM 0 H GLY A 135 -8.533 -0.531 -7.441 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -10.291 0.912 -7.649 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -11.272 -0.338 -8.388 1.00 0.00 H new ATOM 796 N LYS A 136 -10.713 -1.191 -5.411 1.00 0.00 N ATOM 797 CA LYS A 136 -11.286 -1.538 -4.122 1.00 0.00 C ATOM 798 C LYS A 136 -10.257 -1.305 -3.024 1.00 0.00 C ATOM 799 O LYS A 136 -9.051 -1.412 -3.273 1.00 0.00 O ATOM 800 CB LYS A 136 -11.730 -3.006 -4.116 1.00 0.00 C ATOM 801 CG LYS A 136 -12.704 -3.351 -5.231 1.00 0.00 C ATOM 802 CD LYS A 136 -13.113 -4.816 -5.192 1.00 0.00 C ATOM 803 CE LYS A 136 -11.914 -5.744 -5.322 1.00 0.00 C ATOM 804 NZ LYS A 136 -12.333 -7.162 -5.427 1.00 0.00 N ATOM 0 H LYS A 136 -9.824 -1.651 -5.608 1.00 0.00 H new ATOM 0 HA LYS A 136 -12.157 -0.908 -3.941 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.850 -3.643 -4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.194 -3.233 -3.156 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -13.591 -2.724 -5.145 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -12.247 -3.127 -6.195 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -13.632 -5.023 -4.256 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -13.817 -5.018 -5.999 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -11.334 -5.469 -6.203 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -11.261 -5.620 -4.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -11.492 -7.767 -5.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -12.866 -7.431 -4.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -12.936 -7.285 -6.265 1.00 0.00 H new ATOM 818 N PRO A 137 -10.714 -0.960 -1.810 1.00 0.00 N ATOM 819 CA PRO A 137 -9.827 -0.728 -0.662 1.00 0.00 C ATOM 820 C PRO A 137 -9.046 -1.982 -0.274 1.00 0.00 C ATOM 821 O PRO A 137 -9.526 -3.106 -0.446 1.00 0.00 O ATOM 822 CB PRO A 137 -10.788 -0.324 0.466 1.00 0.00 C ATOM 823 CG PRO A 137 -12.124 -0.828 0.041 1.00 0.00 C ATOM 824 CD PRO A 137 -12.132 -0.763 -1.459 1.00 0.00 C ATOM 0 HA PRO A 137 -9.071 0.026 -0.880 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -10.486 -0.763 1.417 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -10.801 0.757 0.604 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -12.285 -1.849 0.388 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -12.923 -0.218 0.462 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -12.766 -1.537 -1.893 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -12.507 0.195 -1.819 1.00 0.00 H new ATOM 832 N LEU A 138 -7.840 -1.791 0.239 1.00 0.00 N ATOM 833 CA LEU A 138 -6.996 -2.910 0.631 1.00 0.00 C ATOM 834 C LEU A 138 -7.124 -3.175 2.126 1.00 0.00 C ATOM 835 O LEU A 138 -6.732 -2.340 2.939 1.00 0.00 O ATOM 836 CB LEU A 138 -5.531 -2.626 0.285 1.00 0.00 C ATOM 837 CG LEU A 138 -5.262 -2.193 -1.159 1.00 0.00 C ATOM 838 CD1 LEU A 138 -3.767 -2.030 -1.391 1.00 0.00 C ATOM 839 CD2 LEU A 138 -5.850 -3.188 -2.146 1.00 0.00 C ATOM 0 H LEU A 138 -7.424 -0.873 0.394 1.00 0.00 H new ATOM 0 HA LEU A 138 -7.326 -3.792 0.082 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.163 -1.847 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.948 -3.524 0.490 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.748 -1.231 -1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.590 -1.722 -2.422 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.374 -1.272 -0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.264 -2.979 -1.205 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -5.644 -2.856 -3.164 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -5.400 -4.168 -1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -6.928 -3.255 -1.997 1.00 0.00 H new ATOM 851 N GLU A 139 -7.699 -4.319 2.483 1.00 0.00 N ATOM 852 CA GLU A 139 -7.752 -4.735 3.881 1.00 0.00 C ATOM 853 C GLU A 139 -6.342 -4.915 4.423 1.00 0.00 C ATOM 854 O GLU A 139 -5.516 -5.591 3.808 1.00 0.00 O ATOM 855 CB GLU A 139 -8.526 -6.045 4.045 1.00 0.00 C ATOM 856 CG GLU A 139 -10.028 -5.902 3.885 1.00 0.00 C ATOM 857 CD GLU A 139 -10.757 -7.204 4.147 1.00 0.00 C ATOM 858 OE1 GLU A 139 -10.828 -7.628 5.320 1.00 0.00 O ATOM 859 OE2 GLU A 139 -11.252 -7.816 3.181 1.00 0.00 O ATOM 0 H GLU A 139 -8.132 -4.971 1.829 1.00 0.00 H new ATOM 0 HA GLU A 139 -8.269 -3.955 4.440 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.160 -6.765 3.312 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.314 -6.458 5.031 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -10.394 -5.138 4.571 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -10.253 -5.558 2.876 1.00 0.00 H new ATOM 866 N ASP A 140 -6.075 -4.323 5.578 1.00 0.00 N ATOM 867 CA ASP A 140 -4.739 -4.352 6.154 1.00 0.00 C ATOM 868 C ASP A 140 -4.441 -5.699 6.808 1.00 0.00 C ATOM 869 O ASP A 140 -3.280 -6.048 7.032 1.00 0.00 O ATOM 870 CB ASP A 140 -4.556 -3.200 7.148 1.00 0.00 C ATOM 871 CG ASP A 140 -5.498 -3.264 8.333 1.00 0.00 C ATOM 872 OD1 ASP A 140 -5.129 -3.876 9.354 1.00 0.00 O ATOM 873 OD2 ASP A 140 -6.599 -2.678 8.251 1.00 0.00 O ATOM 0 H ASP A 140 -6.765 -3.817 6.134 1.00 0.00 H new ATOM 0 HA ASP A 140 -4.021 -4.220 5.344 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.528 -3.205 7.511 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -4.705 -2.255 6.627 1.00 0.00 H new ATOM 878 N GLN A 141 -5.489 -6.460 7.099 1.00 0.00 N ATOM 879 CA GLN A 141 -5.338 -7.788 7.681 1.00 0.00 C ATOM 880 C GLN A 141 -4.765 -8.763 6.654 1.00 0.00 C ATOM 881 O GLN A 141 -3.944 -9.619 6.985 1.00 0.00 O ATOM 882 CB GLN A 141 -6.697 -8.275 8.203 1.00 0.00 C ATOM 883 CG GLN A 141 -6.664 -9.595 8.963 1.00 0.00 C ATOM 884 CD GLN A 141 -6.943 -10.805 8.086 1.00 0.00 C ATOM 885 OE1 GLN A 141 -6.026 -11.436 7.560 1.00 0.00 O ATOM 886 NE2 GLN A 141 -8.215 -11.131 7.915 1.00 0.00 N ATOM 0 H GLN A 141 -6.457 -6.179 6.941 1.00 0.00 H new ATOM 0 HA GLN A 141 -4.638 -7.737 8.515 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.113 -7.508 8.856 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -7.377 -8.378 7.358 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.686 -9.712 9.430 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -7.399 -9.561 9.767 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -8.947 -10.584 8.368 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -8.463 -11.929 7.331 1.00 0.00 H new ATOM 895 N LEU A 142 -5.176 -8.604 5.403 1.00 0.00 N ATOM 896 CA LEU A 142 -4.810 -9.539 4.347 1.00 0.00 C ATOM 897 C LEU A 142 -3.382 -9.291 3.851 1.00 0.00 C ATOM 898 O LEU A 142 -2.835 -8.200 4.032 1.00 0.00 O ATOM 899 CB LEU A 142 -5.811 -9.431 3.191 1.00 0.00 C ATOM 900 CG LEU A 142 -7.255 -9.802 3.553 1.00 0.00 C ATOM 901 CD1 LEU A 142 -8.165 -9.645 2.347 1.00 0.00 C ATOM 902 CD2 LEU A 142 -7.325 -11.227 4.084 1.00 0.00 C ATOM 0 H LEU A 142 -5.766 -7.832 5.093 1.00 0.00 H new ATOM 0 HA LEU A 142 -4.842 -10.549 4.755 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.798 -8.409 2.812 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.478 -10.077 2.379 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.595 -9.123 4.335 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -9.185 -9.913 2.623 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -8.141 -8.610 2.006 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -7.823 -10.299 1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.357 -11.471 4.335 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -6.964 -11.917 3.322 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.704 -11.314 4.976 1.00 0.00 H new ATOM 914 N PRO A 143 -2.754 -10.312 3.231 1.00 0.00 N ATOM 915 CA PRO A 143 -1.381 -10.206 2.724 1.00 0.00 C ATOM 916 C PRO A 143 -1.270 -9.268 1.520 1.00 0.00 C ATOM 917 O PRO A 143 -2.181 -9.180 0.695 1.00 0.00 O ATOM 918 CB PRO A 143 -1.027 -11.642 2.327 1.00 0.00 C ATOM 919 CG PRO A 143 -2.335 -12.303 2.060 1.00 0.00 C ATOM 920 CD PRO A 143 -3.332 -11.648 2.978 1.00 0.00 C ATOM 0 HA PRO A 143 -0.708 -9.783 3.470 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -0.388 -11.661 1.444 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -0.484 -12.149 3.125 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -2.627 -12.181 1.017 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -2.276 -13.375 2.251 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -4.316 -11.577 2.514 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -3.455 -12.212 3.902 1.00 0.00 H new ATOM 928 N LEU A 144 -0.136 -8.588 1.426 1.00 0.00 N ATOM 929 CA LEU A 144 0.084 -7.569 0.409 1.00 0.00 C ATOM 930 C LEU A 144 0.263 -8.186 -0.975 1.00 0.00 C ATOM 931 O LEU A 144 -0.202 -7.635 -1.976 1.00 0.00 O ATOM 932 CB LEU A 144 1.326 -6.751 0.766 1.00 0.00 C ATOM 933 CG LEU A 144 1.517 -5.469 -0.043 1.00 0.00 C ATOM 934 CD1 LEU A 144 0.417 -4.475 0.275 1.00 0.00 C ATOM 935 CD2 LEU A 144 2.878 -4.861 0.238 1.00 0.00 C ATOM 0 H LEU A 144 0.657 -8.727 2.052 1.00 0.00 H new ATOM 0 HA LEU A 144 -0.796 -6.926 0.381 1.00 0.00 H new ATOM 0 HB2 LEU A 144 1.278 -6.490 1.823 1.00 0.00 H new ATOM 0 HB3 LEU A 144 2.206 -7.380 0.633 1.00 0.00 H new ATOM 0 HG LEU A 144 1.463 -5.718 -1.103 1.00 0.00 H new ATOM 0 HD11 LEU A 144 0.567 -3.567 -0.309 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -0.550 -4.911 0.026 1.00 0.00 H new ATOM 0 HD13 LEU A 144 0.443 -4.231 1.337 1.00 0.00 H new ATOM 0 HD21 LEU A 144 2.997 -3.949 -0.347 1.00 0.00 H new ATOM 0 HD22 LEU A 144 2.959 -4.625 1.299 1.00 0.00 H new ATOM 0 HD23 LEU A 144 3.658 -5.572 -0.036 1.00 0.00 H new ATOM 947 N GLY A 145 0.937 -9.335 -1.026 1.00 0.00 N ATOM 948 CA GLY A 145 1.236 -9.982 -2.293 1.00 0.00 C ATOM 949 C GLY A 145 0.004 -10.295 -3.125 1.00 0.00 C ATOM 950 O GLY A 145 0.085 -10.390 -4.347 1.00 0.00 O ATOM 0 H GLY A 145 1.283 -9.831 -0.205 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.900 -9.339 -2.871 1.00 0.00 H new ATOM 0 HA3 GLY A 145 1.777 -10.908 -2.099 1.00 0.00 H new ATOM 954 N GLU A 146 -1.140 -10.447 -2.474 1.00 0.00 N ATOM 955 CA GLU A 146 -2.373 -10.760 -3.169 1.00 0.00 C ATOM 956 C GLU A 146 -2.807 -9.616 -4.079 1.00 0.00 C ATOM 957 O GLU A 146 -3.438 -9.833 -5.111 1.00 0.00 O ATOM 958 CB GLU A 146 -3.469 -11.074 -2.155 1.00 0.00 C ATOM 959 CG GLU A 146 -3.158 -12.284 -1.293 1.00 0.00 C ATOM 960 CD GLU A 146 -2.784 -13.497 -2.116 1.00 0.00 C ATOM 961 OE1 GLU A 146 -3.694 -14.164 -2.647 1.00 0.00 O ATOM 962 OE2 GLU A 146 -1.576 -13.780 -2.249 1.00 0.00 O ATOM 0 H GLU A 146 -1.237 -10.358 -1.463 1.00 0.00 H new ATOM 0 HA GLU A 146 -2.198 -11.633 -3.797 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -3.619 -10.207 -1.512 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -4.407 -11.244 -2.684 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -2.340 -12.043 -0.614 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.025 -12.520 -0.676 1.00 0.00 H new ATOM 969 N TYR A 147 -2.455 -8.398 -3.697 1.00 0.00 N ATOM 970 CA TYR A 147 -2.837 -7.223 -4.468 1.00 0.00 C ATOM 971 C TYR A 147 -1.684 -6.734 -5.332 1.00 0.00 C ATOM 972 O TYR A 147 -1.880 -6.320 -6.472 1.00 0.00 O ATOM 973 CB TYR A 147 -3.287 -6.104 -3.529 1.00 0.00 C ATOM 974 CG TYR A 147 -4.419 -6.502 -2.612 1.00 0.00 C ATOM 975 CD1 TYR A 147 -5.733 -6.522 -3.065 1.00 0.00 C ATOM 976 CD2 TYR A 147 -4.175 -6.857 -1.290 1.00 0.00 C ATOM 977 CE1 TYR A 147 -6.768 -6.886 -2.229 1.00 0.00 C ATOM 978 CE2 TYR A 147 -5.208 -7.224 -0.450 1.00 0.00 C ATOM 979 CZ TYR A 147 -6.501 -7.235 -0.924 1.00 0.00 C ATOM 980 OH TYR A 147 -7.532 -7.599 -0.091 1.00 0.00 O ATOM 0 H TYR A 147 -1.907 -8.197 -2.861 1.00 0.00 H new ATOM 0 HA TYR A 147 -3.662 -7.503 -5.123 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -2.437 -5.784 -2.926 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -3.597 -5.245 -4.124 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -5.947 -6.248 -4.088 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -3.162 -6.846 -0.914 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -7.784 -6.897 -2.596 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -5.003 -7.501 0.574 1.00 0.00 H new ATOM 0 HH TYR A 147 -8.247 -8.013 -0.618 1.00 0.00 H new ATOM 990 N GLY A 148 -0.480 -6.801 -4.785 1.00 0.00 N ATOM 991 CA GLY A 148 0.674 -6.221 -5.444 1.00 0.00 C ATOM 992 C GLY A 148 1.511 -7.224 -6.213 1.00 0.00 C ATOM 993 O GLY A 148 2.579 -6.871 -6.696 1.00 0.00 O ATOM 0 H GLY A 148 -0.280 -7.249 -3.891 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.336 -5.443 -6.129 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.302 -5.736 -4.696 1.00 0.00 H new ATOM 997 N LEU A 149 1.029 -8.473 -6.302 1.00 0.00 N ATOM 998 CA LEU A 149 1.765 -9.594 -6.924 1.00 0.00 C ATOM 999 C LEU A 149 2.580 -9.195 -8.160 1.00 0.00 C ATOM 1000 O LEU A 149 3.682 -9.700 -8.368 1.00 0.00 O ATOM 1001 CB LEU A 149 0.806 -10.742 -7.294 1.00 0.00 C ATOM 1002 CG LEU A 149 -0.200 -10.458 -8.420 1.00 0.00 C ATOM 1003 CD1 LEU A 149 -0.802 -11.760 -8.926 1.00 0.00 C ATOM 1004 CD2 LEU A 149 -1.310 -9.529 -7.948 1.00 0.00 C ATOM 0 H LEU A 149 0.112 -8.739 -5.943 1.00 0.00 H new ATOM 0 HA LEU A 149 2.477 -9.925 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 149 1.404 -11.607 -7.581 1.00 0.00 H new ATOM 0 HB3 LEU A 149 0.248 -11.022 -6.400 1.00 0.00 H new ATOM 0 HG LEU A 149 0.337 -9.966 -9.231 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.513 -11.546 -9.724 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -0.009 -12.403 -9.309 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.315 -12.266 -8.108 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -2.005 -9.347 -8.767 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -1.842 -9.991 -7.116 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.878 -8.583 -7.622 1.00 0.00 H new ATOM 1016 N LYS A 150 2.040 -8.305 -8.975 1.00 0.00 N ATOM 1017 CA LYS A 150 2.754 -7.836 -10.150 1.00 0.00 C ATOM 1018 C LYS A 150 3.575 -6.599 -9.812 1.00 0.00 C ATOM 1019 O LYS A 150 3.040 -5.616 -9.307 1.00 0.00 O ATOM 1020 CB LYS A 150 1.777 -7.517 -11.280 1.00 0.00 C ATOM 1021 CG LYS A 150 2.454 -7.040 -12.554 1.00 0.00 C ATOM 1022 CD LYS A 150 1.461 -6.863 -13.690 1.00 0.00 C ATOM 1023 CE LYS A 150 0.377 -5.854 -13.345 1.00 0.00 C ATOM 1024 NZ LYS A 150 -0.601 -5.699 -14.453 1.00 0.00 N ATOM 0 H LYS A 150 1.115 -7.895 -8.846 1.00 0.00 H new ATOM 0 HA LYS A 150 3.426 -8.628 -10.480 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.189 -8.407 -11.503 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.080 -6.751 -10.941 1.00 0.00 H new ATOM 0 HG2 LYS A 150 2.961 -6.094 -12.364 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.219 -7.758 -12.849 1.00 0.00 H new ATOM 0 HD2 LYS A 150 1.989 -6.536 -14.586 1.00 0.00 H new ATOM 0 HD3 LYS A 150 1.002 -7.824 -13.923 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -0.143 -6.173 -12.442 1.00 0.00 H new ATOM 0 HE3 LYS A 150 0.834 -4.889 -13.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -1.325 -5.003 -14.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -0.108 -5.371 -15.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -1.055 -6.614 -14.646 1.00 0.00 H new ATOM 1038 N PRO A 151 4.883 -6.626 -10.103 1.00 0.00 N ATOM 1039 CA PRO A 151 5.786 -5.486 -9.877 1.00 0.00 C ATOM 1040 C PRO A 151 5.533 -4.329 -10.853 1.00 0.00 C ATOM 1041 O PRO A 151 6.436 -3.554 -11.169 1.00 0.00 O ATOM 1042 CB PRO A 151 7.174 -6.087 -10.104 1.00 0.00 C ATOM 1043 CG PRO A 151 6.944 -7.239 -11.016 1.00 0.00 C ATOM 1044 CD PRO A 151 5.591 -7.789 -10.661 1.00 0.00 C ATOM 0 HA PRO A 151 5.650 -5.050 -8.887 1.00 0.00 H new ATOM 0 HB2 PRO A 151 7.852 -5.359 -10.549 1.00 0.00 H new ATOM 0 HB3 PRO A 151 7.624 -6.409 -9.165 1.00 0.00 H new ATOM 0 HG2 PRO A 151 6.975 -6.923 -12.059 1.00 0.00 H new ATOM 0 HG3 PRO A 151 7.718 -7.996 -10.890 1.00 0.00 H new ATOM 0 HD2 PRO A 151 5.078 -8.189 -11.536 1.00 0.00 H new ATOM 0 HD3 PRO A 151 5.665 -8.600 -9.936 1.00 0.00 H new ATOM 1052 N LEU A 152 4.298 -4.235 -11.326 1.00 0.00 N ATOM 1053 CA LEU A 152 3.860 -3.148 -12.189 1.00 0.00 C ATOM 1054 C LEU A 152 2.441 -2.756 -11.780 1.00 0.00 C ATOM 1055 O LEU A 152 1.724 -2.073 -12.508 1.00 0.00 O ATOM 1056 CB LEU A 152 3.902 -3.598 -13.660 1.00 0.00 C ATOM 1057 CG LEU A 152 4.408 -2.563 -14.680 1.00 0.00 C ATOM 1058 CD1 LEU A 152 3.446 -1.391 -14.818 1.00 0.00 C ATOM 1059 CD2 LEU A 152 5.792 -2.063 -14.295 1.00 0.00 C ATOM 0 H LEU A 152 3.567 -4.916 -11.120 1.00 0.00 H new ATOM 0 HA LEU A 152 4.520 -2.287 -12.084 1.00 0.00 H new ATOM 0 HB2 LEU A 152 4.536 -4.482 -13.728 1.00 0.00 H new ATOM 0 HB3 LEU A 152 2.897 -3.902 -13.953 1.00 0.00 H new ATOM 0 HG LEU A 152 4.468 -3.062 -15.647 1.00 0.00 H new ATOM 0 HD11 LEU A 152 3.838 -0.682 -15.547 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.475 -1.755 -15.152 1.00 0.00 H new ATOM 0 HD13 LEU A 152 3.335 -0.896 -13.853 1.00 0.00 H new ATOM 0 HD21 LEU A 152 6.132 -1.332 -15.029 1.00 0.00 H new ATOM 0 HD22 LEU A 152 5.750 -1.596 -13.311 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.488 -2.902 -14.269 1.00 0.00 H new ATOM 1071 N SER A 153 2.038 -3.219 -10.603 1.00 0.00 N ATOM 1072 CA SER A 153 0.731 -2.890 -10.058 1.00 0.00 C ATOM 1073 C SER A 153 0.723 -1.464 -9.517 1.00 0.00 C ATOM 1074 O SER A 153 1.635 -1.053 -8.794 1.00 0.00 O ATOM 1075 CB SER A 153 0.351 -3.884 -8.955 1.00 0.00 C ATOM 1076 OG SER A 153 1.373 -3.988 -7.979 1.00 0.00 O ATOM 0 H SER A 153 2.602 -3.826 -10.007 1.00 0.00 H new ATOM 0 HA SER A 153 -0.007 -2.959 -10.857 1.00 0.00 H new ATOM 0 HB2 SER A 153 -0.577 -3.566 -8.480 1.00 0.00 H new ATOM 0 HB3 SER A 153 0.164 -4.864 -9.394 1.00 0.00 H new ATOM 0 HG SER A 153 1.951 -4.750 -8.191 1.00 0.00 H new ATOM 1082 N THR A 154 -0.290 -0.705 -9.891 1.00 0.00 N ATOM 1083 CA THR A 154 -0.417 0.659 -9.428 1.00 0.00 C ATOM 1084 C THR A 154 -1.319 0.731 -8.206 1.00 0.00 C ATOM 1085 O THR A 154 -2.526 0.508 -8.296 1.00 0.00 O ATOM 1086 CB THR A 154 -0.983 1.578 -10.523 1.00 0.00 C ATOM 1087 OG1 THR A 154 -0.245 1.413 -11.740 1.00 0.00 O ATOM 1088 CG2 THR A 154 -0.918 3.031 -10.083 1.00 0.00 C ATOM 0 H THR A 154 -1.036 -1.013 -10.515 1.00 0.00 H new ATOM 0 HA THR A 154 0.584 1.001 -9.166 1.00 0.00 H new ATOM 0 HB THR A 154 -2.024 1.304 -10.694 1.00 0.00 H new ATOM 0 HG1 THR A 154 -0.616 2.002 -12.430 1.00 0.00 H new ATOM 0 HG21 THR A 154 -1.323 3.668 -10.870 1.00 0.00 H new ATOM 0 HG22 THR A 154 -1.503 3.162 -9.173 1.00 0.00 H new ATOM 0 HG23 THR A 154 0.119 3.307 -9.890 1.00 0.00 H new ATOM 1096 N VAL A 155 -0.723 1.027 -7.065 1.00 0.00 N ATOM 1097 CA VAL A 155 -1.481 1.211 -5.843 1.00 0.00 C ATOM 1098 C VAL A 155 -1.820 2.689 -5.679 1.00 0.00 C ATOM 1099 O VAL A 155 -0.941 3.512 -5.437 1.00 0.00 O ATOM 1100 CB VAL A 155 -0.699 0.715 -4.608 1.00 0.00 C ATOM 1101 CG1 VAL A 155 -1.553 0.811 -3.355 1.00 0.00 C ATOM 1102 CG2 VAL A 155 -0.218 -0.715 -4.815 1.00 0.00 C ATOM 0 H VAL A 155 0.285 1.145 -6.960 1.00 0.00 H new ATOM 0 HA VAL A 155 -2.395 0.621 -5.916 1.00 0.00 H new ATOM 0 HB VAL A 155 0.172 1.357 -4.479 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -0.982 0.456 -2.497 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -1.845 1.848 -3.192 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -2.446 0.197 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 155 0.331 -1.046 -3.933 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -1.076 -1.368 -4.974 1.00 0.00 H new ATOM 0 HG23 VAL A 155 0.436 -0.756 -5.686 1.00 0.00 H new ATOM 1112 N PHE A 156 -3.086 3.027 -5.842 1.00 0.00 N ATOM 1113 CA PHE A 156 -3.510 4.415 -5.786 1.00 0.00 C ATOM 1114 C PHE A 156 -3.770 4.849 -4.354 1.00 0.00 C ATOM 1115 O PHE A 156 -4.615 4.279 -3.666 1.00 0.00 O ATOM 1116 CB PHE A 156 -4.769 4.626 -6.629 1.00 0.00 C ATOM 1117 CG PHE A 156 -4.534 4.525 -8.106 1.00 0.00 C ATOM 1118 CD1 PHE A 156 -4.170 5.644 -8.836 1.00 0.00 C ATOM 1119 CD2 PHE A 156 -4.681 3.316 -8.766 1.00 0.00 C ATOM 1120 CE1 PHE A 156 -3.957 5.561 -10.198 1.00 0.00 C ATOM 1121 CE2 PHE A 156 -4.469 3.227 -10.129 1.00 0.00 C ATOM 1122 CZ PHE A 156 -4.104 4.351 -10.845 1.00 0.00 C ATOM 0 H PHE A 156 -3.839 2.360 -6.014 1.00 0.00 H new ATOM 0 HA PHE A 156 -2.704 5.026 -6.192 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -5.517 3.888 -6.339 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -5.185 5.608 -6.403 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -4.051 6.593 -8.334 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -4.964 2.434 -8.210 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -3.676 6.442 -10.756 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -4.589 2.280 -10.634 1.00 0.00 H new ATOM 0 HZ PHE A 156 -3.934 4.283 -11.909 1.00 0.00 H new ATOM 1132 N MET A 157 -3.040 5.859 -3.909 1.00 0.00 N ATOM 1133 CA MET A 157 -3.283 6.441 -2.604 1.00 0.00 C ATOM 1134 C MET A 157 -4.379 7.484 -2.733 1.00 0.00 C ATOM 1135 O MET A 157 -4.157 8.580 -3.255 1.00 0.00 O ATOM 1136 CB MET A 157 -2.014 7.068 -2.028 1.00 0.00 C ATOM 1137 CG MET A 157 -2.209 7.607 -0.625 1.00 0.00 C ATOM 1138 SD MET A 157 -0.724 8.373 0.046 1.00 0.00 S ATOM 1139 CE MET A 157 -1.336 8.961 1.621 1.00 0.00 C ATOM 0 H MET A 157 -2.278 6.290 -4.432 1.00 0.00 H new ATOM 0 HA MET A 157 -3.595 5.655 -1.916 1.00 0.00 H new ATOM 0 HB2 MET A 157 -1.218 6.323 -2.019 1.00 0.00 H new ATOM 0 HB3 MET A 157 -1.686 7.877 -2.681 1.00 0.00 H new ATOM 0 HG2 MET A 157 -3.017 8.338 -0.632 1.00 0.00 H new ATOM 0 HG3 MET A 157 -2.520 6.794 0.031 1.00 0.00 H new ATOM 0 HE1 MET A 157 -0.975 9.975 1.796 1.00 0.00 H new ATOM 0 HE2 MET A 157 -2.426 8.960 1.611 1.00 0.00 H new ATOM 0 HE3 MET A 157 -0.980 8.307 2.417 1.00 0.00 H new ATOM 1149 N ASN A 158 -5.568 7.123 -2.290 1.00 0.00 N ATOM 1150 CA ASN A 158 -6.752 7.940 -2.495 1.00 0.00 C ATOM 1151 C ASN A 158 -7.133 8.699 -1.230 1.00 0.00 C ATOM 1152 O ASN A 158 -7.317 8.102 -0.168 1.00 0.00 O ATOM 1153 CB ASN A 158 -7.922 7.052 -2.941 1.00 0.00 C ATOM 1154 CG ASN A 158 -7.937 6.775 -4.436 1.00 0.00 C ATOM 1155 OD1 ASN A 158 -8.998 6.597 -5.036 1.00 0.00 O ATOM 1156 ND2 ASN A 158 -6.766 6.733 -5.053 1.00 0.00 N ATOM 0 H ASN A 158 -5.742 6.258 -1.779 1.00 0.00 H new ATOM 0 HA ASN A 158 -6.527 8.672 -3.271 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -7.874 6.104 -2.404 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -8.860 7.531 -2.659 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -6.724 6.549 -6.055 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -5.906 6.885 -4.526 1.00 0.00 H new ATOM 1163 N LEU A 159 -7.216 10.017 -1.340 1.00 0.00 N ATOM 1164 CA LEU A 159 -7.794 10.825 -0.278 1.00 0.00 C ATOM 1165 C LEU A 159 -9.299 10.621 -0.272 1.00 0.00 C ATOM 1166 O LEU A 159 -9.902 10.404 -1.325 1.00 0.00 O ATOM 1167 CB LEU A 159 -7.452 12.302 -0.458 1.00 0.00 C ATOM 1168 CG LEU A 159 -5.971 12.646 -0.307 1.00 0.00 C ATOM 1169 CD1 LEU A 159 -5.745 14.129 -0.543 1.00 0.00 C ATOM 1170 CD2 LEU A 159 -5.466 12.245 1.071 1.00 0.00 C ATOM 0 H LEU A 159 -6.892 10.547 -2.149 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.376 10.511 0.678 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -7.784 12.618 -1.447 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.020 12.882 0.269 1.00 0.00 H new ATOM 0 HG LEU A 159 -5.410 12.086 -1.055 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -4.685 14.358 -0.432 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -6.069 14.391 -1.550 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -6.319 14.705 0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -4.409 12.498 1.159 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -6.032 12.778 1.835 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -5.594 11.171 1.207 1.00 0.00 H new ATOM 1182 N ARG A 160 -9.899 10.680 0.907 1.00 0.00 N ATOM 1183 CA ARG A 160 -11.292 10.305 1.062 1.00 0.00 C ATOM 1184 C ARG A 160 -12.234 11.233 0.302 1.00 0.00 C ATOM 1185 O ARG A 160 -12.827 10.833 -0.701 1.00 0.00 O ATOM 1186 CB ARG A 160 -11.681 10.250 2.536 1.00 0.00 C ATOM 1187 CG ARG A 160 -13.005 9.554 2.755 1.00 0.00 C ATOM 1188 CD ARG A 160 -13.335 9.422 4.225 1.00 0.00 C ATOM 1189 NE ARG A 160 -14.447 8.505 4.432 1.00 0.00 N ATOM 1190 CZ ARG A 160 -14.850 8.080 5.623 1.00 0.00 C ATOM 1191 NH1 ARG A 160 -14.291 8.560 6.730 1.00 0.00 N ATOM 1192 NH2 ARG A 160 -15.827 7.188 5.710 1.00 0.00 N ATOM 0 H ARG A 160 -9.443 10.983 1.767 1.00 0.00 H new ATOM 0 HA ARG A 160 -11.397 9.310 0.630 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -10.903 9.730 3.095 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -11.736 11.264 2.933 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -13.796 10.112 2.254 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -12.975 8.564 2.299 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -12.459 9.065 4.767 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -13.586 10.401 4.634 1.00 0.00 H new ATOM 0 HE ARG A 160 -14.948 8.168 3.610 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -13.550 9.258 6.666 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -14.604 8.231 7.643 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -16.267 6.830 4.863 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -16.138 6.860 6.624 1.00 0.00 H new TER 1206 ARG A 160