USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 732 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 150 HIS : no HD1:sc= -2.36! C(o=-1.7!,f=-6.2!) USER MOD Set 1.2: A 154 THR OG1 : rot -47:sc= 0.7 USER MOD Set 2.1: A 90 TYR OH : rot 34:sc= 1.32 USER MOD Set 2.2: A 105 SER OG : rot -164:sc= 0.266 USER MOD Set 2.3: A 111 SER OG : rot -98:sc= 0.455 USER MOD Set 2.4: A 115 HIS : no HE2:sc= -0.499 K(o=1.5,f=-5.4!) USER MOD Set 3.1: A 93 TYR OH : rot 180:sc= -0.277 USER MOD Set 3.2: A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 155:sc= -1.25 (180deg=-1.68) USER MOD Single : A 68 SER OG : rot -43:sc= 0.513 USER MOD Single : A 70 THR OG1 : rot 86:sc= 1.29 USER MOD Single : A 72 THR OG1 : rot -121:sc= -0.837 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0312 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0.106 USER MOD Single : A 87 SER OG : rot -110:sc= -2.14 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 79:sc= 1.18 USER MOD Single : A 100 GLN : amide:sc= 0.00354 X(o=0.0035,f=0) USER MOD Single : A 107 ASN : amide:sc= 1.04 K(o=1,f=-4.8!) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 90:sc= 1.28 USER MOD Single : A 123 CYS SG : rot 180:sc= -4.04! USER MOD Single : A 125 SER OG : rot 176:sc= 1.18 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 83:sc= 1.18 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0688) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 168:sc= 1.13 (180deg=0.8) USER MOD Single : A 161 ASN : amide:sc= 0.278 K(o=0.28,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 67 -4.811 4.657 -13.382 1.00 0.00 N ATOM 68 CA LYS A 67 -3.871 3.588 -13.625 1.00 0.00 C ATOM 69 C LYS A 67 -2.460 4.026 -13.275 1.00 0.00 C ATOM 70 O LYS A 67 -1.630 3.223 -12.898 1.00 0.00 O ATOM 71 CB LYS A 67 -3.971 3.171 -15.092 1.00 0.00 C ATOM 72 CG LYS A 67 -5.293 2.481 -15.432 1.00 0.00 C ATOM 73 CD LYS A 67 -5.551 2.385 -16.932 1.00 0.00 C ATOM 74 CE LYS A 67 -6.232 3.647 -17.501 1.00 0.00 C ATOM 75 NZ LYS A 67 -5.420 4.880 -17.391 1.00 0.00 N ATOM 0 HA LYS A 67 -4.112 2.734 -12.991 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.856 4.053 -15.723 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -3.146 2.499 -15.329 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.293 1.478 -15.005 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.112 3.027 -14.963 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -4.605 2.223 -17.449 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.178 1.517 -17.134 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.470 3.475 -18.551 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.177 3.801 -16.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -5.713 5.555 -18.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -5.561 5.306 -16.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -4.415 4.646 -17.517 1.00 0.00 H new ATOM 89 N SER A 68 -2.208 5.305 -13.386 1.00 0.00 N ATOM 90 CA SER A 68 -0.912 5.857 -13.098 1.00 0.00 C ATOM 91 C SER A 68 -1.035 7.073 -12.164 1.00 0.00 C ATOM 92 O SER A 68 -2.128 7.668 -12.059 1.00 0.00 O ATOM 93 CB SER A 68 -0.254 6.237 -14.425 1.00 0.00 C ATOM 94 OG SER A 68 -1.137 7.033 -15.223 1.00 0.00 O ATOM 0 H SER A 68 -2.900 5.995 -13.680 1.00 0.00 H new ATOM 0 HA SER A 68 -0.294 5.123 -12.581 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.667 6.788 -14.234 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.022 5.335 -14.970 1.00 0.00 H new ATOM 0 HG SER A 68 -2.040 6.655 -15.188 1.00 0.00 H new ATOM 100 N LEU A 69 0.082 7.456 -11.511 1.00 0.00 N ATOM 101 CA LEU A 69 0.133 8.620 -10.594 1.00 0.00 C ATOM 102 C LEU A 69 -0.240 9.902 -11.319 1.00 0.00 C ATOM 103 O LEU A 69 -0.774 10.843 -10.716 1.00 0.00 O ATOM 104 CB LEU A 69 1.526 8.789 -9.967 1.00 0.00 C ATOM 105 CG LEU A 69 1.949 7.792 -8.891 1.00 0.00 C ATOM 106 CD1 LEU A 69 3.400 8.031 -8.513 1.00 0.00 C ATOM 107 CD2 LEU A 69 1.092 7.968 -7.658 1.00 0.00 C ATOM 0 H LEU A 69 0.974 6.970 -11.603 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.589 8.425 -9.801 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.262 8.747 -10.770 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.580 9.789 -9.537 1.00 0.00 H new ATOM 0 HG LEU A 69 1.827 6.782 -9.283 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.698 7.317 -7.745 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.031 7.902 -9.392 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.514 9.045 -8.130 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.400 7.253 -6.895 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.210 8.981 -7.274 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.046 7.797 -7.914 1.00 0.00 H new ATOM 119 N THR A 70 0.023 9.921 -12.615 1.00 0.00 N ATOM 120 CA THR A 70 -0.304 11.043 -13.481 1.00 0.00 C ATOM 121 C THR A 70 -1.847 11.298 -13.505 1.00 0.00 C ATOM 122 O THR A 70 -2.318 12.395 -13.821 1.00 0.00 O ATOM 123 CB THR A 70 0.200 10.739 -14.923 1.00 0.00 C ATOM 124 OG1 THR A 70 1.590 10.356 -14.882 1.00 0.00 O ATOM 125 CG2 THR A 70 0.062 11.957 -15.821 1.00 0.00 C ATOM 0 H THR A 70 0.476 9.148 -13.102 1.00 0.00 H new ATOM 0 HA THR A 70 0.184 11.938 -13.096 1.00 0.00 H new ATOM 0 HB THR A 70 -0.408 9.929 -15.325 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.659 9.395 -14.704 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.422 11.714 -16.821 1.00 0.00 H new ATOM 0 HG22 THR A 70 -0.986 12.253 -15.874 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.651 12.778 -15.413 1.00 0.00 H new ATOM 133 N GLU A 71 -2.614 10.289 -13.138 1.00 0.00 N ATOM 134 CA GLU A 71 -4.065 10.369 -13.175 1.00 0.00 C ATOM 135 C GLU A 71 -4.633 10.372 -11.768 1.00 0.00 C ATOM 136 O GLU A 71 -5.852 10.279 -11.577 1.00 0.00 O ATOM 137 CB GLU A 71 -4.595 9.137 -13.865 1.00 0.00 C ATOM 138 CG GLU A 71 -3.972 8.859 -15.197 1.00 0.00 C ATOM 139 CD GLU A 71 -4.383 7.530 -15.699 1.00 0.00 C ATOM 140 OE1 GLU A 71 -3.871 6.514 -15.189 1.00 0.00 O ATOM 141 OE2 GLU A 71 -5.232 7.462 -16.589 1.00 0.00 O ATOM 0 H GLU A 71 -2.253 9.394 -12.807 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.351 11.283 -13.695 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.437 8.275 -13.216 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.672 9.244 -13.996 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.266 9.629 -15.910 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.886 8.901 -15.112 1.00 0.00 H new ATOM 148 N THR A 72 -3.787 10.468 -10.787 1.00 0.00 N ATOM 149 CA THR A 72 -4.236 10.327 -9.445 1.00 0.00 C ATOM 150 C THR A 72 -4.513 11.686 -8.777 1.00 0.00 C ATOM 151 O THR A 72 -3.740 12.639 -8.935 1.00 0.00 O ATOM 152 CB THR A 72 -3.213 9.548 -8.638 1.00 0.00 C ATOM 153 OG1 THR A 72 -2.748 8.439 -9.411 1.00 0.00 O ATOM 154 CG2 THR A 72 -3.865 9.015 -7.405 1.00 0.00 C ATOM 0 H THR A 72 -2.788 10.643 -10.895 1.00 0.00 H new ATOM 0 HA THR A 72 -5.179 9.781 -9.470 1.00 0.00 H new ATOM 0 HB THR A 72 -2.382 10.204 -8.377 1.00 0.00 H new ATOM 0 HG1 THR A 72 -2.936 7.605 -8.932 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.135 8.454 -6.821 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.248 9.843 -6.809 1.00 0.00 H new ATOM 0 HG23 THR A 72 -4.689 8.358 -7.684 1.00 0.00 H new ATOM 162 N GLU A 73 -5.632 11.764 -8.072 1.00 0.00 N ATOM 163 CA GLU A 73 -6.014 12.944 -7.328 1.00 0.00 C ATOM 164 C GLU A 73 -5.086 13.123 -6.121 1.00 0.00 C ATOM 165 O GLU A 73 -4.584 12.142 -5.561 1.00 0.00 O ATOM 166 CB GLU A 73 -7.480 12.842 -6.896 1.00 0.00 C ATOM 167 CG GLU A 73 -7.788 11.667 -5.991 1.00 0.00 C ATOM 168 CD GLU A 73 -9.258 11.524 -5.704 1.00 0.00 C ATOM 169 OE1 GLU A 73 -9.785 12.247 -4.827 1.00 0.00 O ATOM 170 OE2 GLU A 73 -9.920 10.691 -6.362 1.00 0.00 O ATOM 0 H GLU A 73 -6.304 10.999 -8.003 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.913 13.823 -7.965 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.759 13.762 -6.383 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -8.104 12.772 -7.787 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.422 10.751 -6.455 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.249 11.786 -5.051 1.00 0.00 H new ATOM 177 N LEU A 74 -4.882 14.352 -5.727 1.00 0.00 N ATOM 178 CA LEU A 74 -3.933 14.694 -4.695 1.00 0.00 C ATOM 179 C LEU A 74 -4.672 15.339 -3.535 1.00 0.00 C ATOM 180 O LEU A 74 -5.353 16.357 -3.709 1.00 0.00 O ATOM 181 CB LEU A 74 -2.868 15.658 -5.312 1.00 0.00 C ATOM 182 CG LEU A 74 -1.625 16.086 -4.471 1.00 0.00 C ATOM 183 CD1 LEU A 74 -1.981 16.994 -3.307 1.00 0.00 C ATOM 184 CD2 LEU A 74 -0.859 14.879 -3.981 1.00 0.00 C ATOM 0 H LEU A 74 -5.375 15.155 -6.117 1.00 0.00 H new ATOM 0 HA LEU A 74 -3.424 13.809 -4.314 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.497 15.191 -6.224 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.388 16.569 -5.609 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.988 16.663 -5.142 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.075 17.257 -2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.454 17.901 -3.684 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -2.670 16.477 -2.639 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.002 15.206 -3.398 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -1.508 14.265 -3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.518 14.294 -4.835 1.00 0.00 H new ATOM 196 N LEU A 75 -4.561 14.753 -2.384 1.00 0.00 N ATOM 197 CA LEU A 75 -5.164 15.293 -1.194 1.00 0.00 C ATOM 198 C LEU A 75 -4.082 15.598 -0.182 1.00 0.00 C ATOM 199 O LEU A 75 -3.236 14.750 0.082 1.00 0.00 O ATOM 200 CB LEU A 75 -6.186 14.318 -0.548 1.00 0.00 C ATOM 201 CG LEU A 75 -7.489 14.003 -1.311 1.00 0.00 C ATOM 202 CD1 LEU A 75 -8.222 15.268 -1.705 1.00 0.00 C ATOM 203 CD2 LEU A 75 -7.248 13.099 -2.510 1.00 0.00 C ATOM 0 H LEU A 75 -4.049 13.883 -2.237 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.701 16.196 -1.485 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.673 13.374 -0.365 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -6.462 14.724 0.425 1.00 0.00 H new ATOM 0 HG LEU A 75 -8.132 13.452 -0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.135 15.008 -2.241 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -8.476 15.835 -0.810 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.584 15.873 -2.349 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.194 12.905 -3.015 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -6.561 13.587 -3.201 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.816 12.156 -2.174 1.00 0.00 H new ATOM 215 N PRO A 76 -4.024 16.820 0.330 1.00 0.00 N ATOM 216 CA PRO A 76 -3.129 17.152 1.432 1.00 0.00 C ATOM 217 C PRO A 76 -3.553 16.342 2.665 1.00 0.00 C ATOM 218 O PRO A 76 -4.746 16.202 2.927 1.00 0.00 O ATOM 219 CB PRO A 76 -3.383 18.651 1.661 1.00 0.00 C ATOM 220 CG PRO A 76 -4.011 19.130 0.405 1.00 0.00 C ATOM 221 CD PRO A 76 -4.798 17.979 -0.123 1.00 0.00 C ATOM 0 HA PRO A 76 -2.079 16.934 1.237 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -4.038 18.814 2.517 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -2.453 19.182 1.865 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -4.654 19.990 0.593 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -3.255 19.449 -0.313 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -5.813 17.967 0.274 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -4.881 18.010 -1.209 1.00 0.00 H new ATOM 229 N ILE A 77 -2.598 15.822 3.431 1.00 0.00 N ATOM 230 CA ILE A 77 -2.950 14.931 4.565 1.00 0.00 C ATOM 231 C ILE A 77 -3.621 15.712 5.693 1.00 0.00 C ATOM 232 O ILE A 77 -4.174 15.136 6.634 1.00 0.00 O ATOM 233 CB ILE A 77 -1.736 14.116 5.132 1.00 0.00 C ATOM 234 CG1 ILE A 77 -0.830 14.939 6.098 1.00 0.00 C ATOM 235 CG2 ILE A 77 -0.913 13.518 3.995 1.00 0.00 C ATOM 236 CD1 ILE A 77 -0.152 16.139 5.508 1.00 0.00 C ATOM 0 H ILE A 77 -1.599 15.987 3.305 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.651 14.205 4.153 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.162 13.311 5.731 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.438 15.269 6.940 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.064 14.275 6.498 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.075 12.956 4.408 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.540 12.851 3.403 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.535 14.319 3.360 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.449 16.630 6.273 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.492 15.826 4.686 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.904 16.835 5.135 1.00 0.00 H new ATOM 248 N THR A 78 -3.541 17.017 5.589 1.00 0.00 N ATOM 249 CA THR A 78 -4.142 17.914 6.511 1.00 0.00 C ATOM 250 C THR A 78 -5.671 17.836 6.412 1.00 0.00 C ATOM 251 O THR A 78 -6.379 17.958 7.415 1.00 0.00 O ATOM 252 CB THR A 78 -3.622 19.329 6.235 1.00 0.00 C ATOM 253 OG1 THR A 78 -3.522 19.524 4.808 1.00 0.00 O ATOM 254 CG2 THR A 78 -2.259 19.541 6.873 1.00 0.00 C ATOM 0 H THR A 78 -3.039 17.484 4.834 1.00 0.00 H new ATOM 0 HA THR A 78 -3.875 17.639 7.531 1.00 0.00 H new ATOM 0 HB THR A 78 -4.318 20.049 6.666 1.00 0.00 H new ATOM 0 HG1 THR A 78 -3.191 20.428 4.624 1.00 0.00 H new ATOM 0 HG21 THR A 78 -1.912 20.553 6.662 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.336 19.401 7.951 1.00 0.00 H new ATOM 0 HG23 THR A 78 -1.550 18.822 6.464 1.00 0.00 H new ATOM 262 N GLU A 79 -6.163 17.556 5.219 1.00 0.00 N ATOM 263 CA GLU A 79 -7.572 17.384 4.994 1.00 0.00 C ATOM 264 C GLU A 79 -7.948 15.914 4.992 1.00 0.00 C ATOM 265 O GLU A 79 -8.478 15.391 4.018 1.00 0.00 O ATOM 266 CB GLU A 79 -8.124 18.154 3.776 1.00 0.00 C ATOM 267 CG GLU A 79 -7.395 17.947 2.463 1.00 0.00 C ATOM 268 CD GLU A 79 -8.027 18.742 1.355 1.00 0.00 C ATOM 269 OE1 GLU A 79 -8.199 19.977 1.518 1.00 0.00 O ATOM 270 OE2 GLU A 79 -8.403 18.171 0.318 1.00 0.00 O ATOM 0 H GLU A 79 -5.590 17.443 4.383 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.073 17.852 5.841 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.167 17.871 3.636 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.111 19.219 4.010 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.351 18.241 2.574 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -7.402 16.888 2.204 1.00 0.00 H new ATOM 277 N ALA A 80 -7.599 15.240 6.080 1.00 0.00 N ATOM 278 CA ALA A 80 -7.859 13.805 6.276 1.00 0.00 C ATOM 279 C ALA A 80 -9.349 13.440 6.065 1.00 0.00 C ATOM 280 O ALA A 80 -9.686 12.297 5.748 1.00 0.00 O ATOM 281 CB ALA A 80 -7.397 13.374 7.660 1.00 0.00 C ATOM 0 H ALA A 80 -7.119 15.675 6.868 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.289 13.266 5.519 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.594 12.310 7.795 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -6.328 13.561 7.761 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.938 13.942 8.417 1.00 0.00 H new ATOM 287 N ASP A 81 -10.228 14.417 6.222 1.00 0.00 N ATOM 288 CA ASP A 81 -11.665 14.231 5.976 1.00 0.00 C ATOM 289 C ASP A 81 -11.947 14.039 4.473 1.00 0.00 C ATOM 290 O ASP A 81 -12.909 13.392 4.089 1.00 0.00 O ATOM 291 CB ASP A 81 -12.451 15.425 6.531 1.00 0.00 C ATOM 292 CG ASP A 81 -13.904 15.466 6.098 1.00 0.00 C ATOM 293 OD1 ASP A 81 -14.767 14.849 6.765 1.00 0.00 O ATOM 294 OD2 ASP A 81 -14.209 16.154 5.096 1.00 0.00 O ATOM 0 H ASP A 81 -9.976 15.359 6.521 1.00 0.00 H new ATOM 0 HA ASP A 81 -11.991 13.328 6.492 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.408 15.400 7.620 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -11.963 16.347 6.214 1.00 0.00 H new ATOM 299 N SER A 82 -11.066 14.551 3.639 1.00 0.00 N ATOM 300 CA SER A 82 -11.211 14.447 2.202 1.00 0.00 C ATOM 301 C SER A 82 -10.545 13.171 1.660 1.00 0.00 C ATOM 302 O SER A 82 -10.454 12.976 0.446 1.00 0.00 O ATOM 303 CB SER A 82 -10.633 15.697 1.526 1.00 0.00 C ATOM 304 OG SER A 82 -11.332 16.871 1.952 1.00 0.00 O ATOM 0 H SER A 82 -10.229 15.051 3.938 1.00 0.00 H new ATOM 0 HA SER A 82 -12.274 14.380 1.969 1.00 0.00 H new ATOM 0 HB2 SER A 82 -9.574 15.790 1.767 1.00 0.00 H new ATOM 0 HB3 SER A 82 -10.705 15.597 0.443 1.00 0.00 H new ATOM 0 HG SER A 82 -10.948 17.658 1.512 1.00 0.00 H new ATOM 310 N ILE A 83 -10.082 12.313 2.556 1.00 0.00 N ATOM 311 CA ILE A 83 -9.488 11.054 2.154 1.00 0.00 C ATOM 312 C ILE A 83 -10.606 10.028 1.978 1.00 0.00 C ATOM 313 O ILE A 83 -11.308 9.715 2.940 1.00 0.00 O ATOM 314 CB ILE A 83 -8.471 10.524 3.205 1.00 0.00 C ATOM 315 CG1 ILE A 83 -7.451 11.609 3.555 1.00 0.00 C ATOM 316 CG2 ILE A 83 -7.764 9.267 2.701 1.00 0.00 C ATOM 317 CD1 ILE A 83 -6.693 12.175 2.384 1.00 0.00 C ATOM 0 H ILE A 83 -10.107 12.468 3.564 1.00 0.00 H new ATOM 0 HA ILE A 83 -8.945 11.214 1.222 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.023 10.260 4.107 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -7.970 12.424 4.060 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.735 11.197 4.266 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.059 8.919 3.456 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.501 8.488 2.506 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.226 9.496 1.781 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.996 12.936 2.735 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.140 11.377 1.888 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -7.394 12.623 1.679 1.00 0.00 H new ATOM 329 N PRO A 84 -10.812 9.534 0.752 1.00 0.00 N ATOM 330 CA PRO A 84 -11.865 8.564 0.444 1.00 0.00 C ATOM 331 C PRO A 84 -11.789 7.298 1.286 1.00 0.00 C ATOM 332 O PRO A 84 -10.737 6.660 1.409 1.00 0.00 O ATOM 333 CB PRO A 84 -11.626 8.227 -1.023 1.00 0.00 C ATOM 334 CG PRO A 84 -10.935 9.423 -1.556 1.00 0.00 C ATOM 335 CD PRO A 84 -10.050 9.897 -0.445 1.00 0.00 C ATOM 0 HA PRO A 84 -12.850 8.979 0.656 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -11.015 7.331 -1.133 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -12.563 8.040 -1.548 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -10.353 9.178 -2.445 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -11.650 10.194 -1.845 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -9.075 9.409 -0.468 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -9.871 10.971 -0.500 1.00 0.00 H new ATOM 343 N SER A 85 -12.909 6.919 1.815 1.00 0.00 N ATOM 344 CA SER A 85 -13.048 5.754 2.646 1.00 0.00 C ATOM 345 C SER A 85 -13.371 4.512 1.795 1.00 0.00 C ATOM 346 O SER A 85 -14.084 3.603 2.217 1.00 0.00 O ATOM 347 CB SER A 85 -14.142 6.068 3.643 1.00 0.00 C ATOM 348 OG SER A 85 -15.180 6.803 3.004 1.00 0.00 O ATOM 0 H SER A 85 -13.784 7.425 1.679 1.00 0.00 H new ATOM 0 HA SER A 85 -12.121 5.520 3.169 1.00 0.00 H new ATOM 0 HB2 SER A 85 -14.542 5.144 4.061 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.735 6.644 4.474 1.00 0.00 H new ATOM 0 HG SER A 85 -15.887 7.002 3.653 1.00 0.00 H new ATOM 354 N ALA A 86 -12.779 4.468 0.632 1.00 0.00 N ATOM 355 CA ALA A 86 -12.987 3.402 -0.313 1.00 0.00 C ATOM 356 C ALA A 86 -11.795 2.463 -0.292 1.00 0.00 C ATOM 357 O ALA A 86 -10.868 2.643 0.501 1.00 0.00 O ATOM 358 CB ALA A 86 -13.170 3.982 -1.703 1.00 0.00 C ATOM 0 H ALA A 86 -12.128 5.183 0.308 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.883 2.844 -0.041 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -13.327 3.173 -2.417 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -14.035 4.645 -1.710 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.279 4.545 -1.983 1.00 0.00 H new ATOM 364 N SER A 87 -11.817 1.488 -1.147 1.00 0.00 N ATOM 365 CA SER A 87 -10.755 0.542 -1.261 1.00 0.00 C ATOM 366 C SER A 87 -9.955 0.878 -2.511 1.00 0.00 C ATOM 367 O SER A 87 -10.501 1.453 -3.474 1.00 0.00 O ATOM 368 CB SER A 87 -11.357 -0.860 -1.361 1.00 0.00 C ATOM 369 OG SER A 87 -10.379 -1.905 -1.350 1.00 0.00 O ATOM 0 H SER A 87 -12.587 1.326 -1.796 1.00 0.00 H new ATOM 0 HA SER A 87 -10.097 0.578 -0.393 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.047 -1.010 -0.530 1.00 0.00 H new ATOM 0 HB3 SER A 87 -11.942 -0.931 -2.278 1.00 0.00 H new ATOM 0 HG SER A 87 -10.335 -2.321 -2.236 1.00 0.00 H new ATOM 375 N GLY A 88 -8.685 0.576 -2.489 1.00 0.00 N ATOM 376 CA GLY A 88 -7.874 0.823 -3.621 1.00 0.00 C ATOM 377 C GLY A 88 -6.442 0.976 -3.237 1.00 0.00 C ATOM 378 O GLY A 88 -5.979 0.368 -2.254 1.00 0.00 O ATOM 0 H GLY A 88 -8.202 0.159 -1.694 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.977 0.002 -4.331 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.216 1.726 -4.126 1.00 0.00 H new ATOM 382 N VAL A 89 -5.763 1.816 -3.950 1.00 0.00 N ATOM 383 CA VAL A 89 -4.352 2.027 -3.776 1.00 0.00 C ATOM 384 C VAL A 89 -4.100 3.494 -3.437 1.00 0.00 C ATOM 385 O VAL A 89 -4.860 4.370 -3.857 1.00 0.00 O ATOM 386 CB VAL A 89 -3.580 1.592 -5.076 1.00 0.00 C ATOM 387 CG1 VAL A 89 -4.102 2.309 -6.312 1.00 0.00 C ATOM 388 CG2 VAL A 89 -2.066 1.767 -4.943 1.00 0.00 C ATOM 0 H VAL A 89 -6.177 2.389 -4.686 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.982 1.416 -2.952 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.773 0.526 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.542 1.980 -7.187 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.158 2.077 -6.449 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.980 3.385 -6.187 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -1.581 1.453 -5.867 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.836 2.815 -4.751 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.701 1.158 -4.116 1.00 0.00 H new ATOM 398 N TYR A 90 -3.096 3.759 -2.643 1.00 0.00 N ATOM 399 CA TYR A 90 -2.749 5.107 -2.311 1.00 0.00 C ATOM 400 C TYR A 90 -1.235 5.294 -2.347 1.00 0.00 C ATOM 401 O TYR A 90 -0.466 4.338 -2.125 1.00 0.00 O ATOM 402 CB TYR A 90 -3.344 5.541 -0.955 1.00 0.00 C ATOM 403 CG TYR A 90 -2.809 4.810 0.258 1.00 0.00 C ATOM 404 CD1 TYR A 90 -1.668 5.258 0.892 1.00 0.00 C ATOM 405 CD2 TYR A 90 -3.452 3.693 0.779 1.00 0.00 C ATOM 406 CE1 TYR A 90 -1.171 4.627 1.996 1.00 0.00 C ATOM 407 CE2 TYR A 90 -2.957 3.056 1.902 1.00 0.00 C ATOM 408 CZ TYR A 90 -1.812 3.535 2.501 1.00 0.00 C ATOM 409 OH TYR A 90 -1.307 2.930 3.625 1.00 0.00 O ATOM 0 H TYR A 90 -2.503 3.049 -2.213 1.00 0.00 H new ATOM 0 HA TYR A 90 -3.190 5.759 -3.065 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.162 6.608 -0.824 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -4.425 5.404 -0.992 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.157 6.127 0.506 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -4.346 3.319 0.302 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.271 4.992 2.469 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.463 2.191 2.306 1.00 0.00 H new ATOM 0 HH TYR A 90 -0.906 3.607 4.209 1.00 0.00 H new ATOM 419 N ALA A 91 -0.827 6.494 -2.628 1.00 0.00 N ATOM 420 CA ALA A 91 0.555 6.871 -2.720 1.00 0.00 C ATOM 421 C ALA A 91 0.816 8.010 -1.756 1.00 0.00 C ATOM 422 O ALA A 91 0.147 9.040 -1.820 1.00 0.00 O ATOM 423 CB ALA A 91 0.851 7.311 -4.135 1.00 0.00 C ATOM 0 H ALA A 91 -1.468 7.267 -2.806 1.00 0.00 H new ATOM 0 HA ALA A 91 1.197 6.028 -2.465 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.899 7.599 -4.215 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.648 6.489 -4.822 1.00 0.00 H new ATOM 0 HB3 ALA A 91 0.220 8.162 -4.391 1.00 0.00 H new ATOM 429 N VAL A 92 1.770 7.832 -0.878 1.00 0.00 N ATOM 430 CA VAL A 92 2.057 8.818 0.141 1.00 0.00 C ATOM 431 C VAL A 92 3.288 9.653 -0.238 1.00 0.00 C ATOM 432 O VAL A 92 4.388 9.103 -0.523 1.00 0.00 O ATOM 433 CB VAL A 92 2.301 8.159 1.522 1.00 0.00 C ATOM 434 CG1 VAL A 92 2.324 9.203 2.613 1.00 0.00 C ATOM 435 CG2 VAL A 92 1.253 7.112 1.828 1.00 0.00 C ATOM 0 H VAL A 92 2.368 7.006 -0.846 1.00 0.00 H new ATOM 0 HA VAL A 92 1.182 9.465 0.210 1.00 0.00 H new ATOM 0 HB VAL A 92 3.272 7.665 1.483 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.497 8.720 3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.124 9.917 2.417 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.368 9.726 2.636 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.454 6.670 2.804 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.267 7.576 1.836 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.282 6.334 1.065 1.00 0.00 H new ATOM 445 N TYR A 93 3.090 10.949 -0.254 1.00 0.00 N ATOM 446 CA TYR A 93 4.103 11.931 -0.542 1.00 0.00 C ATOM 447 C TYR A 93 4.387 12.698 0.752 1.00 0.00 C ATOM 448 O TYR A 93 3.455 13.122 1.437 1.00 0.00 O ATOM 449 CB TYR A 93 3.599 12.919 -1.613 1.00 0.00 C ATOM 450 CG TYR A 93 3.361 12.357 -3.016 1.00 0.00 C ATOM 451 CD1 TYR A 93 2.363 11.427 -3.280 1.00 0.00 C ATOM 452 CD2 TYR A 93 4.123 12.804 -4.081 1.00 0.00 C ATOM 453 CE1 TYR A 93 2.146 10.963 -4.566 1.00 0.00 C ATOM 454 CE2 TYR A 93 3.920 12.346 -5.360 1.00 0.00 C ATOM 455 CZ TYR A 93 2.934 11.429 -5.602 1.00 0.00 C ATOM 456 OH TYR A 93 2.717 10.990 -6.892 1.00 0.00 O ATOM 0 H TYR A 93 2.179 11.364 -0.058 1.00 0.00 H new ATOM 0 HA TYR A 93 5.002 11.441 -0.915 1.00 0.00 H new ATOM 0 HB2 TYR A 93 2.665 13.355 -1.259 1.00 0.00 H new ATOM 0 HB3 TYR A 93 4.321 13.732 -1.691 1.00 0.00 H new ATOM 0 HD1 TYR A 93 1.748 11.061 -2.471 1.00 0.00 H new ATOM 0 HD2 TYR A 93 4.899 13.533 -3.902 1.00 0.00 H new ATOM 0 HE1 TYR A 93 1.366 10.241 -4.759 1.00 0.00 H new ATOM 0 HE2 TYR A 93 4.536 12.708 -6.170 1.00 0.00 H new ATOM 0 HH TYR A 93 3.359 11.419 -7.496 1.00 0.00 H new ATOM 466 N ASP A 94 5.646 12.882 1.087 1.00 0.00 N ATOM 467 CA ASP A 94 6.014 13.561 2.349 1.00 0.00 C ATOM 468 C ASP A 94 5.879 15.093 2.212 1.00 0.00 C ATOM 469 O ASP A 94 5.294 15.594 1.250 1.00 0.00 O ATOM 470 CB ASP A 94 7.460 13.205 2.763 1.00 0.00 C ATOM 471 CG ASP A 94 8.517 13.947 1.967 1.00 0.00 C ATOM 472 OD1 ASP A 94 8.718 13.647 0.792 1.00 0.00 O ATOM 473 OD2 ASP A 94 9.141 14.885 2.520 1.00 0.00 O ATOM 0 H ASP A 94 6.439 12.580 0.521 1.00 0.00 H new ATOM 0 HA ASP A 94 5.327 13.214 3.121 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.591 13.427 3.822 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.611 12.132 2.641 1.00 0.00 H new ATOM 478 N LYS A 95 6.428 15.831 3.182 1.00 0.00 N ATOM 479 CA LYS A 95 6.432 17.306 3.189 1.00 0.00 C ATOM 480 C LYS A 95 7.116 17.864 1.927 1.00 0.00 C ATOM 481 O LYS A 95 6.801 18.951 1.474 1.00 0.00 O ATOM 482 CB LYS A 95 7.164 17.833 4.442 1.00 0.00 C ATOM 483 CG LYS A 95 6.540 17.417 5.779 1.00 0.00 C ATOM 484 CD LYS A 95 5.158 18.042 6.005 1.00 0.00 C ATOM 485 CE LYS A 95 5.236 19.525 6.298 1.00 0.00 C ATOM 486 NZ LYS A 95 3.896 20.147 6.401 1.00 0.00 N ATOM 0 H LYS A 95 6.888 15.421 3.995 1.00 0.00 H new ATOM 0 HA LYS A 95 5.395 17.642 3.203 1.00 0.00 H new ATOM 0 HB2 LYS A 95 8.196 17.483 4.415 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.195 18.922 4.396 1.00 0.00 H new ATOM 0 HG2 LYS A 95 6.453 16.331 5.813 1.00 0.00 H new ATOM 0 HG3 LYS A 95 7.204 17.709 6.592 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.541 17.881 5.121 1.00 0.00 H new ATOM 0 HD3 LYS A 95 4.665 17.536 6.835 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.780 19.681 7.230 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.805 20.020 5.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 3.999 21.162 6.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 3.385 20.022 5.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.361 19.694 7.170 1.00 0.00 H new ATOM 500 N SER A 96 8.032 17.100 1.366 1.00 0.00 N ATOM 501 CA SER A 96 8.742 17.501 0.163 1.00 0.00 C ATOM 502 C SER A 96 7.939 17.111 -1.088 1.00 0.00 C ATOM 503 O SER A 96 8.359 17.380 -2.223 1.00 0.00 O ATOM 504 CB SER A 96 10.093 16.807 0.142 1.00 0.00 C ATOM 505 OG SER A 96 10.694 16.855 1.439 1.00 0.00 O ATOM 0 H SER A 96 8.306 16.187 1.728 1.00 0.00 H new ATOM 0 HA SER A 96 8.875 18.583 0.163 1.00 0.00 H new ATOM 0 HB2 SER A 96 9.972 15.770 -0.173 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.745 17.288 -0.587 1.00 0.00 H new ATOM 0 HG SER A 96 10.287 16.173 2.013 1.00 0.00 H new ATOM 511 N ASP A 97 6.794 16.466 -0.855 1.00 0.00 N ATOM 512 CA ASP A 97 5.886 15.970 -1.893 1.00 0.00 C ATOM 513 C ASP A 97 6.594 14.888 -2.702 1.00 0.00 C ATOM 514 O ASP A 97 6.415 14.745 -3.899 1.00 0.00 O ATOM 515 CB ASP A 97 5.359 17.123 -2.782 1.00 0.00 C ATOM 516 CG ASP A 97 4.232 16.719 -3.728 1.00 0.00 C ATOM 517 OD1 ASP A 97 3.097 16.481 -3.259 1.00 0.00 O ATOM 518 OD2 ASP A 97 4.446 16.702 -4.969 1.00 0.00 O ATOM 0 H ASP A 97 6.463 16.268 0.089 1.00 0.00 H new ATOM 0 HA ASP A 97 5.007 15.528 -1.424 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.007 17.930 -2.140 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.186 17.521 -3.370 1.00 0.00 H new ATOM 523 N GLU A 98 7.421 14.128 -2.028 1.00 0.00 N ATOM 524 CA GLU A 98 8.084 13.021 -2.641 1.00 0.00 C ATOM 525 C GLU A 98 7.400 11.741 -2.294 1.00 0.00 C ATOM 526 O GLU A 98 7.161 11.448 -1.117 1.00 0.00 O ATOM 527 CB GLU A 98 9.557 12.960 -2.269 1.00 0.00 C ATOM 528 CG GLU A 98 10.448 13.778 -3.172 1.00 0.00 C ATOM 529 CD GLU A 98 10.407 13.254 -4.593 1.00 0.00 C ATOM 530 OE1 GLU A 98 10.876 12.118 -4.835 1.00 0.00 O ATOM 531 OE2 GLU A 98 9.901 13.953 -5.491 1.00 0.00 O ATOM 0 H GLU A 98 7.648 14.264 -1.043 1.00 0.00 H new ATOM 0 HA GLU A 98 8.029 13.167 -3.720 1.00 0.00 H new ATOM 0 HB2 GLU A 98 9.678 13.308 -1.243 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.886 11.921 -2.294 1.00 0.00 H new ATOM 0 HG2 GLU A 98 10.130 14.820 -3.156 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.472 13.751 -2.800 1.00 0.00 H new ATOM 538 N LEU A 99 7.027 11.013 -3.321 1.00 0.00 N ATOM 539 CA LEU A 99 6.424 9.720 -3.164 1.00 0.00 C ATOM 540 C LEU A 99 7.458 8.788 -2.591 1.00 0.00 C ATOM 541 O LEU A 99 8.511 8.564 -3.194 1.00 0.00 O ATOM 542 CB LEU A 99 5.851 9.225 -4.522 1.00 0.00 C ATOM 543 CG LEU A 99 5.150 7.839 -4.592 1.00 0.00 C ATOM 544 CD1 LEU A 99 6.142 6.676 -4.609 1.00 0.00 C ATOM 545 CD2 LEU A 99 4.207 7.684 -3.430 1.00 0.00 C ATOM 0 H LEU A 99 7.136 11.307 -4.292 1.00 0.00 H new ATOM 0 HA LEU A 99 5.580 9.762 -2.476 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.136 9.972 -4.868 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.672 9.214 -5.239 1.00 0.00 H new ATOM 0 HG LEU A 99 4.599 7.807 -5.532 1.00 0.00 H new ATOM 0 HD11 LEU A 99 5.597 5.733 -4.658 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.792 6.765 -5.479 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.745 6.699 -3.701 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.719 6.711 -3.485 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.765 7.758 -2.496 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.453 8.470 -3.466 1.00 0.00 H new ATOM 557 N GLN A 100 7.167 8.296 -1.435 1.00 0.00 N ATOM 558 CA GLN A 100 8.067 7.431 -0.723 1.00 0.00 C ATOM 559 C GLN A 100 7.408 6.132 -0.294 1.00 0.00 C ATOM 560 O GLN A 100 8.093 5.185 0.102 1.00 0.00 O ATOM 561 CB GLN A 100 8.703 8.151 0.471 1.00 0.00 C ATOM 562 CG GLN A 100 9.763 9.183 0.088 1.00 0.00 C ATOM 563 CD GLN A 100 10.403 9.832 1.297 1.00 0.00 C ATOM 564 OE1 GLN A 100 11.399 9.331 1.838 1.00 0.00 O ATOM 565 NE2 GLN A 100 9.895 10.960 1.698 1.00 0.00 N ATOM 0 H GLN A 100 6.291 8.480 -0.946 1.00 0.00 H new ATOM 0 HA GLN A 100 8.861 7.165 -1.420 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.918 8.647 1.042 1.00 0.00 H new ATOM 0 HB3 GLN A 100 9.155 7.409 1.129 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.534 8.701 -0.513 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.308 9.953 -0.535 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.074 11.345 1.230 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.317 11.460 2.480 1.00 0.00 H new ATOM 574 N PHE A 101 6.090 6.079 -0.343 1.00 0.00 N ATOM 575 CA PHE A 101 5.402 4.861 0.017 1.00 0.00 C ATOM 576 C PHE A 101 4.138 4.685 -0.790 1.00 0.00 C ATOM 577 O PHE A 101 3.356 5.617 -0.946 1.00 0.00 O ATOM 578 CB PHE A 101 5.074 4.827 1.521 1.00 0.00 C ATOM 579 CG PHE A 101 4.374 3.569 1.955 1.00 0.00 C ATOM 580 CD1 PHE A 101 5.075 2.388 2.070 1.00 0.00 C ATOM 581 CD2 PHE A 101 3.016 3.569 2.239 1.00 0.00 C ATOM 582 CE1 PHE A 101 4.446 1.227 2.452 1.00 0.00 C ATOM 583 CE2 PHE A 101 2.382 2.410 2.625 1.00 0.00 C ATOM 584 CZ PHE A 101 3.101 1.237 2.729 1.00 0.00 C ATOM 0 H PHE A 101 5.486 6.852 -0.624 1.00 0.00 H new ATOM 0 HA PHE A 101 6.075 4.034 -0.210 1.00 0.00 H new ATOM 0 HB2 PHE A 101 5.998 4.933 2.089 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.448 5.685 1.768 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.134 2.375 1.857 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.452 4.486 2.156 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.008 0.309 2.534 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.325 2.419 2.846 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.605 0.325 3.029 1.00 0.00 H new ATOM 594 N VAL A 102 3.951 3.496 -1.296 1.00 0.00 N ATOM 595 CA VAL A 102 2.742 3.125 -2.004 1.00 0.00 C ATOM 596 C VAL A 102 2.133 1.902 -1.343 1.00 0.00 C ATOM 597 O VAL A 102 2.859 0.973 -0.953 1.00 0.00 O ATOM 598 CB VAL A 102 2.980 2.859 -3.522 1.00 0.00 C ATOM 599 CG1 VAL A 102 3.303 4.140 -4.227 1.00 0.00 C ATOM 600 CG2 VAL A 102 4.117 1.883 -3.738 1.00 0.00 C ATOM 0 H VAL A 102 4.638 2.745 -1.231 1.00 0.00 H new ATOM 0 HA VAL A 102 2.055 3.970 -1.946 1.00 0.00 H new ATOM 0 HB VAL A 102 2.064 2.430 -3.927 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.467 3.941 -5.286 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.473 4.837 -4.113 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.204 4.575 -3.796 1.00 0.00 H new ATOM 0 HG21 VAL A 102 4.257 1.719 -4.806 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.033 2.291 -3.310 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.880 0.936 -3.253 1.00 0.00 H new ATOM 610 N GLY A 103 0.837 1.893 -1.194 1.00 0.00 N ATOM 611 CA GLY A 103 0.200 0.782 -0.533 1.00 0.00 C ATOM 612 C GLY A 103 -1.243 0.617 -0.927 1.00 0.00 C ATOM 613 O GLY A 103 -1.876 1.564 -1.394 1.00 0.00 O ATOM 0 H GLY A 103 0.207 2.629 -1.515 1.00 0.00 H new ATOM 0 HA2 GLY A 103 0.743 -0.134 -0.767 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.263 0.923 0.546 1.00 0.00 H new ATOM 617 N ILE A 104 -1.748 -0.579 -0.752 1.00 0.00 N ATOM 618 CA ILE A 104 -3.132 -0.907 -1.046 1.00 0.00 C ATOM 619 C ILE A 104 -3.877 -1.227 0.249 1.00 0.00 C ATOM 620 O ILE A 104 -3.281 -1.761 1.202 1.00 0.00 O ATOM 621 CB ILE A 104 -3.247 -2.082 -2.073 1.00 0.00 C ATOM 622 CG1 ILE A 104 -2.352 -3.276 -1.664 1.00 0.00 C ATOM 623 CG2 ILE A 104 -2.910 -1.597 -3.475 1.00 0.00 C ATOM 624 CD1 ILE A 104 -2.344 -4.435 -2.652 1.00 0.00 C ATOM 0 H ILE A 104 -1.207 -1.367 -0.397 1.00 0.00 H new ATOM 0 HA ILE A 104 -3.596 -0.038 -1.512 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.279 -2.434 -2.072 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.330 -2.919 -1.536 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.684 -3.646 -0.694 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.995 -2.426 -4.177 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.602 -0.806 -3.763 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.891 -1.211 -3.491 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -1.690 -5.224 -2.282 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.356 -4.825 -2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.980 -4.087 -3.619 1.00 0.00 H new ATOM 636 N SER A 105 -5.137 -0.843 0.326 1.00 0.00 N ATOM 637 CA SER A 105 -5.942 -1.067 1.520 1.00 0.00 C ATOM 638 C SER A 105 -7.425 -1.229 1.151 1.00 0.00 C ATOM 639 O SER A 105 -7.853 -0.827 0.046 1.00 0.00 O ATOM 640 CB SER A 105 -5.760 0.103 2.514 1.00 0.00 C ATOM 641 OG SER A 105 -4.390 0.237 2.908 1.00 0.00 O ATOM 0 H SER A 105 -5.632 -0.370 -0.430 1.00 0.00 H new ATOM 0 HA SER A 105 -5.605 -1.988 1.996 1.00 0.00 H new ATOM 0 HB2 SER A 105 -6.102 1.031 2.055 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.380 -0.064 3.395 1.00 0.00 H new ATOM 0 HG SER A 105 -4.334 0.795 3.712 1.00 0.00 H new ATOM 647 N ARG A 106 -8.204 -1.814 2.060 1.00 0.00 N ATOM 648 CA ARG A 106 -9.626 -2.005 1.825 1.00 0.00 C ATOM 649 C ARG A 106 -10.381 -0.737 2.241 1.00 0.00 C ATOM 650 O ARG A 106 -11.474 -0.466 1.766 1.00 0.00 O ATOM 651 CB ARG A 106 -10.153 -3.249 2.571 1.00 0.00 C ATOM 652 CG ARG A 106 -11.575 -3.667 2.186 1.00 0.00 C ATOM 653 CD ARG A 106 -11.665 -4.049 0.707 1.00 0.00 C ATOM 654 NE ARG A 106 -13.022 -4.450 0.306 1.00 0.00 N ATOM 655 CZ ARG A 106 -13.564 -4.225 -0.908 1.00 0.00 C ATOM 656 NH1 ARG A 106 -12.867 -3.582 -1.849 1.00 0.00 N ATOM 657 NH2 ARG A 106 -14.798 -4.644 -1.177 1.00 0.00 N ATOM 0 H ARG A 106 -7.872 -2.161 2.960 1.00 0.00 H new ATOM 0 HA ARG A 106 -9.793 -2.182 0.762 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.479 -4.084 2.380 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -10.123 -3.054 3.643 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -11.886 -4.512 2.801 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -12.265 -2.849 2.395 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -11.345 -3.204 0.098 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -10.974 -4.867 0.505 1.00 0.00 H new ATOM 0 HE ARG A 106 -13.595 -4.934 0.997 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -11.920 -3.259 -1.651 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -13.282 -3.414 -2.766 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -15.336 -5.137 -0.464 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -15.206 -4.473 -2.096 1.00 0.00 H new ATOM 671 N ASN A 107 -9.785 0.022 3.133 1.00 0.00 N ATOM 672 CA ASN A 107 -10.317 1.316 3.513 1.00 0.00 C ATOM 673 C ASN A 107 -9.167 2.294 3.545 1.00 0.00 C ATOM 674 O ASN A 107 -8.347 2.268 4.466 1.00 0.00 O ATOM 675 CB ASN A 107 -10.999 1.285 4.882 1.00 0.00 C ATOM 676 CG ASN A 107 -11.729 2.588 5.191 1.00 0.00 C ATOM 677 OD1 ASN A 107 -11.141 3.556 5.663 1.00 0.00 O ATOM 678 ND2 ASN A 107 -13.011 2.613 4.953 1.00 0.00 N ATOM 0 H ASN A 107 -8.923 -0.236 3.614 1.00 0.00 H new ATOM 0 HA ASN A 107 -11.075 1.610 2.787 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.707 0.457 4.915 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.253 1.097 5.654 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -13.552 3.453 5.160 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -13.473 1.793 4.560 1.00 0.00 H new ATOM 685 N ILE A 108 -9.066 3.097 2.509 1.00 0.00 N ATOM 686 CA ILE A 108 -7.983 4.053 2.359 1.00 0.00 C ATOM 687 C ILE A 108 -7.946 5.067 3.510 1.00 0.00 C ATOM 688 O ILE A 108 -6.904 5.247 4.133 1.00 0.00 O ATOM 689 CB ILE A 108 -8.055 4.784 0.981 1.00 0.00 C ATOM 690 CG1 ILE A 108 -7.943 3.767 -0.173 1.00 0.00 C ATOM 691 CG2 ILE A 108 -6.956 5.840 0.868 1.00 0.00 C ATOM 692 CD1 ILE A 108 -8.070 4.376 -1.559 1.00 0.00 C ATOM 0 H ILE A 108 -9.736 3.108 1.740 1.00 0.00 H new ATOM 0 HA ILE A 108 -7.054 3.484 2.394 1.00 0.00 H new ATOM 0 HB ILE A 108 -9.020 5.287 0.912 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -6.983 3.257 -0.100 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -8.717 3.009 -0.050 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.026 6.336 -0.100 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -7.076 6.576 1.663 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -5.981 5.362 0.961 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.980 3.592 -2.311 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.041 4.861 -1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.280 5.113 -1.706 1.00 0.00 H new ATOM 704 N ALA A 109 -9.090 5.680 3.801 1.00 0.00 N ATOM 705 CA ALA A 109 -9.208 6.714 4.843 1.00 0.00 C ATOM 706 C ALA A 109 -8.648 6.276 6.187 1.00 0.00 C ATOM 707 O ALA A 109 -7.741 6.929 6.715 1.00 0.00 O ATOM 708 CB ALA A 109 -10.650 7.158 4.994 1.00 0.00 C ATOM 0 H ALA A 109 -9.968 5.478 3.323 1.00 0.00 H new ATOM 0 HA ALA A 109 -8.601 7.556 4.510 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -10.716 7.922 5.769 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -11.005 7.568 4.049 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -11.266 6.304 5.274 1.00 0.00 H new ATOM 714 N ALA A 110 -9.164 5.178 6.723 1.00 0.00 N ATOM 715 CA ALA A 110 -8.740 4.678 8.019 1.00 0.00 C ATOM 716 C ALA A 110 -7.271 4.338 8.014 1.00 0.00 C ATOM 717 O ALA A 110 -6.546 4.719 8.929 1.00 0.00 O ATOM 718 CB ALA A 110 -9.557 3.467 8.427 1.00 0.00 C ATOM 0 H ALA A 110 -9.884 4.613 6.273 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.907 5.470 8.749 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -9.220 3.112 9.401 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.610 3.742 8.486 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.429 2.676 7.688 1.00 0.00 H new ATOM 724 N SER A 111 -6.836 3.665 6.958 1.00 0.00 N ATOM 725 CA SER A 111 -5.460 3.263 6.808 1.00 0.00 C ATOM 726 C SER A 111 -4.549 4.495 6.836 1.00 0.00 C ATOM 727 O SER A 111 -3.732 4.657 7.771 1.00 0.00 O ATOM 728 CB SER A 111 -5.296 2.471 5.491 1.00 0.00 C ATOM 729 OG SER A 111 -3.975 1.983 5.298 1.00 0.00 O ATOM 0 H SER A 111 -7.437 3.385 6.182 1.00 0.00 H new ATOM 0 HA SER A 111 -5.172 2.616 7.636 1.00 0.00 H new ATOM 0 HB2 SER A 111 -5.992 1.632 5.489 1.00 0.00 H new ATOM 0 HB3 SER A 111 -5.567 3.112 4.652 1.00 0.00 H new ATOM 0 HG SER A 111 -3.486 2.589 4.703 1.00 0.00 H new ATOM 735 N VAL A 112 -4.753 5.395 5.869 1.00 0.00 N ATOM 736 CA VAL A 112 -3.944 6.594 5.705 1.00 0.00 C ATOM 737 C VAL A 112 -3.902 7.421 6.984 1.00 0.00 C ATOM 738 O VAL A 112 -2.808 7.687 7.514 1.00 0.00 O ATOM 739 CB VAL A 112 -4.440 7.459 4.500 1.00 0.00 C ATOM 740 CG1 VAL A 112 -3.698 8.780 4.410 1.00 0.00 C ATOM 741 CG2 VAL A 112 -4.264 6.697 3.201 1.00 0.00 C ATOM 0 H VAL A 112 -5.494 5.305 5.174 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.927 6.267 5.487 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.496 7.671 4.667 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.072 9.350 3.560 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.855 9.349 5.326 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.633 8.591 4.279 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.613 7.310 2.370 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.210 6.459 3.059 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.843 5.774 3.239 1.00 0.00 H new ATOM 751 N SER A 113 -5.073 7.747 7.508 1.00 0.00 N ATOM 752 CA SER A 113 -5.195 8.578 8.692 1.00 0.00 C ATOM 753 C SER A 113 -4.477 7.942 9.903 1.00 0.00 C ATOM 754 O SER A 113 -3.682 8.612 10.585 1.00 0.00 O ATOM 755 CB SER A 113 -6.687 8.845 8.992 1.00 0.00 C ATOM 756 OG SER A 113 -6.873 9.737 10.080 1.00 0.00 O ATOM 0 H SER A 113 -5.966 7.441 7.122 1.00 0.00 H new ATOM 0 HA SER A 113 -4.705 9.533 8.501 1.00 0.00 H new ATOM 0 HB2 SER A 113 -7.165 9.257 8.103 1.00 0.00 H new ATOM 0 HB3 SER A 113 -7.184 7.900 9.212 1.00 0.00 H new ATOM 0 HG SER A 113 -7.832 9.875 10.229 1.00 0.00 H new ATOM 762 N ALA A 114 -4.683 6.638 10.113 1.00 0.00 N ATOM 763 CA ALA A 114 -4.112 5.959 11.269 1.00 0.00 C ATOM 764 C ALA A 114 -2.593 5.969 11.238 1.00 0.00 C ATOM 765 O ALA A 114 -1.944 6.341 12.226 1.00 0.00 O ATOM 766 CB ALA A 114 -4.630 4.531 11.385 1.00 0.00 C ATOM 0 H ALA A 114 -5.237 6.040 9.500 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.432 6.514 12.150 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.185 4.052 12.257 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.715 4.545 11.493 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.362 3.973 10.488 1.00 0.00 H new ATOM 772 N HIS A 115 -2.008 5.613 10.105 1.00 0.00 N ATOM 773 CA HIS A 115 -0.552 5.528 10.055 1.00 0.00 C ATOM 774 C HIS A 115 0.133 6.882 10.006 1.00 0.00 C ATOM 775 O HIS A 115 1.246 7.015 10.480 1.00 0.00 O ATOM 776 CB HIS A 115 0.011 4.569 8.982 1.00 0.00 C ATOM 777 CG HIS A 115 -0.252 4.909 7.536 1.00 0.00 C ATOM 778 ND1 HIS A 115 0.482 5.835 6.820 1.00 0.00 N ATOM 779 CD2 HIS A 115 -1.116 4.375 6.661 1.00 0.00 C ATOM 780 CE1 HIS A 115 0.066 5.835 5.567 1.00 0.00 C ATOM 781 NE2 HIS A 115 -0.902 4.956 5.449 1.00 0.00 N ATOM 0 H HIS A 115 -2.494 5.386 9.237 1.00 0.00 H new ATOM 0 HA HIS A 115 -0.300 5.072 11.013 1.00 0.00 H new ATOM 0 HB2 HIS A 115 1.090 4.505 9.121 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -0.395 3.575 9.173 1.00 0.00 H new ATOM 0 HD1 HIS A 115 1.225 6.423 7.198 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -1.853 3.616 6.880 1.00 0.00 H new ATOM 0 HE1 HIS A 115 0.456 6.454 4.773 1.00 0.00 H new ATOM 790 N LEU A 116 -0.526 7.887 9.466 1.00 0.00 N ATOM 791 CA LEU A 116 0.086 9.213 9.393 1.00 0.00 C ATOM 792 C LEU A 116 0.129 9.894 10.748 1.00 0.00 C ATOM 793 O LEU A 116 0.982 10.733 10.998 1.00 0.00 O ATOM 794 CB LEU A 116 -0.595 10.099 8.364 1.00 0.00 C ATOM 795 CG LEU A 116 -0.427 9.688 6.898 1.00 0.00 C ATOM 796 CD1 LEU A 116 -1.202 10.626 6.018 1.00 0.00 C ATOM 797 CD2 LEU A 116 1.044 9.690 6.489 1.00 0.00 C ATOM 0 H LEU A 116 -1.466 7.822 9.076 1.00 0.00 H new ATOM 0 HA LEU A 116 1.115 9.059 9.067 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.661 10.130 8.591 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.215 11.114 8.481 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.810 8.674 6.781 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -1.080 10.331 4.976 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.258 10.587 6.285 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.831 11.642 6.153 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.131 9.394 5.444 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.456 10.691 6.619 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.596 8.987 7.112 1.00 0.00 H new ATOM 809 N LYS A 117 -0.785 9.530 11.621 1.00 0.00 N ATOM 810 CA LYS A 117 -0.775 10.081 12.962 1.00 0.00 C ATOM 811 C LYS A 117 0.140 9.268 13.864 1.00 0.00 C ATOM 812 O LYS A 117 0.567 9.729 14.927 1.00 0.00 O ATOM 813 CB LYS A 117 -2.191 10.181 13.534 1.00 0.00 C ATOM 814 CG LYS A 117 -3.107 11.107 12.738 1.00 0.00 C ATOM 815 CD LYS A 117 -2.533 12.516 12.659 1.00 0.00 C ATOM 816 CE LYS A 117 -3.444 13.453 11.889 1.00 0.00 C ATOM 817 NZ LYS A 117 -2.868 14.810 11.795 1.00 0.00 N ATOM 0 H LYS A 117 -1.535 8.865 11.433 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.380 11.096 12.912 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.633 9.185 13.565 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -2.134 10.536 14.563 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.244 10.710 11.732 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -4.091 11.138 13.205 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.381 12.903 13.666 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.555 12.484 12.179 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -3.612 13.057 10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.416 13.502 12.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.515 15.426 11.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.731 15.196 12.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.952 14.765 11.305 1.00 0.00 H new ATOM 831 N SER A 118 0.452 8.066 13.427 1.00 0.00 N ATOM 832 CA SER A 118 1.353 7.206 14.157 1.00 0.00 C ATOM 833 C SER A 118 2.794 7.572 13.800 1.00 0.00 C ATOM 834 O SER A 118 3.676 7.615 14.659 1.00 0.00 O ATOM 835 CB SER A 118 1.066 5.734 13.829 1.00 0.00 C ATOM 836 OG SER A 118 -0.290 5.394 14.125 1.00 0.00 O ATOM 0 H SER A 118 0.091 7.662 12.563 1.00 0.00 H new ATOM 0 HA SER A 118 1.205 7.345 15.228 1.00 0.00 H new ATOM 0 HB2 SER A 118 1.269 5.547 12.774 1.00 0.00 H new ATOM 0 HB3 SER A 118 1.738 5.094 14.401 1.00 0.00 H new ATOM 0 HG SER A 118 -0.848 5.560 13.337 1.00 0.00 H new ATOM 842 N VAL A 119 3.018 7.850 12.533 1.00 0.00 N ATOM 843 CA VAL A 119 4.315 8.243 12.049 1.00 0.00 C ATOM 844 C VAL A 119 4.180 9.322 10.940 1.00 0.00 C ATOM 845 O VAL A 119 3.923 9.021 9.768 1.00 0.00 O ATOM 846 CB VAL A 119 5.178 7.006 11.601 1.00 0.00 C ATOM 847 CG1 VAL A 119 4.467 6.135 10.568 1.00 0.00 C ATOM 848 CG2 VAL A 119 6.548 7.441 11.101 1.00 0.00 C ATOM 0 H VAL A 119 2.299 7.808 11.810 1.00 0.00 H new ATOM 0 HA VAL A 119 4.863 8.697 12.874 1.00 0.00 H new ATOM 0 HB VAL A 119 5.318 6.388 12.488 1.00 0.00 H new ATOM 0 HG11 VAL A 119 5.108 5.297 10.295 1.00 0.00 H new ATOM 0 HG12 VAL A 119 3.536 5.757 10.990 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.248 6.728 9.680 1.00 0.00 H new ATOM 0 HG21 VAL A 119 7.120 6.564 10.799 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.429 8.108 10.247 1.00 0.00 H new ATOM 0 HG23 VAL A 119 7.077 7.963 11.898 1.00 0.00 H new ATOM 858 N PRO A 120 4.322 10.613 11.317 1.00 0.00 N ATOM 859 CA PRO A 120 4.176 11.762 10.392 1.00 0.00 C ATOM 860 C PRO A 120 5.354 11.944 9.417 1.00 0.00 C ATOM 861 O PRO A 120 5.455 12.976 8.746 1.00 0.00 O ATOM 862 CB PRO A 120 4.091 12.983 11.330 1.00 0.00 C ATOM 863 CG PRO A 120 3.944 12.428 12.705 1.00 0.00 C ATOM 864 CD PRO A 120 4.584 11.074 12.683 1.00 0.00 C ATOM 0 HA PRO A 120 3.308 11.617 9.749 1.00 0.00 H new ATOM 0 HB2 PRO A 120 4.986 13.600 11.251 1.00 0.00 H new ATOM 0 HB3 PRO A 120 3.243 13.617 11.071 1.00 0.00 H new ATOM 0 HG2 PRO A 120 4.426 13.074 13.439 1.00 0.00 H new ATOM 0 HG3 PRO A 120 2.893 12.357 12.985 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.652 11.128 12.894 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.146 10.407 13.426 1.00 0.00 H new ATOM 872 N GLU A 121 6.204 10.932 9.311 1.00 0.00 N ATOM 873 CA GLU A 121 7.392 10.961 8.451 1.00 0.00 C ATOM 874 C GLU A 121 7.014 11.283 6.999 1.00 0.00 C ATOM 875 O GLU A 121 7.689 12.055 6.316 1.00 0.00 O ATOM 876 CB GLU A 121 8.100 9.599 8.511 1.00 0.00 C ATOM 877 CG GLU A 121 9.391 9.516 7.707 1.00 0.00 C ATOM 878 CD GLU A 121 10.467 10.433 8.232 1.00 0.00 C ATOM 879 OE1 GLU A 121 10.540 11.611 7.804 1.00 0.00 O ATOM 880 OE2 GLU A 121 11.265 10.000 9.075 1.00 0.00 O ATOM 0 H GLU A 121 6.092 10.056 9.822 1.00 0.00 H new ATOM 0 HA GLU A 121 8.060 11.743 8.811 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.321 9.365 9.552 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.414 8.832 8.151 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.757 8.489 7.721 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.182 9.766 6.667 1.00 0.00 H new ATOM 887 N LEU A 122 5.916 10.727 6.558 1.00 0.00 N ATOM 888 CA LEU A 122 5.487 10.909 5.193 1.00 0.00 C ATOM 889 C LEU A 122 4.253 11.788 5.097 1.00 0.00 C ATOM 890 O LEU A 122 3.533 11.753 4.115 1.00 0.00 O ATOM 891 CB LEU A 122 5.267 9.564 4.506 1.00 0.00 C ATOM 892 CG LEU A 122 6.490 8.644 4.406 1.00 0.00 C ATOM 893 CD1 LEU A 122 6.161 7.410 3.596 1.00 0.00 C ATOM 894 CD2 LEU A 122 7.680 9.373 3.805 1.00 0.00 C ATOM 0 H LEU A 122 5.300 10.143 7.124 1.00 0.00 H new ATOM 0 HA LEU A 122 6.288 11.429 4.667 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.481 9.031 5.041 1.00 0.00 H new ATOM 0 HB3 LEU A 122 4.896 9.751 3.498 1.00 0.00 H new ATOM 0 HG LEU A 122 6.760 8.336 5.416 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.041 6.769 3.536 1.00 0.00 H new ATOM 0 HD12 LEU A 122 5.348 6.866 4.076 1.00 0.00 H new ATOM 0 HD13 LEU A 122 5.857 7.704 2.591 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.531 8.694 3.747 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.425 9.722 2.804 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.938 10.226 4.432 1.00 0.00 H new ATOM 906 N CYS A 123 4.007 12.572 6.115 1.00 0.00 N ATOM 907 CA CYS A 123 2.926 13.516 6.059 1.00 0.00 C ATOM 908 C CYS A 123 3.259 14.635 5.100 1.00 0.00 C ATOM 909 O CYS A 123 4.269 15.282 5.241 1.00 0.00 O ATOM 910 CB CYS A 123 2.607 14.089 7.440 1.00 0.00 C ATOM 911 SG CYS A 123 1.766 12.936 8.538 1.00 0.00 S ATOM 0 H CYS A 123 4.538 12.575 6.986 1.00 0.00 H new ATOM 0 HA CYS A 123 2.042 12.986 5.703 1.00 0.00 H new ATOM 0 HB2 CYS A 123 3.536 14.411 7.911 1.00 0.00 H new ATOM 0 HB3 CYS A 123 1.986 14.977 7.319 1.00 0.00 H new ATOM 0 HG CYS A 123 1.541 13.511 9.682 1.00 0.00 H new ATOM 917 N GLY A 124 2.448 14.787 4.097 1.00 0.00 N ATOM 918 CA GLY A 124 2.572 15.888 3.188 1.00 0.00 C ATOM 919 C GLY A 124 1.381 15.935 2.287 1.00 0.00 C ATOM 920 O GLY A 124 0.505 16.811 2.410 1.00 0.00 O ATOM 0 H GLY A 124 1.680 14.150 3.885 1.00 0.00 H new ATOM 0 HA2 GLY A 124 2.657 16.822 3.743 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.482 15.784 2.598 1.00 0.00 H new ATOM 924 N SER A 125 1.304 14.974 1.446 1.00 0.00 N ATOM 925 CA SER A 125 0.241 14.846 0.512 1.00 0.00 C ATOM 926 C SER A 125 0.034 13.379 0.169 1.00 0.00 C ATOM 927 O SER A 125 0.939 12.573 0.308 1.00 0.00 O ATOM 928 CB SER A 125 0.541 15.715 -0.718 1.00 0.00 C ATOM 929 OG SER A 125 1.942 15.720 -1.003 1.00 0.00 O ATOM 0 H SER A 125 1.998 14.229 1.383 1.00 0.00 H new ATOM 0 HA SER A 125 -0.695 15.204 0.940 1.00 0.00 H new ATOM 0 HB2 SER A 125 -0.009 15.337 -1.580 1.00 0.00 H new ATOM 0 HB3 SER A 125 0.197 16.734 -0.542 1.00 0.00 H new ATOM 0 HG SER A 125 2.106 16.221 -1.829 1.00 0.00 H new ATOM 935 N VAL A 126 -1.147 13.020 -0.192 1.00 0.00 N ATOM 936 CA VAL A 126 -1.419 11.658 -0.525 1.00 0.00 C ATOM 937 C VAL A 126 -2.269 11.587 -1.788 1.00 0.00 C ATOM 938 O VAL A 126 -3.175 12.399 -1.992 1.00 0.00 O ATOM 939 CB VAL A 126 -2.094 10.894 0.677 1.00 0.00 C ATOM 940 CG1 VAL A 126 -3.417 11.521 1.078 1.00 0.00 C ATOM 941 CG2 VAL A 126 -2.265 9.403 0.389 1.00 0.00 C ATOM 0 H VAL A 126 -1.946 13.650 -0.266 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.472 11.156 -0.724 1.00 0.00 H new ATOM 0 HB VAL A 126 -1.411 10.990 1.521 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.847 10.963 1.910 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.252 12.555 1.382 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.103 11.496 0.231 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.734 8.918 1.245 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.894 9.272 -0.491 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.289 8.953 0.207 1.00 0.00 H new ATOM 951 N LYS A 127 -1.930 10.686 -2.651 1.00 0.00 N ATOM 952 CA LYS A 127 -2.687 10.459 -3.841 1.00 0.00 C ATOM 953 C LYS A 127 -3.434 9.168 -3.686 1.00 0.00 C ATOM 954 O LYS A 127 -2.862 8.170 -3.267 1.00 0.00 O ATOM 955 CB LYS A 127 -1.803 10.440 -5.092 1.00 0.00 C ATOM 956 CG LYS A 127 -1.206 11.783 -5.448 1.00 0.00 C ATOM 957 CD LYS A 127 -0.524 11.752 -6.803 1.00 0.00 C ATOM 958 CE LYS A 127 0.084 13.098 -7.147 1.00 0.00 C ATOM 959 NZ LYS A 127 0.739 13.080 -8.465 1.00 0.00 N ATOM 0 H LYS A 127 -1.114 10.082 -2.551 1.00 0.00 H new ATOM 0 HA LYS A 127 -3.388 11.282 -3.979 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -0.995 9.724 -4.942 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -2.393 10.082 -5.935 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -1.990 12.540 -5.452 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -0.485 12.075 -4.684 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.254 10.989 -6.803 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -1.246 11.471 -7.569 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -0.694 13.861 -7.138 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.811 13.375 -6.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.143 14.017 -8.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.498 12.369 -8.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 0.040 12.841 -9.197 1.00 0.00 H new ATOM 973 N VAL A 128 -4.699 9.184 -3.978 1.00 0.00 N ATOM 974 CA VAL A 128 -5.528 8.016 -3.775 1.00 0.00 C ATOM 975 C VAL A 128 -6.165 7.557 -5.077 1.00 0.00 C ATOM 976 O VAL A 128 -6.620 8.375 -5.885 1.00 0.00 O ATOM 977 CB VAL A 128 -6.618 8.264 -2.690 1.00 0.00 C ATOM 978 CG1 VAL A 128 -5.978 8.514 -1.332 1.00 0.00 C ATOM 979 CG2 VAL A 128 -7.495 9.444 -3.068 1.00 0.00 C ATOM 0 H VAL A 128 -5.189 9.993 -4.360 1.00 0.00 H new ATOM 0 HA VAL A 128 -4.875 7.221 -3.416 1.00 0.00 H new ATOM 0 HB VAL A 128 -7.238 7.370 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -6.757 8.685 -0.589 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -5.385 7.646 -1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -5.333 9.391 -1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -8.249 9.599 -2.296 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -6.880 10.339 -3.160 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -7.986 9.242 -4.020 1.00 0.00 H new ATOM 989 N GLY A 129 -6.168 6.276 -5.291 1.00 0.00 N ATOM 990 CA GLY A 129 -6.732 5.716 -6.478 1.00 0.00 C ATOM 991 C GLY A 129 -7.838 4.784 -6.137 1.00 0.00 C ATOM 992 O GLY A 129 -7.601 3.686 -5.603 1.00 0.00 O ATOM 0 H GLY A 129 -5.778 5.590 -4.645 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.105 6.513 -7.122 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -5.962 5.187 -7.039 1.00 0.00 H new ATOM 996 N ILE A 130 -9.040 5.204 -6.404 1.00 0.00 N ATOM 997 CA ILE A 130 -10.192 4.430 -6.066 1.00 0.00 C ATOM 998 C ILE A 130 -10.597 3.533 -7.213 1.00 0.00 C ATOM 999 O ILE A 130 -11.049 3.989 -8.262 1.00 0.00 O ATOM 1000 CB ILE A 130 -11.416 5.297 -5.572 1.00 0.00 C ATOM 1001 CG1 ILE A 130 -11.141 5.957 -4.199 1.00 0.00 C ATOM 1002 CG2 ILE A 130 -12.689 4.454 -5.487 1.00 0.00 C ATOM 1003 CD1 ILE A 130 -10.074 7.026 -4.189 1.00 0.00 C ATOM 0 H ILE A 130 -9.246 6.092 -6.862 1.00 0.00 H new ATOM 0 HA ILE A 130 -9.898 3.812 -5.218 1.00 0.00 H new ATOM 0 HB ILE A 130 -11.557 6.087 -6.310 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -12.070 6.394 -3.834 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -10.855 5.178 -3.492 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.515 5.077 -5.144 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -12.924 4.049 -6.471 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.537 3.635 -4.785 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -9.963 7.420 -3.179 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.127 6.598 -4.517 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -10.361 7.833 -4.864 1.00 0.00 H new ATOM 1015 N VAL A 131 -10.392 2.276 -7.009 1.00 0.00 N ATOM 1016 CA VAL A 131 -10.819 1.278 -7.925 1.00 0.00 C ATOM 1017 C VAL A 131 -11.935 0.511 -7.243 1.00 0.00 C ATOM 1018 O VAL A 131 -11.792 0.050 -6.105 1.00 0.00 O ATOM 1019 CB VAL A 131 -9.644 0.354 -8.406 1.00 0.00 C ATOM 1020 CG1 VAL A 131 -8.899 -0.282 -7.245 1.00 0.00 C ATOM 1021 CG2 VAL A 131 -10.142 -0.710 -9.382 1.00 0.00 C ATOM 0 H VAL A 131 -9.914 1.908 -6.186 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.184 1.735 -8.845 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.935 0.994 -8.930 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -8.096 -0.911 -7.629 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.477 0.499 -6.612 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -9.589 -0.890 -6.660 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.306 -1.334 -9.697 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -10.893 -1.330 -8.892 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -10.583 -0.226 -10.254 1.00 0.00 H new ATOM 1031 N GLU A 132 -13.050 0.425 -7.890 1.00 0.00 N ATOM 1032 CA GLU A 132 -14.231 -0.135 -7.273 1.00 0.00 C ATOM 1033 C GLU A 132 -14.281 -1.630 -7.440 1.00 0.00 C ATOM 1034 O GLU A 132 -15.071 -2.307 -6.794 1.00 0.00 O ATOM 1035 CB GLU A 132 -15.462 0.518 -7.845 1.00 0.00 C ATOM 1036 CG GLU A 132 -15.414 2.025 -7.746 1.00 0.00 C ATOM 1037 CD GLU A 132 -16.586 2.672 -8.386 1.00 0.00 C ATOM 1038 OE1 GLU A 132 -16.652 2.683 -9.626 1.00 0.00 O ATOM 1039 OE2 GLU A 132 -17.454 3.216 -7.660 1.00 0.00 O ATOM 0 H GLU A 132 -13.179 0.735 -8.853 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.192 0.066 -6.202 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -15.571 0.229 -8.890 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -16.343 0.150 -7.319 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -15.370 2.316 -6.697 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.500 2.388 -8.216 1.00 0.00 H new ATOM 1046 N GLU A 133 -13.449 -2.139 -8.301 1.00 0.00 N ATOM 1047 CA GLU A 133 -13.356 -3.551 -8.486 1.00 0.00 C ATOM 1048 C GLU A 133 -12.273 -4.106 -7.578 1.00 0.00 C ATOM 1049 O GLU A 133 -11.088 -3.802 -7.751 1.00 0.00 O ATOM 1050 CB GLU A 133 -13.105 -3.903 -9.943 1.00 0.00 C ATOM 1051 CG GLU A 133 -14.254 -3.505 -10.853 1.00 0.00 C ATOM 1052 CD GLU A 133 -14.040 -3.935 -12.266 1.00 0.00 C ATOM 1053 OE1 GLU A 133 -14.243 -5.128 -12.567 1.00 0.00 O ATOM 1054 OE2 GLU A 133 -13.677 -3.097 -13.109 1.00 0.00 O ATOM 0 H GLU A 133 -12.822 -1.589 -8.889 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.307 -4.010 -8.216 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.194 -3.409 -10.279 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.935 -4.976 -10.028 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -15.178 -3.945 -10.479 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.380 -2.423 -10.821 1.00 0.00 H new ATOM 1061 N PRO A 134 -12.661 -4.924 -6.592 1.00 0.00 N ATOM 1062 CA PRO A 134 -11.740 -5.475 -5.590 1.00 0.00 C ATOM 1063 C PRO A 134 -10.903 -6.651 -6.127 1.00 0.00 C ATOM 1064 O PRO A 134 -10.712 -7.676 -5.444 1.00 0.00 O ATOM 1065 CB PRO A 134 -12.698 -5.949 -4.490 1.00 0.00 C ATOM 1066 CG PRO A 134 -13.941 -6.324 -5.205 1.00 0.00 C ATOM 1067 CD PRO A 134 -14.052 -5.391 -6.372 1.00 0.00 C ATOM 0 HA PRO A 134 -10.999 -4.746 -5.262 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -12.285 -6.797 -3.944 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -12.884 -5.161 -3.761 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -13.900 -7.361 -5.539 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -14.808 -6.234 -4.551 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -14.447 -5.898 -7.252 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -14.723 -4.559 -6.156 1.00 0.00 H new ATOM 1075 N ASP A 135 -10.371 -6.488 -7.306 1.00 0.00 N ATOM 1076 CA ASP A 135 -9.551 -7.501 -7.924 1.00 0.00 C ATOM 1077 C ASP A 135 -8.142 -7.379 -7.368 1.00 0.00 C ATOM 1078 O ASP A 135 -7.506 -6.328 -7.492 1.00 0.00 O ATOM 1079 CB ASP A 135 -9.544 -7.332 -9.441 1.00 0.00 C ATOM 1080 CG ASP A 135 -8.760 -8.411 -10.152 1.00 0.00 C ATOM 1081 OD1 ASP A 135 -7.517 -8.418 -10.090 1.00 0.00 O ATOM 1082 OD2 ASP A 135 -9.371 -9.264 -10.804 1.00 0.00 O ATOM 0 H ASP A 135 -10.492 -5.647 -7.870 1.00 0.00 H new ATOM 0 HA ASP A 135 -9.953 -8.490 -7.703 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -10.571 -7.336 -9.806 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -9.121 -6.359 -9.691 1.00 0.00 H new ATOM 1087 N LYS A 136 -7.662 -8.444 -6.767 1.00 0.00 N ATOM 1088 CA LYS A 136 -6.381 -8.438 -6.071 1.00 0.00 C ATOM 1089 C LYS A 136 -5.195 -8.260 -7.006 1.00 0.00 C ATOM 1090 O LYS A 136 -4.155 -7.712 -6.607 1.00 0.00 O ATOM 1091 CB LYS A 136 -6.214 -9.704 -5.226 1.00 0.00 C ATOM 1092 CG LYS A 136 -7.217 -9.851 -4.078 1.00 0.00 C ATOM 1093 CD LYS A 136 -7.065 -8.757 -3.006 1.00 0.00 C ATOM 1094 CE LYS A 136 -5.687 -8.776 -2.348 1.00 0.00 C ATOM 1095 NZ LYS A 136 -5.563 -7.753 -1.285 1.00 0.00 N ATOM 0 H LYS A 136 -8.144 -9.343 -6.743 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.394 -7.569 -5.413 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -6.301 -10.573 -5.879 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -5.206 -9.716 -4.812 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -8.229 -9.820 -4.481 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -7.089 -10.828 -3.613 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -7.235 -7.781 -3.460 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -7.831 -8.891 -2.243 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -5.502 -9.763 -1.924 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -4.922 -8.606 -3.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -4.612 -7.801 -0.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -5.714 -6.808 -1.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -6.276 -7.930 -0.548 1.00 0.00 H new ATOM 1109 N ALA A 137 -5.343 -8.678 -8.238 1.00 0.00 N ATOM 1110 CA ALA A 137 -4.271 -8.554 -9.182 1.00 0.00 C ATOM 1111 C ALA A 137 -4.249 -7.146 -9.730 1.00 0.00 C ATOM 1112 O ALA A 137 -3.188 -6.563 -9.886 1.00 0.00 O ATOM 1113 CB ALA A 137 -4.387 -9.578 -10.288 1.00 0.00 C ATOM 0 H ALA A 137 -6.193 -9.105 -8.606 1.00 0.00 H new ATOM 0 HA ALA A 137 -3.327 -8.750 -8.674 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -3.559 -9.455 -10.986 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -4.356 -10.580 -9.861 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -5.330 -9.438 -10.816 1.00 0.00 H new ATOM 1119 N VAL A 138 -5.436 -6.587 -9.978 1.00 0.00 N ATOM 1120 CA VAL A 138 -5.554 -5.200 -10.431 1.00 0.00 C ATOM 1121 C VAL A 138 -4.984 -4.250 -9.380 1.00 0.00 C ATOM 1122 O VAL A 138 -4.260 -3.323 -9.718 1.00 0.00 O ATOM 1123 CB VAL A 138 -7.023 -4.797 -10.787 1.00 0.00 C ATOM 1124 CG1 VAL A 138 -7.119 -3.318 -11.167 1.00 0.00 C ATOM 1125 CG2 VAL A 138 -7.533 -5.648 -11.932 1.00 0.00 C ATOM 0 H VAL A 138 -6.327 -7.073 -9.873 1.00 0.00 H new ATOM 0 HA VAL A 138 -4.975 -5.119 -11.351 1.00 0.00 H new ATOM 0 HB VAL A 138 -7.638 -4.965 -9.903 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.153 -3.071 -11.409 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -6.785 -2.705 -10.330 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -6.487 -3.123 -12.034 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.556 -5.360 -12.172 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -6.899 -5.499 -12.806 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.511 -6.699 -11.643 1.00 0.00 H new ATOM 1135 N LEU A 139 -5.274 -4.522 -8.105 1.00 0.00 N ATOM 1136 CA LEU A 139 -4.734 -3.722 -6.994 1.00 0.00 C ATOM 1137 C LEU A 139 -3.210 -3.719 -7.030 1.00 0.00 C ATOM 1138 O LEU A 139 -2.578 -2.664 -6.969 1.00 0.00 O ATOM 1139 CB LEU A 139 -5.200 -4.261 -5.628 1.00 0.00 C ATOM 1140 CG LEU A 139 -6.704 -4.235 -5.341 1.00 0.00 C ATOM 1141 CD1 LEU A 139 -6.991 -4.879 -4.001 1.00 0.00 C ATOM 1142 CD2 LEU A 139 -7.227 -2.813 -5.350 1.00 0.00 C ATOM 0 H LEU A 139 -5.879 -5.289 -7.813 1.00 0.00 H new ATOM 0 HA LEU A 139 -5.110 -2.706 -7.117 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -4.856 -5.291 -5.537 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -4.698 -3.687 -4.849 1.00 0.00 H new ATOM 0 HG LEU A 139 -7.211 -4.797 -6.125 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -8.063 -4.855 -3.808 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -6.648 -5.914 -4.014 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -6.468 -4.333 -3.216 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.297 -2.818 -5.144 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -6.713 -2.231 -4.585 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -7.048 -2.366 -6.328 1.00 0.00 H new ATOM 1154 N THR A 140 -2.639 -4.897 -7.177 1.00 0.00 N ATOM 1155 CA THR A 140 -1.202 -5.061 -7.202 1.00 0.00 C ATOM 1156 C THR A 140 -0.603 -4.449 -8.488 1.00 0.00 C ATOM 1157 O THR A 140 0.478 -3.863 -8.468 1.00 0.00 O ATOM 1158 CB THR A 140 -0.845 -6.556 -7.081 1.00 0.00 C ATOM 1159 OG1 THR A 140 -1.531 -7.098 -5.931 1.00 0.00 O ATOM 1160 CG2 THR A 140 0.658 -6.751 -6.895 1.00 0.00 C ATOM 0 H THR A 140 -3.160 -5.768 -7.283 1.00 0.00 H new ATOM 0 HA THR A 140 -0.771 -4.531 -6.353 1.00 0.00 H new ATOM 0 HB THR A 140 -1.148 -7.065 -7.996 1.00 0.00 H new ATOM 0 HG1 THR A 140 -2.452 -7.327 -6.177 1.00 0.00 H new ATOM 0 HG21 THR A 140 0.879 -7.815 -6.813 1.00 0.00 H new ATOM 0 HG22 THR A 140 1.188 -6.335 -7.752 1.00 0.00 H new ATOM 0 HG23 THR A 140 0.981 -6.242 -5.987 1.00 0.00 H new ATOM 1168 N GLN A 141 -1.329 -4.567 -9.588 1.00 0.00 N ATOM 1169 CA GLN A 141 -0.927 -4.010 -10.854 1.00 0.00 C ATOM 1170 C GLN A 141 -0.910 -2.479 -10.771 1.00 0.00 C ATOM 1171 O GLN A 141 0.039 -1.839 -11.213 1.00 0.00 O ATOM 1172 CB GLN A 141 -1.884 -4.487 -11.947 1.00 0.00 C ATOM 1173 CG GLN A 141 -1.542 -3.996 -13.327 1.00 0.00 C ATOM 1174 CD GLN A 141 -2.514 -4.484 -14.374 1.00 0.00 C ATOM 1175 OE1 GLN A 141 -2.320 -5.536 -14.981 1.00 0.00 O ATOM 1176 NE2 GLN A 141 -3.561 -3.735 -14.591 1.00 0.00 N ATOM 0 H GLN A 141 -2.222 -5.059 -9.619 1.00 0.00 H new ATOM 0 HA GLN A 141 0.080 -4.348 -11.100 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -1.894 -5.577 -11.954 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -2.894 -4.160 -11.698 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.529 -2.906 -13.328 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.537 -4.327 -13.588 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -3.686 -2.869 -14.067 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -4.254 -4.016 -15.285 1.00 0.00 H new ATOM 1185 N ALA A 142 -1.953 -1.912 -10.177 1.00 0.00 N ATOM 1186 CA ALA A 142 -2.048 -0.470 -9.987 1.00 0.00 C ATOM 1187 C ALA A 142 -0.922 0.002 -9.087 1.00 0.00 C ATOM 1188 O ALA A 142 -0.247 0.980 -9.391 1.00 0.00 O ATOM 1189 CB ALA A 142 -3.402 -0.090 -9.401 1.00 0.00 C ATOM 0 H ALA A 142 -2.751 -2.434 -9.816 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.955 0.020 -10.956 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -3.450 0.991 -9.268 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -4.194 -0.408 -10.079 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -3.532 -0.581 -8.436 1.00 0.00 H new ATOM 1195 N TRP A 143 -0.705 -0.743 -7.998 1.00 0.00 N ATOM 1196 CA TRP A 143 0.383 -0.491 -7.057 1.00 0.00 C ATOM 1197 C TRP A 143 1.712 -0.444 -7.811 1.00 0.00 C ATOM 1198 O TRP A 143 2.547 0.443 -7.591 1.00 0.00 O ATOM 1199 CB TRP A 143 0.421 -1.625 -5.999 1.00 0.00 C ATOM 1200 CG TRP A 143 1.520 -1.493 -4.974 1.00 0.00 C ATOM 1201 CD1 TRP A 143 1.456 -0.823 -3.798 1.00 0.00 C ATOM 1202 CD2 TRP A 143 2.845 -2.052 -5.046 1.00 0.00 C ATOM 1203 NE1 TRP A 143 2.656 -0.913 -3.133 1.00 0.00 N ATOM 1204 CE2 TRP A 143 3.527 -1.656 -3.884 1.00 0.00 C ATOM 1205 CE3 TRP A 143 3.515 -2.839 -5.985 1.00 0.00 C ATOM 1206 CZ2 TRP A 143 4.852 -2.013 -3.637 1.00 0.00 C ATOM 1207 CZ3 TRP A 143 4.828 -3.196 -5.741 1.00 0.00 C ATOM 1208 CH2 TRP A 143 5.485 -2.781 -4.574 1.00 0.00 C ATOM 0 H TRP A 143 -1.286 -1.543 -7.746 1.00 0.00 H new ATOM 0 HA TRP A 143 0.220 0.464 -6.558 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -0.538 -1.654 -5.482 1.00 0.00 H new ATOM 0 HB3 TRP A 143 0.535 -2.579 -6.513 1.00 0.00 H new ATOM 0 HD1 TRP A 143 0.587 -0.294 -3.435 1.00 0.00 H new ATOM 0 HE1 TRP A 143 2.864 -0.494 -2.227 1.00 0.00 H new ATOM 0 HE3 TRP A 143 3.016 -3.163 -6.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 5.359 -1.694 -2.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 5.356 -3.804 -6.461 1.00 0.00 H new ATOM 0 HH2 TRP A 143 6.512 -3.074 -4.412 1.00 0.00 H new ATOM 1219 N LYS A 144 1.875 -1.397 -8.709 1.00 0.00 N ATOM 1220 CA LYS A 144 3.075 -1.544 -9.484 1.00 0.00 C ATOM 1221 C LYS A 144 3.280 -0.330 -10.389 1.00 0.00 C ATOM 1222 O LYS A 144 4.317 0.291 -10.343 1.00 0.00 O ATOM 1223 CB LYS A 144 3.020 -2.820 -10.320 1.00 0.00 C ATOM 1224 CG LYS A 144 4.381 -3.331 -10.737 1.00 0.00 C ATOM 1225 CD LYS A 144 4.272 -4.509 -11.681 1.00 0.00 C ATOM 1226 CE LYS A 144 5.585 -5.276 -11.776 1.00 0.00 C ATOM 1227 NZ LYS A 144 6.752 -4.413 -12.089 1.00 0.00 N ATOM 0 H LYS A 144 1.163 -2.097 -8.918 1.00 0.00 H new ATOM 0 HA LYS A 144 3.919 -1.614 -8.797 1.00 0.00 H new ATOM 0 HB2 LYS A 144 2.509 -3.596 -9.750 1.00 0.00 H new ATOM 0 HB3 LYS A 144 2.422 -2.634 -11.212 1.00 0.00 H new ATOM 0 HG2 LYS A 144 4.939 -2.528 -11.220 1.00 0.00 H new ATOM 0 HG3 LYS A 144 4.946 -3.625 -9.852 1.00 0.00 H new ATOM 0 HD2 LYS A 144 3.483 -5.179 -11.338 1.00 0.00 H new ATOM 0 HD3 LYS A 144 3.983 -4.157 -12.671 1.00 0.00 H new ATOM 0 HE2 LYS A 144 5.766 -5.790 -10.832 1.00 0.00 H new ATOM 0 HE3 LYS A 144 5.494 -6.044 -12.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 7.572 -5.009 -12.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 6.525 -3.803 -12.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 6.978 -3.822 -11.264 1.00 0.00 H new ATOM 1241 N LEU A 145 2.274 0.018 -11.176 1.00 0.00 N ATOM 1242 CA LEU A 145 2.378 1.165 -12.088 1.00 0.00 C ATOM 1243 C LEU A 145 2.681 2.458 -11.341 1.00 0.00 C ATOM 1244 O LEU A 145 3.481 3.270 -11.800 1.00 0.00 O ATOM 1245 CB LEU A 145 1.128 1.320 -12.977 1.00 0.00 C ATOM 1246 CG LEU A 145 1.072 0.481 -14.279 1.00 0.00 C ATOM 1247 CD1 LEU A 145 1.191 -1.012 -14.024 1.00 0.00 C ATOM 1248 CD2 LEU A 145 -0.205 0.784 -15.045 1.00 0.00 C ATOM 0 H LEU A 145 1.378 -0.469 -11.208 1.00 0.00 H new ATOM 0 HA LEU A 145 3.221 0.957 -12.748 1.00 0.00 H new ATOM 0 HB2 LEU A 145 0.254 1.069 -12.376 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.036 2.371 -13.249 1.00 0.00 H new ATOM 0 HG LEU A 145 1.936 0.769 -14.878 1.00 0.00 H new ATOM 0 HD11 LEU A 145 1.145 -1.548 -14.972 1.00 0.00 H new ATOM 0 HD12 LEU A 145 2.141 -1.223 -13.534 1.00 0.00 H new ATOM 0 HD13 LEU A 145 0.372 -1.338 -13.383 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -0.232 0.188 -15.957 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -1.068 0.539 -14.426 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -0.232 1.843 -15.302 1.00 0.00 H new ATOM 1260 N TRP A 146 2.081 2.619 -10.179 1.00 0.00 N ATOM 1261 CA TRP A 146 2.298 3.795 -9.352 1.00 0.00 C ATOM 1262 C TRP A 146 3.735 3.905 -8.859 1.00 0.00 C ATOM 1263 O TRP A 146 4.342 4.984 -8.940 1.00 0.00 O ATOM 1264 CB TRP A 146 1.332 3.827 -8.187 1.00 0.00 C ATOM 1265 CG TRP A 146 -0.071 4.186 -8.561 1.00 0.00 C ATOM 1266 CD1 TRP A 146 -0.689 4.041 -9.774 1.00 0.00 C ATOM 1267 CD2 TRP A 146 -1.029 4.748 -7.695 1.00 0.00 C ATOM 1268 NE1 TRP A 146 -1.979 4.485 -9.696 1.00 0.00 N ATOM 1269 CE2 TRP A 146 -2.210 4.928 -8.426 1.00 0.00 C ATOM 1270 CE3 TRP A 146 -0.998 5.123 -6.363 1.00 0.00 C ATOM 1271 CZ2 TRP A 146 -3.346 5.463 -7.859 1.00 0.00 C ATOM 1272 CZ3 TRP A 146 -2.122 5.653 -5.803 1.00 0.00 C ATOM 1273 CH2 TRP A 146 -3.278 5.821 -6.545 1.00 0.00 C ATOM 0 H TRP A 146 1.431 1.942 -9.780 1.00 0.00 H new ATOM 0 HA TRP A 146 2.109 4.661 -9.987 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.328 2.849 -7.706 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.694 4.544 -7.450 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -0.226 3.636 -10.661 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -2.656 4.485 -10.459 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -0.099 4.998 -5.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -4.253 5.593 -8.431 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -2.110 5.946 -4.764 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -4.150 6.247 -6.071 1.00 0.00 H new ATOM 1284 N ILE A 147 4.295 2.810 -8.353 1.00 0.00 N ATOM 1285 CA ILE A 147 5.675 2.850 -7.901 1.00 0.00 C ATOM 1286 C ILE A 147 6.607 3.149 -9.074 1.00 0.00 C ATOM 1287 O ILE A 147 7.436 4.059 -8.991 1.00 0.00 O ATOM 1288 CB ILE A 147 6.128 1.580 -7.073 1.00 0.00 C ATOM 1289 CG1 ILE A 147 7.606 1.668 -6.648 1.00 0.00 C ATOM 1290 CG2 ILE A 147 5.819 0.265 -7.760 1.00 0.00 C ATOM 1291 CD1 ILE A 147 8.091 0.490 -5.822 1.00 0.00 C ATOM 0 H ILE A 147 3.827 1.909 -8.249 1.00 0.00 H new ATOM 0 HA ILE A 147 5.744 3.668 -7.184 1.00 0.00 H new ATOM 0 HB ILE A 147 5.521 1.590 -6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.225 1.749 -7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.753 2.583 -6.075 1.00 0.00 H new ATOM 0 HG21 ILE A 147 6.158 -0.561 -7.134 1.00 0.00 H new ATOM 0 HG22 ILE A 147 4.744 0.182 -7.920 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.333 0.227 -8.721 1.00 0.00 H new ATOM 0 HD11 ILE A 147 9.141 0.633 -5.566 1.00 0.00 H new ATOM 0 HD12 ILE A 147 7.501 0.419 -4.908 1.00 0.00 H new ATOM 0 HD13 ILE A 147 7.980 -0.429 -6.398 1.00 0.00 H new ATOM 1303 N GLU A 148 6.373 2.468 -10.199 1.00 0.00 N ATOM 1304 CA GLU A 148 7.149 2.637 -11.420 1.00 0.00 C ATOM 1305 C GLU A 148 7.130 4.093 -11.907 1.00 0.00 C ATOM 1306 O GLU A 148 8.148 4.608 -12.364 1.00 0.00 O ATOM 1307 CB GLU A 148 6.582 1.714 -12.462 1.00 0.00 C ATOM 1308 CG GLU A 148 6.682 0.260 -12.062 1.00 0.00 C ATOM 1309 CD GLU A 148 8.032 -0.351 -12.288 1.00 0.00 C ATOM 1310 OE1 GLU A 148 8.392 -0.599 -13.456 1.00 0.00 O ATOM 1311 OE2 GLU A 148 8.733 -0.664 -11.310 1.00 0.00 O ATOM 0 H GLU A 148 5.628 1.776 -10.283 1.00 0.00 H new ATOM 0 HA GLU A 148 8.193 2.390 -11.225 1.00 0.00 H new ATOM 0 HB2 GLU A 148 5.537 1.968 -12.638 1.00 0.00 H new ATOM 0 HB3 GLU A 148 7.110 1.866 -13.403 1.00 0.00 H new ATOM 0 HG2 GLU A 148 6.426 0.167 -11.006 1.00 0.00 H new ATOM 0 HG3 GLU A 148 5.940 -0.310 -12.621 1.00 0.00 H new ATOM 1318 N GLU A 149 5.977 4.743 -11.787 1.00 0.00 N ATOM 1319 CA GLU A 149 5.815 6.165 -12.103 1.00 0.00 C ATOM 1320 C GLU A 149 6.856 7.023 -11.385 1.00 0.00 C ATOM 1321 O GLU A 149 7.550 7.846 -12.005 1.00 0.00 O ATOM 1322 CB GLU A 149 4.417 6.620 -11.695 1.00 0.00 C ATOM 1323 CG GLU A 149 3.324 6.295 -12.682 1.00 0.00 C ATOM 1324 CD GLU A 149 3.175 7.376 -13.716 1.00 0.00 C ATOM 1325 OE1 GLU A 149 3.963 7.429 -14.675 1.00 0.00 O ATOM 1326 OE2 GLU A 149 2.246 8.221 -13.556 1.00 0.00 O ATOM 0 H GLU A 149 5.118 4.297 -11.465 1.00 0.00 H new ATOM 0 HA GLU A 149 5.955 6.290 -13.177 1.00 0.00 H new ATOM 0 HB2 GLU A 149 4.168 6.163 -10.737 1.00 0.00 H new ATOM 0 HB3 GLU A 149 4.434 7.699 -11.538 1.00 0.00 H new ATOM 0 HG2 GLU A 149 3.546 5.348 -13.174 1.00 0.00 H new ATOM 0 HG3 GLU A 149 2.381 6.165 -12.152 1.00 0.00 H new ATOM 1333 N HIS A 150 7.008 6.819 -10.084 1.00 0.00 N ATOM 1334 CA HIS A 150 7.939 7.639 -9.347 1.00 0.00 C ATOM 1335 C HIS A 150 9.362 7.124 -9.554 1.00 0.00 C ATOM 1336 O HIS A 150 10.331 7.878 -9.437 1.00 0.00 O ATOM 1337 CB HIS A 150 7.545 7.774 -7.859 1.00 0.00 C ATOM 1338 CG HIS A 150 8.048 9.027 -7.201 1.00 0.00 C ATOM 1339 ND1 HIS A 150 7.456 10.249 -7.403 1.00 0.00 N ATOM 1340 CD2 HIS A 150 9.040 9.243 -6.320 1.00 0.00 C ATOM 1341 CE1 HIS A 150 8.054 11.159 -6.683 1.00 0.00 C ATOM 1342 NE2 HIS A 150 9.024 10.586 -6.011 1.00 0.00 N ATOM 0 H HIS A 150 6.513 6.114 -9.537 1.00 0.00 H new ATOM 0 HA HIS A 150 7.900 8.655 -9.740 1.00 0.00 H new ATOM 0 HB2 HIS A 150 6.458 7.746 -7.778 1.00 0.00 H new ATOM 0 HB3 HIS A 150 7.928 6.911 -7.313 1.00 0.00 H new ATOM 0 HD2 HIS A 150 9.722 8.503 -5.928 1.00 0.00 H new ATOM 0 HE1 HIS A 150 7.794 12.207 -6.647 1.00 0.00 H new ATOM 0 HE2 HIS A 150 9.660 11.056 -5.367 1.00 0.00 H new ATOM 1351 N ILE A 151 9.479 5.853 -9.904 1.00 0.00 N ATOM 1352 CA ILE A 151 10.766 5.249 -10.250 1.00 0.00 C ATOM 1353 C ILE A 151 11.341 5.920 -11.502 1.00 0.00 C ATOM 1354 O ILE A 151 12.466 6.392 -11.482 1.00 0.00 O ATOM 1355 CB ILE A 151 10.659 3.705 -10.492 1.00 0.00 C ATOM 1356 CG1 ILE A 151 10.219 2.958 -9.225 1.00 0.00 C ATOM 1357 CG2 ILE A 151 11.958 3.123 -11.022 1.00 0.00 C ATOM 1358 CD1 ILE A 151 11.115 3.160 -8.025 1.00 0.00 C ATOM 0 H ILE A 151 8.690 5.209 -9.958 1.00 0.00 H new ATOM 0 HA ILE A 151 11.429 5.405 -9.399 1.00 0.00 H new ATOM 0 HB ILE A 151 9.891 3.565 -11.253 1.00 0.00 H new ATOM 0 HG12 ILE A 151 9.210 3.277 -8.965 1.00 0.00 H new ATOM 0 HG13 ILE A 151 10.169 1.892 -9.448 1.00 0.00 H new ATOM 0 HG21 ILE A 151 11.840 2.050 -11.176 1.00 0.00 H new ATOM 0 HG22 ILE A 151 12.211 3.600 -11.969 1.00 0.00 H new ATOM 0 HG23 ILE A 151 12.757 3.301 -10.302 1.00 0.00 H new ATOM 0 HD11 ILE A 151 10.724 2.594 -7.180 1.00 0.00 H new ATOM 0 HD12 ILE A 151 12.121 2.813 -8.260 1.00 0.00 H new ATOM 0 HD13 ILE A 151 11.147 4.219 -7.769 1.00 0.00 H new ATOM 1370 N LYS A 152 10.533 6.017 -12.554 1.00 0.00 N ATOM 1371 CA LYS A 152 10.969 6.608 -13.824 1.00 0.00 C ATOM 1372 C LYS A 152 11.490 8.036 -13.625 1.00 0.00 C ATOM 1373 O LYS A 152 12.561 8.399 -14.128 1.00 0.00 O ATOM 1374 CB LYS A 152 9.825 6.614 -14.858 1.00 0.00 C ATOM 1375 CG LYS A 152 9.285 5.233 -15.258 1.00 0.00 C ATOM 1376 CD LYS A 152 8.144 5.375 -16.268 1.00 0.00 C ATOM 1377 CE LYS A 152 7.483 4.040 -16.625 1.00 0.00 C ATOM 1378 NZ LYS A 152 8.412 3.086 -17.264 1.00 0.00 N ATOM 0 H LYS A 152 9.566 5.693 -12.555 1.00 0.00 H new ATOM 0 HA LYS A 152 11.782 5.989 -14.202 1.00 0.00 H new ATOM 0 HB2 LYS A 152 9.001 7.205 -14.458 1.00 0.00 H new ATOM 0 HB3 LYS A 152 10.174 7.122 -15.757 1.00 0.00 H new ATOM 0 HG2 LYS A 152 10.087 4.633 -15.689 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.931 4.704 -14.373 1.00 0.00 H new ATOM 0 HD2 LYS A 152 7.390 6.049 -15.862 1.00 0.00 H new ATOM 0 HD3 LYS A 152 8.528 5.837 -17.177 1.00 0.00 H new ATOM 0 HE2 LYS A 152 7.075 3.590 -15.720 1.00 0.00 H new ATOM 0 HE3 LYS A 152 6.644 4.225 -17.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 7.907 2.203 -17.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 8.783 3.499 -18.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 9.201 2.884 -16.617 1.00 0.00 H new ATOM 1392 N VAL A 153 10.759 8.823 -12.854 1.00 0.00 N ATOM 1393 CA VAL A 153 11.120 10.219 -12.651 1.00 0.00 C ATOM 1394 C VAL A 153 12.228 10.455 -11.596 1.00 0.00 C ATOM 1395 O VAL A 153 13.026 11.378 -11.746 1.00 0.00 O ATOM 1396 CB VAL A 153 9.888 11.130 -12.358 1.00 0.00 C ATOM 1397 CG1 VAL A 153 8.935 11.142 -13.541 1.00 0.00 C ATOM 1398 CG2 VAL A 153 9.154 10.691 -11.105 1.00 0.00 C ATOM 0 H VAL A 153 9.918 8.524 -12.361 1.00 0.00 H new ATOM 0 HA VAL A 153 11.544 10.512 -13.612 1.00 0.00 H new ATOM 0 HB VAL A 153 10.263 12.140 -12.194 1.00 0.00 H new ATOM 0 HG11 VAL A 153 8.083 11.783 -13.315 1.00 0.00 H new ATOM 0 HG12 VAL A 153 9.453 11.523 -14.421 1.00 0.00 H new ATOM 0 HG13 VAL A 153 8.585 10.128 -13.736 1.00 0.00 H new ATOM 0 HG21 VAL A 153 8.302 11.349 -10.933 1.00 0.00 H new ATOM 0 HG22 VAL A 153 8.802 9.667 -11.229 1.00 0.00 H new ATOM 0 HG23 VAL A 153 9.830 10.741 -10.251 1.00 0.00 H new ATOM 1408 N THR A 154 12.298 9.646 -10.543 1.00 0.00 N ATOM 1409 CA THR A 154 13.282 9.914 -9.500 1.00 0.00 C ATOM 1410 C THR A 154 14.104 8.677 -9.116 1.00 0.00 C ATOM 1411 O THR A 154 15.306 8.770 -8.860 1.00 0.00 O ATOM 1412 CB THR A 154 12.586 10.433 -8.225 1.00 0.00 C ATOM 1413 OG1 THR A 154 11.570 9.509 -7.829 1.00 0.00 O ATOM 1414 CG2 THR A 154 11.959 11.800 -8.415 1.00 0.00 C ATOM 0 H THR A 154 11.708 8.828 -10.391 1.00 0.00 H new ATOM 0 HA THR A 154 13.957 10.662 -9.914 1.00 0.00 H new ATOM 0 HB THR A 154 13.353 10.525 -7.456 1.00 0.00 H new ATOM 0 HG1 THR A 154 11.033 9.259 -8.610 1.00 0.00 H new ATOM 0 HG21 THR A 154 11.484 12.115 -7.486 1.00 0.00 H new ATOM 0 HG22 THR A 154 12.731 12.519 -8.690 1.00 0.00 H new ATOM 0 HG23 THR A 154 11.211 11.750 -9.206 1.00 0.00 H new ATOM 1422 N GLY A 155 13.472 7.521 -9.121 1.00 0.00 N ATOM 1423 CA GLY A 155 14.139 6.319 -8.672 1.00 0.00 C ATOM 1424 C GLY A 155 14.155 6.224 -7.156 1.00 0.00 C ATOM 1425 O GLY A 155 15.097 5.698 -6.565 1.00 0.00 O ATOM 0 H GLY A 155 12.508 7.390 -9.428 1.00 0.00 H new ATOM 0 HA2 GLY A 155 13.636 5.446 -9.087 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.162 6.307 -9.049 1.00 0.00 H new ATOM 1429 N LYS A 156 13.141 6.771 -6.524 1.00 0.00 N ATOM 1430 CA LYS A 156 13.027 6.707 -5.073 1.00 0.00 C ATOM 1431 C LYS A 156 12.440 5.385 -4.652 1.00 0.00 C ATOM 1432 O LYS A 156 11.308 5.069 -5.005 1.00 0.00 O ATOM 1433 CB LYS A 156 12.130 7.820 -4.526 1.00 0.00 C ATOM 1434 CG LYS A 156 12.644 9.235 -4.706 1.00 0.00 C ATOM 1435 CD LYS A 156 13.861 9.505 -3.841 1.00 0.00 C ATOM 1436 CE LYS A 156 14.351 10.933 -4.012 1.00 0.00 C ATOM 1437 NZ LYS A 156 13.321 11.929 -3.655 1.00 0.00 N ATOM 0 H LYS A 156 12.379 7.267 -6.987 1.00 0.00 H new ATOM 0 HA LYS A 156 14.033 6.826 -4.670 1.00 0.00 H new ATOM 0 HB2 LYS A 156 11.155 7.744 -5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 156 11.974 7.644 -3.462 1.00 0.00 H new ATOM 0 HG2 LYS A 156 12.898 9.399 -5.753 1.00 0.00 H new ATOM 0 HG3 LYS A 156 11.855 9.943 -4.455 1.00 0.00 H new ATOM 0 HD2 LYS A 156 13.614 9.325 -2.795 1.00 0.00 H new ATOM 0 HD3 LYS A 156 14.659 8.810 -4.104 1.00 0.00 H new ATOM 0 HE2 LYS A 156 15.233 11.088 -3.391 1.00 0.00 H new ATOM 0 HE3 LYS A 156 14.658 11.087 -5.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 13.757 12.871 -3.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 12.580 11.939 -4.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 12.900 11.679 -2.737 1.00 0.00 H new ATOM 1451 N VAL A 157 13.211 4.615 -3.930 1.00 0.00 N ATOM 1452 CA VAL A 157 12.734 3.385 -3.337 1.00 0.00 C ATOM 1453 C VAL A 157 13.170 3.427 -1.879 1.00 0.00 C ATOM 1454 O VAL A 157 14.228 2.911 -1.529 1.00 0.00 O ATOM 1455 CB VAL A 157 13.315 2.090 -3.986 1.00 0.00 C ATOM 1456 CG1 VAL A 157 12.544 0.863 -3.515 1.00 0.00 C ATOM 1457 CG2 VAL A 157 13.343 2.157 -5.503 1.00 0.00 C ATOM 0 H VAL A 157 14.191 4.820 -3.734 1.00 0.00 H new ATOM 0 HA VAL A 157 11.655 3.332 -3.481 1.00 0.00 H new ATOM 0 HB VAL A 157 14.351 2.007 -3.656 1.00 0.00 H new ATOM 0 HG11 VAL A 157 12.963 -0.030 -3.978 1.00 0.00 H new ATOM 0 HG12 VAL A 157 12.620 0.780 -2.431 1.00 0.00 H new ATOM 0 HG13 VAL A 157 11.496 0.961 -3.799 1.00 0.00 H new ATOM 0 HG21 VAL A 157 13.756 1.230 -5.901 1.00 0.00 H new ATOM 0 HG22 VAL A 157 12.329 2.293 -5.880 1.00 0.00 H new ATOM 0 HG23 VAL A 157 13.963 2.996 -5.819 1.00 0.00 H new ATOM 1467 N PRO A 158 12.433 4.143 -1.039 1.00 0.00 N ATOM 1468 CA PRO A 158 12.789 4.335 0.362 1.00 0.00 C ATOM 1469 C PRO A 158 12.507 3.091 1.216 1.00 0.00 C ATOM 1470 O PRO A 158 11.720 2.218 0.817 1.00 0.00 O ATOM 1471 CB PRO A 158 11.887 5.509 0.795 1.00 0.00 C ATOM 1472 CG PRO A 158 11.327 6.035 -0.475 1.00 0.00 C ATOM 1473 CD PRO A 158 11.206 4.858 -1.365 1.00 0.00 C ATOM 0 HA PRO A 158 13.854 4.525 0.492 1.00 0.00 H new ATOM 0 HB2 PRO A 158 11.098 5.176 1.469 1.00 0.00 H new ATOM 0 HB3 PRO A 158 12.457 6.273 1.324 1.00 0.00 H new ATOM 0 HG2 PRO A 158 10.358 6.506 -0.312 1.00 0.00 H new ATOM 0 HG3 PRO A 158 11.980 6.791 -0.910 1.00 0.00 H new ATOM 0 HD2 PRO A 158 10.315 4.268 -1.151 1.00 0.00 H new ATOM 0 HD3 PRO A 158 11.158 5.139 -2.417 1.00 0.00 H new ATOM 1481 N PRO A 159 13.124 3.010 2.433 1.00 0.00 N ATOM 1482 CA PRO A 159 12.974 1.868 3.381 1.00 0.00 C ATOM 1483 C PRO A 159 11.522 1.578 3.758 1.00 0.00 C ATOM 1484 O PRO A 159 11.209 0.516 4.288 1.00 0.00 O ATOM 1485 CB PRO A 159 13.705 2.358 4.622 1.00 0.00 C ATOM 1486 CG PRO A 159 14.719 3.308 4.108 1.00 0.00 C ATOM 1487 CD PRO A 159 14.059 4.023 2.976 1.00 0.00 C ATOM 0 HA PRO A 159 13.354 0.945 2.942 1.00 0.00 H new ATOM 0 HB2 PRO A 159 13.022 2.845 5.318 1.00 0.00 H new ATOM 0 HB3 PRO A 159 14.172 1.532 5.159 1.00 0.00 H new ATOM 0 HG2 PRO A 159 15.031 4.006 4.884 1.00 0.00 H new ATOM 0 HG3 PRO A 159 15.614 2.783 3.772 1.00 0.00 H new ATOM 0 HD2 PRO A 159 13.533 4.915 3.316 1.00 0.00 H new ATOM 0 HD3 PRO A 159 14.782 4.345 2.227 1.00 0.00 H new ATOM 1495 N GLY A 160 10.680 2.543 3.510 1.00 0.00 N ATOM 1496 CA GLY A 160 9.266 2.426 3.794 1.00 0.00 C ATOM 1497 C GLY A 160 8.552 1.597 2.757 1.00 0.00 C ATOM 1498 O GLY A 160 7.677 0.803 3.081 1.00 0.00 O ATOM 0 H GLY A 160 10.951 3.439 3.104 1.00 0.00 H new ATOM 0 HA2 GLY A 160 9.129 1.975 4.777 1.00 0.00 H new ATOM 0 HA3 GLY A 160 8.820 3.420 3.834 1.00 0.00 H new ATOM 1502 N ASN A 161 8.953 1.778 1.506 1.00 0.00 N ATOM 1503 CA ASN A 161 8.347 1.079 0.370 1.00 0.00 C ATOM 1504 C ASN A 161 9.004 -0.302 0.263 1.00 0.00 C ATOM 1505 O ASN A 161 8.446 -1.245 -0.315 1.00 0.00 O ATOM 1506 CB ASN A 161 8.589 1.899 -0.920 1.00 0.00 C ATOM 1507 CG ASN A 161 7.641 1.589 -2.102 1.00 0.00 C ATOM 1508 OD1 ASN A 161 7.361 2.461 -2.904 1.00 0.00 O ATOM 1509 ND2 ASN A 161 7.137 0.387 -2.212 1.00 0.00 N ATOM 0 H ASN A 161 9.708 2.413 1.245 1.00 0.00 H new ATOM 0 HA ASN A 161 7.272 0.965 0.508 1.00 0.00 H new ATOM 0 HB2 ASN A 161 8.502 2.958 -0.677 1.00 0.00 H new ATOM 0 HB3 ASN A 161 9.615 1.731 -1.248 1.00 0.00 H new ATOM 0 HD21 ASN A 161 6.500 0.169 -2.978 1.00 0.00 H new ATOM 0 HD22 ASN A 161 7.381 -0.333 -1.532 1.00 0.00 H new