USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1090 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 114 THR OG1 : rot -63:sc= 1.27 USER MOD Set 1.2: A 117 GLN : amide:sc= 1.99 K(o=3.3,f=-5.4!) USER MOD Set 2.1: A 33 GLN : amide:sc= -0.376 K(o=-2,f=-6.1) USER MOD Set 2.2: A 88 MET CE :methyl 168:sc= 0 (180deg=0) USER MOD Set 2.3: A 118 MET CE :methyl -123:sc= -1.62 (180deg=-6.01!) USER MOD Set 3.1: A 74 THR OG1 : rot -34:sc= -0.896! USER MOD Set 3.2: A 81 GLN : amide:sc= -1.16 K(o=-2.1,f=-3.1!) USER MOD Set 4.1: A 38 LYS NZ :NH3+ -168:sc= 1.3 (180deg=0.584) USER MOD Set 4.2: A 40 GLN :FLIP amide:sc= -1.5 F(o=-2!,f=-0.2) USER MOD Set 5.1: A 11 SER OG : rot 170:sc= -0.297 USER MOD Set 5.2: A 128 LYS NZ :NH3+ -171:sc= 1.15 (180deg=0.919) USER MOD Set 6.1: A 9 LYS NZ :NH3+ -128:sc= 0.122 (180deg=-0.189) USER MOD Set 6.2: A 22 THR OG1 : rot 172:sc= 0.346 USER MOD Set 7.1: A 8 LYS NZ :NH3+ -159:sc= 0.934 (180deg=0.768) USER MOD Set 7.2: A 115 MET CE :methyl 160:sc= -0.753 (180deg=-1.34) USER MOD Single : A 1 MET CE :methyl -165:sc= -0.127 (180deg=-0.603) USER MOD Single : A 1 MET N :NH3+ -168:sc=-0.00137 (180deg=-0.148) USER MOD Single : A 4 LYS NZ :NH3+ 155:sc= -0.0501 (180deg=-0.342) USER MOD Single : A 7 SER OG : rot 180:sc= -0.703 USER MOD Single : A 13 ASN : amide:sc= -1.21 K(o=-1.2,f=-6.3!) USER MOD Single : A 15 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= -1.94! USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -179:sc= 1.25 (180deg=1.18) USER MOD Single : A 29 LYS NZ :NH3+ -125:sc= 1.28 (180deg=-0.298) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= -1.77! USER MOD Single : A 37 THR OG1 : rot 180:sc= -1.93! USER MOD Single : A 43 SER OG : rot -88:sc= 0.979 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.775 USER MOD Single : A 49 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.191) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 1.05 (180deg=1.05) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -92:sc= 1.29 USER MOD Single : A 62 LYS NZ :NH3+ -170:sc= 0.996 (180deg=0.804) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -124:sc= 0.0968 (180deg=-1.86!) USER MOD Single : A 65 ASN : amide:sc= -0.0107 X(o=-0.011,f=-0.081) USER MOD Single : A 72 LYS NZ :NH3+ -166:sc= -0.064 (180deg=-0.343) USER MOD Single : A 75 TYR OH : rot 46:sc= -2.72! USER MOD Single : A 76 THR OG1 : rot 153:sc= 0.831 USER MOD Single : A 78 THR OG1 : rot -14:sc= 1.06 USER MOD Single : A 79 TYR OH : rot 180:sc=-0.00978 USER MOD Single : A 83 ASN : amide:sc= 0.912 K(o=0.91,f=-0.03) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN :FLIP amide:sc= -0.829 F(o=-1.4!,f=-0.83) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc=-0.00796 X(o=-0.008,f=-0.28) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl -162:sc= -0.17 (180deg=-0.971) USER MOD Single : A 123 LYS NZ :NH3+ -168:sc= -0.0152 (180deg=-0.136) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 HIS : no HD1:sc= -0.217 K(o=-0.22,f=-0.87) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 137 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 138 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.061) USER MOD Single : A 139 HIS : no HE2:sc= -0.425 K(o=-0.43,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.066 -9.006 19.619 1.00 0.00 N ATOM 2 CA MET A 1 13.974 -7.840 19.555 1.00 0.00 C ATOM 3 C MET A 1 15.113 -8.110 18.583 1.00 0.00 C ATOM 4 O MET A 1 16.027 -8.883 18.878 1.00 0.00 O ATOM 5 CB MET A 1 14.543 -7.520 20.940 1.00 0.00 C ATOM 6 CG MET A 1 13.487 -7.132 21.962 1.00 0.00 C ATOM 7 SD MET A 1 14.191 -6.742 23.577 1.00 0.00 S ATOM 8 CE MET A 1 14.920 -8.318 24.021 1.00 0.00 C ATOM 0 H1 MET A 1 12.194 -8.740 20.120 1.00 0.00 H new ATOM 0 H2 MET A 1 12.830 -9.316 18.655 1.00 0.00 H new ATOM 0 H3 MET A 1 13.534 -9.783 20.128 1.00 0.00 H new ATOM 0 HA MET A 1 13.400 -6.982 19.205 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.089 -8.389 21.308 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.262 -6.706 20.848 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.931 -6.269 21.595 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.773 -7.949 22.069 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.156 -8.323 25.085 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.215 -9.120 23.802 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.833 -8.471 23.446 1.00 0.00 H new ATOM 20 N GLY A 2 15.043 -7.488 17.418 1.00 0.00 N ATOM 21 CA GLY A 2 16.088 -7.647 16.431 1.00 0.00 C ATOM 22 C GLY A 2 16.710 -6.322 16.055 1.00 0.00 C ATOM 23 O GLY A 2 17.284 -5.638 16.904 1.00 0.00 O ATOM 0 H GLY A 2 14.279 -6.874 17.137 1.00 0.00 H new ATOM 0 HA2 GLY A 2 16.858 -8.313 16.821 1.00 0.00 H new ATOM 0 HA3 GLY A 2 15.677 -8.122 15.540 1.00 0.00 H new ATOM 27 N ASP A 3 16.586 -5.950 14.792 1.00 0.00 N ATOM 28 CA ASP A 3 17.137 -4.687 14.314 1.00 0.00 C ATOM 29 C ASP A 3 16.103 -3.572 14.482 1.00 0.00 C ATOM 30 O ASP A 3 15.066 -3.769 15.123 1.00 0.00 O ATOM 31 CB ASP A 3 17.564 -4.813 12.845 1.00 0.00 C ATOM 32 CG ASP A 3 18.622 -3.795 12.455 1.00 0.00 C ATOM 33 OD1 ASP A 3 18.258 -2.679 12.034 1.00 0.00 O ATOM 34 OD2 ASP A 3 19.823 -4.106 12.578 1.00 0.00 O ATOM 0 H ASP A 3 16.110 -6.501 14.078 1.00 0.00 H new ATOM 0 HA ASP A 3 18.019 -4.438 14.905 1.00 0.00 H new ATOM 0 HB2 ASP A 3 17.948 -5.817 12.667 1.00 0.00 H new ATOM 0 HB3 ASP A 3 16.691 -4.688 12.205 1.00 0.00 H new ATOM 39 N LYS A 4 16.379 -2.407 13.912 1.00 0.00 N ATOM 40 CA LYS A 4 15.488 -1.262 14.037 1.00 0.00 C ATOM 41 C LYS A 4 14.452 -1.280 12.920 1.00 0.00 C ATOM 42 O LYS A 4 14.733 -1.741 11.817 1.00 0.00 O ATOM 43 CB LYS A 4 16.278 0.052 13.988 1.00 0.00 C ATOM 44 CG LYS A 4 17.317 0.215 15.092 1.00 0.00 C ATOM 45 CD LYS A 4 16.702 0.116 16.481 1.00 0.00 C ATOM 46 CE LYS A 4 16.912 -1.263 17.092 1.00 0.00 C ATOM 47 NZ LYS A 4 18.346 -1.524 17.381 1.00 0.00 N ATOM 0 H LYS A 4 17.216 -2.230 13.357 1.00 0.00 H new ATOM 0 HA LYS A 4 14.982 -1.328 15.000 1.00 0.00 H new ATOM 0 HB2 LYS A 4 16.780 0.122 13.023 1.00 0.00 H new ATOM 0 HB3 LYS A 4 15.576 0.884 14.043 1.00 0.00 H new ATOM 0 HG2 LYS A 4 18.085 -0.551 14.981 1.00 0.00 H new ATOM 0 HG3 LYS A 4 17.811 1.180 14.984 1.00 0.00 H new ATOM 0 HD2 LYS A 4 17.144 0.873 17.129 1.00 0.00 H new ATOM 0 HD3 LYS A 4 15.635 0.330 16.423 1.00 0.00 H new ATOM 0 HE2 LYS A 4 16.335 -1.345 18.013 1.00 0.00 H new ATOM 0 HE3 LYS A 4 16.534 -2.025 16.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 18.424 -2.228 18.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 18.812 -1.886 16.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 18.807 -0.640 17.678 1.00 0.00 H new ATOM 61 N GLU A 5 13.259 -0.783 13.209 1.00 0.00 N ATOM 62 CA GLU A 5 12.186 -0.760 12.225 1.00 0.00 C ATOM 63 C GLU A 5 11.936 0.655 11.723 1.00 0.00 C ATOM 64 O GLU A 5 11.472 1.522 12.466 1.00 0.00 O ATOM 65 CB GLU A 5 10.906 -1.378 12.800 1.00 0.00 C ATOM 66 CG GLU A 5 10.627 -1.014 14.247 1.00 0.00 C ATOM 67 CD GLU A 5 9.473 -1.809 14.823 1.00 0.00 C ATOM 68 OE1 GLU A 5 9.555 -3.053 14.836 1.00 0.00 O ATOM 69 OE2 GLU A 5 8.479 -1.193 15.260 1.00 0.00 O ATOM 0 H GLU A 5 13.009 -0.390 14.116 1.00 0.00 H new ATOM 0 HA GLU A 5 12.496 -1.364 11.372 1.00 0.00 H new ATOM 0 HB2 GLU A 5 10.060 -1.063 12.190 1.00 0.00 H new ATOM 0 HB3 GLU A 5 10.972 -2.463 12.718 1.00 0.00 H new ATOM 0 HG2 GLU A 5 11.522 -1.191 14.844 1.00 0.00 H new ATOM 0 HG3 GLU A 5 10.403 0.051 14.316 1.00 0.00 H new ATOM 76 N GLU A 6 12.243 0.871 10.452 1.00 0.00 N ATOM 77 CA GLU A 6 12.138 2.183 9.834 1.00 0.00 C ATOM 78 C GLU A 6 10.953 2.205 8.883 1.00 0.00 C ATOM 79 O GLU A 6 10.550 1.166 8.365 1.00 0.00 O ATOM 80 CB GLU A 6 13.424 2.513 9.074 1.00 0.00 C ATOM 81 CG GLU A 6 14.677 2.441 9.932 1.00 0.00 C ATOM 82 CD GLU A 6 14.702 3.488 11.025 1.00 0.00 C ATOM 83 OE1 GLU A 6 14.123 3.248 12.102 1.00 0.00 O ATOM 84 OE2 GLU A 6 15.312 4.559 10.817 1.00 0.00 O ATOM 0 H GLU A 6 12.572 0.141 9.821 1.00 0.00 H new ATOM 0 HA GLU A 6 11.990 2.932 10.612 1.00 0.00 H new ATOM 0 HB2 GLU A 6 13.528 1.823 8.237 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.340 3.515 8.653 1.00 0.00 H new ATOM 0 HG2 GLU A 6 14.747 1.451 10.382 1.00 0.00 H new ATOM 0 HG3 GLU A 6 15.554 2.565 9.297 1.00 0.00 H new ATOM 91 N SER A 7 10.397 3.381 8.650 1.00 0.00 N ATOM 92 CA SER A 7 9.211 3.502 7.821 1.00 0.00 C ATOM 93 C SER A 7 9.475 4.368 6.593 1.00 0.00 C ATOM 94 O SER A 7 9.811 5.547 6.715 1.00 0.00 O ATOM 95 CB SER A 7 8.070 4.098 8.645 1.00 0.00 C ATOM 96 OG SER A 7 7.925 3.407 9.874 1.00 0.00 O ATOM 0 H SER A 7 10.747 4.264 9.022 1.00 0.00 H new ATOM 0 HA SER A 7 8.934 2.507 7.474 1.00 0.00 H new ATOM 0 HB2 SER A 7 8.266 5.153 8.836 1.00 0.00 H new ATOM 0 HB3 SER A 7 7.140 4.044 8.080 1.00 0.00 H new ATOM 0 HG SER A 7 7.191 3.804 10.388 1.00 0.00 H new ATOM 102 N LYS A 8 9.331 3.779 5.414 1.00 0.00 N ATOM 103 CA LYS A 8 9.404 4.539 4.177 1.00 0.00 C ATOM 104 C LYS A 8 8.044 4.543 3.506 1.00 0.00 C ATOM 105 O LYS A 8 7.502 3.493 3.158 1.00 0.00 O ATOM 106 CB LYS A 8 10.448 3.971 3.210 1.00 0.00 C ATOM 107 CG LYS A 8 10.593 4.819 1.950 1.00 0.00 C ATOM 108 CD LYS A 8 11.501 4.179 0.912 1.00 0.00 C ATOM 109 CE LYS A 8 12.934 4.057 1.398 1.00 0.00 C ATOM 110 NZ LYS A 8 13.845 3.593 0.318 1.00 0.00 N ATOM 0 H LYS A 8 9.164 2.781 5.289 1.00 0.00 H new ATOM 0 HA LYS A 8 9.707 5.555 4.431 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.412 3.908 3.715 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.167 2.955 2.931 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.608 4.984 1.513 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.990 5.798 2.220 1.00 0.00 H new ATOM 0 HD2 LYS A 8 11.120 3.190 0.659 1.00 0.00 H new ATOM 0 HD3 LYS A 8 11.479 4.772 -0.002 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.275 5.023 1.771 1.00 0.00 H new ATOM 0 HE3 LYS A 8 12.976 3.359 2.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.704 3.186 0.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 13.364 2.870 -0.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.104 4.398 -0.287 1.00 0.00 H new ATOM 124 N LYS A 9 7.492 5.726 3.358 1.00 0.00 N ATOM 125 CA LYS A 9 6.226 5.909 2.681 1.00 0.00 C ATOM 126 C LYS A 9 6.503 6.331 1.247 1.00 0.00 C ATOM 127 O LYS A 9 7.451 7.064 1.001 1.00 0.00 O ATOM 128 CB LYS A 9 5.420 6.981 3.424 1.00 0.00 C ATOM 129 CG LYS A 9 3.967 7.114 2.998 1.00 0.00 C ATOM 130 CD LYS A 9 3.249 8.121 3.886 1.00 0.00 C ATOM 131 CE LYS A 9 1.771 8.248 3.550 1.00 0.00 C ATOM 132 NZ LYS A 9 1.014 6.995 3.828 1.00 0.00 N ATOM 0 H LYS A 9 7.908 6.591 3.704 1.00 0.00 H new ATOM 0 HA LYS A 9 5.648 4.985 2.671 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.450 6.760 4.491 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.912 7.944 3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 9 3.913 7.433 1.957 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.472 6.145 3.061 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.356 7.822 4.929 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.726 9.096 3.783 1.00 0.00 H new ATOM 0 HE2 LYS A 9 1.339 9.065 4.127 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.662 8.509 2.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 0.472 6.722 2.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.680 6.234 4.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.361 7.153 4.622 1.00 0.00 H new ATOM 146 N PHE A 10 5.731 5.836 0.298 1.00 0.00 N ATOM 147 CA PHE A 10 5.827 6.327 -1.068 1.00 0.00 C ATOM 148 C PHE A 10 4.434 6.652 -1.568 1.00 0.00 C ATOM 149 O PHE A 10 3.458 6.077 -1.089 1.00 0.00 O ATOM 150 CB PHE A 10 6.543 5.326 -1.996 1.00 0.00 C ATOM 151 CG PHE A 10 5.709 4.165 -2.470 1.00 0.00 C ATOM 152 CD1 PHE A 10 4.846 4.311 -3.548 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.803 2.928 -1.859 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.093 3.248 -4.001 1.00 0.00 C ATOM 155 CE2 PHE A 10 5.050 1.861 -2.308 1.00 0.00 C ATOM 156 CZ PHE A 10 4.195 2.022 -3.383 1.00 0.00 C ATOM 0 H PHE A 10 5.037 5.102 0.443 1.00 0.00 H new ATOM 0 HA PHE A 10 6.436 7.231 -1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 10 6.910 5.866 -2.869 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.415 4.934 -1.473 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.763 5.270 -4.038 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.472 2.795 -1.022 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.424 3.377 -4.839 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.129 0.901 -1.820 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.608 1.187 -3.737 1.00 0.00 H new ATOM 166 N SER A 11 4.332 7.574 -2.508 1.00 0.00 N ATOM 167 CA SER A 11 3.034 8.017 -2.968 1.00 0.00 C ATOM 168 C SER A 11 2.995 8.107 -4.487 1.00 0.00 C ATOM 169 O SER A 11 3.911 8.643 -5.119 1.00 0.00 O ATOM 170 CB SER A 11 2.693 9.373 -2.342 1.00 0.00 C ATOM 171 OG SER A 11 3.424 10.425 -2.952 1.00 0.00 O ATOM 0 H SER A 11 5.126 8.025 -2.963 1.00 0.00 H new ATOM 0 HA SER A 11 2.289 7.285 -2.657 1.00 0.00 H new ATOM 0 HB2 SER A 11 1.625 9.564 -2.444 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.912 9.348 -1.274 1.00 0.00 H new ATOM 0 HG SER A 11 3.072 11.287 -2.648 1.00 0.00 H new ATOM 177 N ALA A 12 1.943 7.563 -5.068 1.00 0.00 N ATOM 178 CA ALA A 12 1.723 7.662 -6.496 1.00 0.00 C ATOM 179 C ALA A 12 0.253 7.925 -6.778 1.00 0.00 C ATOM 180 O ALA A 12 -0.586 7.041 -6.606 1.00 0.00 O ATOM 181 CB ALA A 12 2.182 6.395 -7.199 1.00 0.00 C ATOM 0 H ALA A 12 1.222 7.044 -4.567 1.00 0.00 H new ATOM 0 HA ALA A 12 2.310 8.495 -6.882 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.008 6.490 -8.271 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.246 6.243 -7.016 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.622 5.542 -6.815 1.00 0.00 H new ATOM 187 N ASN A 13 -0.062 9.152 -7.158 1.00 0.00 N ATOM 188 CA ASN A 13 -1.421 9.497 -7.541 1.00 0.00 C ATOM 189 C ASN A 13 -1.643 9.109 -8.991 1.00 0.00 C ATOM 190 O ASN A 13 -1.173 9.782 -9.908 1.00 0.00 O ATOM 191 CB ASN A 13 -1.694 10.994 -7.327 1.00 0.00 C ATOM 192 CG ASN A 13 -3.129 11.404 -7.650 1.00 0.00 C ATOM 193 OD1 ASN A 13 -3.775 10.852 -8.543 1.00 0.00 O ATOM 194 ND2 ASN A 13 -3.648 12.369 -6.907 1.00 0.00 N ATOM 0 H ASN A 13 0.603 9.924 -7.210 1.00 0.00 H new ATOM 0 HA ASN A 13 -2.119 8.947 -6.909 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.476 11.250 -6.290 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.011 11.572 -7.949 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.608 12.675 -7.066 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.088 12.807 -6.175 1.00 0.00 H new ATOM 201 N LEU A 14 -2.329 8.003 -9.195 1.00 0.00 N ATOM 202 CA LEU A 14 -2.609 7.523 -10.532 1.00 0.00 C ATOM 203 C LEU A 14 -4.108 7.517 -10.797 1.00 0.00 C ATOM 204 O LEU A 14 -4.865 6.788 -10.155 1.00 0.00 O ATOM 205 CB LEU A 14 -1.974 6.139 -10.751 1.00 0.00 C ATOM 206 CG LEU A 14 -2.052 5.168 -9.567 1.00 0.00 C ATOM 207 CD1 LEU A 14 -3.268 4.260 -9.683 1.00 0.00 C ATOM 208 CD2 LEU A 14 -0.774 4.349 -9.469 1.00 0.00 C ATOM 0 H LEU A 14 -2.704 7.418 -8.448 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.159 8.204 -11.254 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.456 5.672 -11.610 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.925 6.280 -11.011 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.159 5.753 -8.653 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.298 3.582 -8.830 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -4.174 4.866 -9.697 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -3.204 3.681 -10.605 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.845 3.664 -8.624 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.636 3.779 -10.388 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.076 5.016 -9.325 1.00 0.00 H new ATOM 220 N ASN A 15 -4.529 8.390 -11.710 1.00 0.00 N ATOM 221 CA ASN A 15 -5.931 8.490 -12.126 1.00 0.00 C ATOM 222 C ASN A 15 -6.822 8.954 -10.973 1.00 0.00 C ATOM 223 O ASN A 15 -8.038 8.759 -10.994 1.00 0.00 O ATOM 224 CB ASN A 15 -6.429 7.146 -12.680 1.00 0.00 C ATOM 225 CG ASN A 15 -5.693 6.725 -13.940 1.00 0.00 C ATOM 226 OD1 ASN A 15 -5.247 7.564 -14.725 1.00 0.00 O ATOM 227 ND2 ASN A 15 -5.562 5.422 -14.147 1.00 0.00 N ATOM 0 H ASN A 15 -3.910 9.049 -12.183 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.989 9.237 -12.917 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -6.308 6.376 -11.918 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -7.495 7.218 -12.893 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -5.078 5.084 -14.979 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -5.945 4.758 -13.474 1.00 0.00 H new ATOM 234 N GLY A 16 -6.215 9.590 -9.976 1.00 0.00 N ATOM 235 CA GLY A 16 -6.969 10.066 -8.832 1.00 0.00 C ATOM 236 C GLY A 16 -6.820 9.150 -7.636 1.00 0.00 C ATOM 237 O GLY A 16 -7.244 9.480 -6.529 1.00 0.00 O ATOM 0 H GLY A 16 -5.214 9.784 -9.940 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.631 11.068 -8.566 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.023 10.145 -9.099 1.00 0.00 H new ATOM 241 N THR A 17 -6.227 7.990 -7.862 1.00 0.00 N ATOM 242 CA THR A 17 -5.965 7.054 -6.789 1.00 0.00 C ATOM 243 C THR A 17 -4.567 7.285 -6.230 1.00 0.00 C ATOM 244 O THR A 17 -3.571 6.902 -6.846 1.00 0.00 O ATOM 245 CB THR A 17 -6.101 5.600 -7.281 1.00 0.00 C ATOM 246 OG1 THR A 17 -7.389 5.414 -7.880 1.00 0.00 O ATOM 247 CG2 THR A 17 -5.925 4.612 -6.136 1.00 0.00 C ATOM 0 H THR A 17 -5.918 7.676 -8.782 1.00 0.00 H new ATOM 0 HA THR A 17 -6.701 7.219 -6.002 1.00 0.00 H new ATOM 0 HB THR A 17 -5.318 5.414 -8.016 1.00 0.00 H new ATOM 0 HG1 THR A 17 -7.473 4.489 -8.194 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.026 3.595 -6.514 1.00 0.00 H new ATOM 0 HG22 THR A 17 -4.936 4.738 -5.695 1.00 0.00 H new ATOM 0 HG23 THR A 17 -6.686 4.795 -5.378 1.00 0.00 H new ATOM 255 N GLU A 18 -4.496 7.947 -5.086 1.00 0.00 N ATOM 256 CA GLU A 18 -3.218 8.236 -4.463 1.00 0.00 C ATOM 257 C GLU A 18 -2.781 7.042 -3.630 1.00 0.00 C ATOM 258 O GLU A 18 -3.296 6.813 -2.535 1.00 0.00 O ATOM 259 CB GLU A 18 -3.302 9.489 -3.585 1.00 0.00 C ATOM 260 CG GLU A 18 -4.216 10.567 -4.144 1.00 0.00 C ATOM 261 CD GLU A 18 -3.978 11.923 -3.514 1.00 0.00 C ATOM 262 OE1 GLU A 18 -4.560 12.198 -2.447 1.00 0.00 O ATOM 263 OE2 GLU A 18 -3.218 12.726 -4.092 1.00 0.00 O ATOM 0 H GLU A 18 -5.307 8.293 -4.573 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.484 8.425 -5.246 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.655 9.204 -2.594 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.301 9.902 -3.461 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.067 10.641 -5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.254 10.275 -3.985 1.00 0.00 H new ATOM 270 N ILE A 19 -1.848 6.271 -4.155 1.00 0.00 N ATOM 271 CA ILE A 19 -1.376 5.092 -3.456 1.00 0.00 C ATOM 272 C ILE A 19 -0.193 5.448 -2.581 1.00 0.00 C ATOM 273 O ILE A 19 0.905 5.704 -3.076 1.00 0.00 O ATOM 274 CB ILE A 19 -0.973 3.963 -4.428 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.118 3.665 -5.400 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.587 2.711 -3.651 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.850 2.498 -6.325 1.00 0.00 C ATOM 0 H ILE A 19 -1.404 6.439 -5.058 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.200 4.728 -2.842 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.108 4.289 -5.006 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.023 3.462 -4.828 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.313 4.554 -6.000 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.305 1.922 -4.349 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.255 2.934 -2.996 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.435 2.379 -3.052 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.707 2.350 -6.982 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.964 2.705 -6.925 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.686 1.596 -5.735 1.00 0.00 H new ATOM 289 N ALA A 20 -0.435 5.504 -1.285 1.00 0.00 N ATOM 290 CA ALA A 20 0.604 5.825 -0.331 1.00 0.00 C ATOM 291 C ALA A 20 0.916 4.620 0.539 1.00 0.00 C ATOM 292 O ALA A 20 0.271 4.392 1.564 1.00 0.00 O ATOM 293 CB ALA A 20 0.192 7.013 0.521 1.00 0.00 C ATOM 0 H ALA A 20 -1.350 5.330 -0.869 1.00 0.00 H new ATOM 0 HA ALA A 20 1.508 6.094 -0.878 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.984 7.242 1.234 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.019 7.878 -0.120 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.724 6.773 1.061 1.00 0.00 H new ATOM 299 N ILE A 21 1.897 3.840 0.121 1.00 0.00 N ATOM 300 CA ILE A 21 2.284 2.657 0.864 1.00 0.00 C ATOM 301 C ILE A 21 3.423 2.984 1.817 1.00 0.00 C ATOM 302 O ILE A 21 4.508 3.383 1.396 1.00 0.00 O ATOM 303 CB ILE A 21 2.703 1.495 -0.064 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.552 1.115 -1.004 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.146 0.288 0.758 1.00 0.00 C ATOM 306 CD1 ILE A 21 1.864 -0.065 -1.902 1.00 0.00 C ATOM 0 H ILE A 21 2.438 4.005 -0.727 1.00 0.00 H new ATOM 0 HA ILE A 21 1.410 2.333 1.429 1.00 0.00 H new ATOM 0 HB ILE A 21 3.546 1.825 -0.671 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.669 0.883 -0.408 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.301 1.976 -1.624 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.438 -0.521 0.088 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.995 0.565 1.383 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.322 -0.044 1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.004 -0.275 -2.538 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.727 0.170 -2.525 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.085 -0.939 -1.290 1.00 0.00 H new ATOM 318 N THR A 22 3.150 2.841 3.099 1.00 0.00 N ATOM 319 CA THR A 22 4.141 3.057 4.129 1.00 0.00 C ATOM 320 C THR A 22 4.651 1.712 4.627 1.00 0.00 C ATOM 321 O THR A 22 4.007 1.071 5.459 1.00 0.00 O ATOM 322 CB THR A 22 3.541 3.835 5.319 1.00 0.00 C ATOM 323 OG1 THR A 22 2.668 4.872 4.844 1.00 0.00 O ATOM 324 CG2 THR A 22 4.641 4.448 6.175 1.00 0.00 C ATOM 0 H THR A 22 2.233 2.571 3.454 1.00 0.00 H new ATOM 0 HA THR A 22 4.957 3.641 3.703 1.00 0.00 H new ATOM 0 HB THR A 22 2.972 3.134 5.929 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.194 5.274 5.602 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.194 4.991 7.008 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.285 3.658 6.561 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.233 5.135 5.570 1.00 0.00 H new ATOM 332 N TYR A 23 5.775 1.256 4.102 1.00 0.00 N ATOM 333 CA TYR A 23 6.288 -0.039 4.504 1.00 0.00 C ATOM 334 C TYR A 23 7.396 0.098 5.538 1.00 0.00 C ATOM 335 O TYR A 23 8.324 0.898 5.392 1.00 0.00 O ATOM 336 CB TYR A 23 6.730 -0.890 3.299 1.00 0.00 C ATOM 337 CG TYR A 23 7.690 -0.225 2.334 1.00 0.00 C ATOM 338 CD1 TYR A 23 9.063 -0.296 2.525 1.00 0.00 C ATOM 339 CD2 TYR A 23 7.217 0.452 1.217 1.00 0.00 C ATOM 340 CE1 TYR A 23 9.939 0.294 1.634 1.00 0.00 C ATOM 341 CE2 TYR A 23 8.085 1.045 0.321 1.00 0.00 C ATOM 342 CZ TYR A 23 9.446 0.961 0.534 1.00 0.00 C ATOM 343 OH TYR A 23 10.316 1.553 -0.355 1.00 0.00 O ATOM 0 H TYR A 23 6.339 1.752 3.411 1.00 0.00 H new ATOM 0 HA TYR A 23 5.465 -0.575 4.977 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.196 -1.801 3.674 1.00 0.00 H new ATOM 0 HB3 TYR A 23 5.840 -1.191 2.746 1.00 0.00 H new ATOM 0 HD1 TYR A 23 9.453 -0.821 3.384 1.00 0.00 H new ATOM 0 HD2 TYR A 23 6.152 0.516 1.046 1.00 0.00 H new ATOM 0 HE1 TYR A 23 11.005 0.233 1.799 1.00 0.00 H new ATOM 0 HE2 TYR A 23 7.701 1.571 -0.541 1.00 0.00 H new ATOM 0 HH TYR A 23 9.807 1.981 -1.075 1.00 0.00 H new ATOM 353 N VAL A 24 7.250 -0.670 6.607 1.00 0.00 N ATOM 354 CA VAL A 24 8.208 -0.693 7.693 1.00 0.00 C ATOM 355 C VAL A 24 9.173 -1.848 7.503 1.00 0.00 C ATOM 356 O VAL A 24 8.763 -3.009 7.402 1.00 0.00 O ATOM 357 CB VAL A 24 7.509 -0.822 9.063 1.00 0.00 C ATOM 358 CG1 VAL A 24 8.525 -0.992 10.186 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.633 0.390 9.325 1.00 0.00 C ATOM 0 H VAL A 24 6.457 -1.297 6.743 1.00 0.00 H new ATOM 0 HA VAL A 24 8.753 0.251 7.679 1.00 0.00 H new ATOM 0 HB VAL A 24 6.881 -1.713 9.038 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.003 -1.080 11.139 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.114 -1.892 10.010 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.186 -0.125 10.213 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.147 0.285 10.295 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.247 1.290 9.323 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.875 0.466 8.545 1.00 0.00 H new ATOM 369 N TYR A 25 10.447 -1.524 7.449 1.00 0.00 N ATOM 370 CA TYR A 25 11.474 -2.515 7.222 1.00 0.00 C ATOM 371 C TYR A 25 12.473 -2.516 8.371 1.00 0.00 C ATOM 372 O TYR A 25 12.713 -1.484 9.001 1.00 0.00 O ATOM 373 CB TYR A 25 12.185 -2.246 5.887 1.00 0.00 C ATOM 374 CG TYR A 25 12.816 -0.872 5.779 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.062 0.234 5.404 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.167 -0.683 6.050 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.636 1.487 5.300 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.747 0.567 5.947 1.00 0.00 C ATOM 379 CZ TYR A 25 13.978 1.647 5.574 1.00 0.00 C ATOM 380 OH TYR A 25 14.557 2.891 5.466 1.00 0.00 O ATOM 0 H TYR A 25 10.797 -0.573 7.560 1.00 0.00 H new ATOM 0 HA TYR A 25 11.007 -3.499 7.173 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.959 -3.000 5.743 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.467 -2.367 5.076 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.010 0.112 5.190 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.773 -1.527 6.346 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.037 2.336 5.006 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.798 0.696 6.158 1.00 0.00 H new ATOM 0 HH TYR A 25 15.508 2.830 5.695 1.00 0.00 H new ATOM 390 N LYS A 26 13.037 -3.681 8.643 1.00 0.00 N ATOM 391 CA LYS A 26 14.020 -3.836 9.704 1.00 0.00 C ATOM 392 C LYS A 26 15.267 -4.485 9.123 1.00 0.00 C ATOM 393 O LYS A 26 15.297 -5.694 8.881 1.00 0.00 O ATOM 394 CB LYS A 26 13.445 -4.682 10.851 1.00 0.00 C ATOM 395 CG LYS A 26 12.079 -4.196 11.317 1.00 0.00 C ATOM 396 CD LYS A 26 11.545 -4.976 12.510 1.00 0.00 C ATOM 397 CE LYS A 26 12.288 -4.640 13.792 1.00 0.00 C ATOM 398 NZ LYS A 26 11.449 -4.903 14.991 1.00 0.00 N ATOM 0 H LYS A 26 12.828 -4.542 8.138 1.00 0.00 H new ATOM 0 HA LYS A 26 14.278 -2.859 10.113 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.365 -5.719 10.526 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.138 -4.664 11.692 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.146 -3.140 11.581 1.00 0.00 H new ATOM 0 HG3 LYS A 26 11.371 -4.275 10.492 1.00 0.00 H new ATOM 0 HD2 LYS A 26 10.485 -4.759 12.639 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.630 -6.044 12.312 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.202 -5.230 13.850 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.586 -3.592 13.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.979 -4.647 15.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.580 -4.334 14.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.200 -5.912 15.026 1.00 0.00 H new ATOM 412 N GLY A 27 16.281 -3.670 8.876 1.00 0.00 N ATOM 413 CA GLY A 27 17.433 -4.131 8.130 1.00 0.00 C ATOM 414 C GLY A 27 17.179 -4.050 6.636 1.00 0.00 C ATOM 415 O GLY A 27 16.980 -2.958 6.096 1.00 0.00 O ATOM 0 H GLY A 27 16.327 -2.697 9.179 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.303 -3.528 8.388 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.664 -5.159 8.408 1.00 0.00 H new ATOM 419 N ASP A 28 17.163 -5.199 5.973 1.00 0.00 N ATOM 420 CA ASP A 28 16.860 -5.253 4.545 1.00 0.00 C ATOM 421 C ASP A 28 15.597 -6.067 4.297 1.00 0.00 C ATOM 422 O ASP A 28 15.249 -6.365 3.151 1.00 0.00 O ATOM 423 CB ASP A 28 18.026 -5.839 3.743 1.00 0.00 C ATOM 424 CG ASP A 28 19.164 -4.855 3.563 1.00 0.00 C ATOM 425 OD1 ASP A 28 19.079 -4.004 2.652 1.00 0.00 O ATOM 426 OD2 ASP A 28 20.154 -4.928 4.324 1.00 0.00 O ATOM 0 H ASP A 28 17.356 -6.106 6.398 1.00 0.00 H new ATOM 0 HA ASP A 28 16.698 -4.230 4.207 1.00 0.00 H new ATOM 0 HB2 ASP A 28 18.398 -6.730 4.249 1.00 0.00 H new ATOM 0 HB3 ASP A 28 17.666 -6.155 2.764 1.00 0.00 H new ATOM 431 N LYS A 29 14.912 -6.431 5.371 1.00 0.00 N ATOM 432 CA LYS A 29 13.631 -7.106 5.250 1.00 0.00 C ATOM 433 C LYS A 29 12.512 -6.103 5.467 1.00 0.00 C ATOM 434 O LYS A 29 12.612 -5.248 6.342 1.00 0.00 O ATOM 435 CB LYS A 29 13.482 -8.230 6.281 1.00 0.00 C ATOM 436 CG LYS A 29 12.475 -9.292 5.859 1.00 0.00 C ATOM 437 CD LYS A 29 11.738 -9.901 7.044 1.00 0.00 C ATOM 438 CE LYS A 29 12.684 -10.367 8.138 1.00 0.00 C ATOM 439 NZ LYS A 29 11.985 -11.193 9.157 1.00 0.00 N ATOM 0 H LYS A 29 15.220 -6.271 6.330 1.00 0.00 H new ATOM 0 HA LYS A 29 13.578 -7.541 4.252 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.452 -8.700 6.441 1.00 0.00 H new ATOM 0 HB3 LYS A 29 13.173 -7.803 7.235 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.752 -8.850 5.174 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.992 -10.081 5.312 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.046 -9.166 7.455 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.140 -10.745 6.701 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.495 -10.945 7.695 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.137 -9.501 8.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.140 -10.785 10.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.966 -11.210 8.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 12.359 -12.163 9.134 1.00 0.00 H new ATOM 453 N VAL A 30 11.459 -6.200 4.675 1.00 0.00 N ATOM 454 CA VAL A 30 10.274 -5.395 4.907 1.00 0.00 C ATOM 455 C VAL A 30 9.257 -6.246 5.655 1.00 0.00 C ATOM 456 O VAL A 30 8.905 -7.334 5.203 1.00 0.00 O ATOM 457 CB VAL A 30 9.662 -4.871 3.591 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.614 -3.811 3.880 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.739 -4.322 2.668 1.00 0.00 C ATOM 0 H VAL A 30 11.400 -6.824 3.870 1.00 0.00 H new ATOM 0 HA VAL A 30 10.554 -4.521 5.496 1.00 0.00 H new ATOM 0 HB VAL A 30 9.180 -5.707 3.084 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.192 -3.451 2.942 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.822 -4.240 4.493 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.075 -2.979 4.413 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.280 -3.960 1.748 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.258 -3.501 3.162 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.452 -5.112 2.431 1.00 0.00 H new ATOM 469 N LEU A 31 8.815 -5.771 6.812 1.00 0.00 N ATOM 470 CA LEU A 31 8.003 -6.595 7.701 1.00 0.00 C ATOM 471 C LEU A 31 6.559 -6.120 7.758 1.00 0.00 C ATOM 472 O LEU A 31 5.669 -6.871 8.165 1.00 0.00 O ATOM 473 CB LEU A 31 8.600 -6.624 9.113 1.00 0.00 C ATOM 474 CG LEU A 31 9.976 -7.289 9.232 1.00 0.00 C ATOM 475 CD1 LEU A 31 11.076 -6.372 8.739 1.00 0.00 C ATOM 476 CD2 LEU A 31 10.252 -7.714 10.662 1.00 0.00 C ATOM 0 H LEU A 31 9.002 -4.829 7.156 1.00 0.00 H new ATOM 0 HA LEU A 31 8.007 -7.605 7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.678 -5.600 9.477 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.905 -7.145 9.772 1.00 0.00 H new ATOM 0 HG LEU A 31 9.964 -8.177 8.601 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.039 -6.873 8.837 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.901 -6.124 7.692 1.00 0.00 H new ATOM 0 HD13 LEU A 31 11.081 -5.458 9.333 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.234 -8.183 10.719 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.229 -6.840 11.312 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.491 -8.425 10.983 1.00 0.00 H new ATOM 488 N LYS A 32 6.320 -4.877 7.366 1.00 0.00 N ATOM 489 CA LYS A 32 4.962 -4.349 7.331 1.00 0.00 C ATOM 490 C LYS A 32 4.735 -3.507 6.093 1.00 0.00 C ATOM 491 O LYS A 32 5.381 -2.486 5.904 1.00 0.00 O ATOM 492 CB LYS A 32 4.659 -3.509 8.577 1.00 0.00 C ATOM 493 CG LYS A 32 4.487 -4.322 9.847 1.00 0.00 C ATOM 494 CD LYS A 32 4.176 -3.426 11.035 1.00 0.00 C ATOM 495 CE LYS A 32 3.871 -4.241 12.281 1.00 0.00 C ATOM 496 NZ LYS A 32 3.636 -3.378 13.468 1.00 0.00 N ATOM 0 H LYS A 32 7.041 -4.219 7.070 1.00 0.00 H new ATOM 0 HA LYS A 32 4.288 -5.205 7.309 1.00 0.00 H new ATOM 0 HB2 LYS A 32 5.467 -2.792 8.724 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.750 -2.933 8.401 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.682 -5.045 9.713 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.396 -4.890 10.044 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.023 -2.768 11.228 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.324 -2.788 10.798 1.00 0.00 H new ATOM 0 HE2 LYS A 32 2.991 -4.860 12.103 1.00 0.00 H new ATOM 0 HE3 LYS A 32 4.701 -4.918 12.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.432 -3.974 14.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 4.484 -2.806 13.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.828 -2.750 13.286 1.00 0.00 H new ATOM 510 N GLN A 33 3.807 -3.936 5.261 1.00 0.00 N ATOM 511 CA GLN A 33 3.468 -3.205 4.056 1.00 0.00 C ATOM 512 C GLN A 33 2.113 -2.538 4.228 1.00 0.00 C ATOM 513 O GLN A 33 1.071 -3.148 3.992 1.00 0.00 O ATOM 514 CB GLN A 33 3.462 -4.148 2.849 1.00 0.00 C ATOM 515 CG GLN A 33 3.214 -3.460 1.517 1.00 0.00 C ATOM 516 CD GLN A 33 3.353 -4.411 0.342 1.00 0.00 C ATOM 517 OE1 GLN A 33 4.132 -5.360 0.383 1.00 0.00 O ATOM 518 NE2 GLN A 33 2.591 -4.169 -0.709 1.00 0.00 N ATOM 0 H GLN A 33 3.271 -4.793 5.399 1.00 0.00 H new ATOM 0 HA GLN A 33 4.217 -2.433 3.879 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.420 -4.667 2.804 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.695 -4.908 3.000 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.214 -3.027 1.515 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.918 -2.636 1.400 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.956 -3.371 -0.706 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.637 -4.780 -1.524 1.00 0.00 H new ATOM 527 N SER A 34 2.126 -1.301 4.683 1.00 0.00 N ATOM 528 CA SER A 34 0.894 -0.565 4.869 1.00 0.00 C ATOM 529 C SER A 34 0.506 0.120 3.571 1.00 0.00 C ATOM 530 O SER A 34 1.031 1.174 3.228 1.00 0.00 O ATOM 531 CB SER A 34 1.043 0.462 5.992 1.00 0.00 C ATOM 532 OG SER A 34 1.570 -0.143 7.162 1.00 0.00 O ATOM 0 H SER A 34 2.972 -0.787 4.929 1.00 0.00 H new ATOM 0 HA SER A 34 0.106 -1.263 5.152 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.699 1.269 5.668 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.074 0.909 6.213 1.00 0.00 H new ATOM 0 HG SER A 34 1.659 0.531 7.867 1.00 0.00 H new ATOM 538 N SER A 35 -0.415 -0.486 2.853 1.00 0.00 N ATOM 539 CA SER A 35 -0.844 0.033 1.576 1.00 0.00 C ATOM 540 C SER A 35 -2.116 0.836 1.765 1.00 0.00 C ATOM 541 O SER A 35 -3.213 0.287 1.856 1.00 0.00 O ATOM 542 CB SER A 35 -1.065 -1.118 0.589 1.00 0.00 C ATOM 543 OG SER A 35 -1.885 -2.122 1.157 1.00 0.00 O ATOM 0 H SER A 35 -0.884 -1.346 3.137 1.00 0.00 H new ATOM 0 HA SER A 35 -0.073 0.686 1.166 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.528 -0.737 -0.322 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.104 -1.546 0.303 1.00 0.00 H new ATOM 0 HG SER A 35 -2.013 -2.845 0.508 1.00 0.00 H new ATOM 549 N GLU A 36 -1.943 2.139 1.876 1.00 0.00 N ATOM 550 CA GLU A 36 -3.037 3.042 2.152 1.00 0.00 C ATOM 551 C GLU A 36 -3.377 3.848 0.901 1.00 0.00 C ATOM 552 O GLU A 36 -2.641 4.750 0.494 1.00 0.00 O ATOM 553 CB GLU A 36 -2.637 3.924 3.334 1.00 0.00 C ATOM 554 CG GLU A 36 -3.523 5.129 3.584 1.00 0.00 C ATOM 555 CD GLU A 36 -3.050 5.931 4.781 1.00 0.00 C ATOM 556 OE1 GLU A 36 -2.204 6.836 4.606 1.00 0.00 O ATOM 557 OE2 GLU A 36 -3.511 5.647 5.907 1.00 0.00 O ATOM 0 H GLU A 36 -1.038 2.599 1.777 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.941 2.496 2.421 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.627 3.310 4.235 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -1.617 4.273 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.531 5.765 2.699 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -4.549 4.799 3.749 1.00 0.00 H new ATOM 564 N THR A 37 -4.476 3.471 0.273 1.00 0.00 N ATOM 565 CA THR A 37 -4.902 4.069 -0.979 1.00 0.00 C ATOM 566 C THR A 37 -5.934 5.168 -0.755 1.00 0.00 C ATOM 567 O THR A 37 -7.055 4.903 -0.321 1.00 0.00 O ATOM 568 CB THR A 37 -5.494 2.995 -1.911 1.00 0.00 C ATOM 569 OG1 THR A 37 -6.222 2.030 -1.145 1.00 0.00 O ATOM 570 CG2 THR A 37 -4.399 2.301 -2.704 1.00 0.00 C ATOM 0 H THR A 37 -5.099 2.741 0.617 1.00 0.00 H new ATOM 0 HA THR A 37 -4.022 4.514 -1.443 1.00 0.00 H new ATOM 0 HB THR A 37 -6.169 3.486 -2.612 1.00 0.00 H new ATOM 0 HG1 THR A 37 -6.597 1.351 -1.745 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.843 1.547 -3.354 1.00 0.00 H new ATOM 0 HG22 THR A 37 -3.867 3.035 -3.309 1.00 0.00 H new ATOM 0 HG23 THR A 37 -3.700 1.822 -2.018 1.00 0.00 H new ATOM 578 N LYS A 38 -5.543 6.400 -1.045 1.00 0.00 N ATOM 579 CA LYS A 38 -6.450 7.531 -0.963 1.00 0.00 C ATOM 580 C LYS A 38 -7.188 7.685 -2.287 1.00 0.00 C ATOM 581 O LYS A 38 -6.756 8.409 -3.186 1.00 0.00 O ATOM 582 CB LYS A 38 -5.686 8.808 -0.593 1.00 0.00 C ATOM 583 CG LYS A 38 -6.553 10.056 -0.502 1.00 0.00 C ATOM 584 CD LYS A 38 -5.809 11.173 0.209 1.00 0.00 C ATOM 585 CE LYS A 38 -6.574 12.490 0.202 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.617 13.118 -1.147 1.00 0.00 N ATOM 0 H LYS A 38 -4.597 6.641 -1.341 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.184 7.353 -0.177 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.189 8.655 0.365 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -4.904 8.977 -1.334 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -6.838 10.381 -1.503 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.474 9.827 0.033 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.616 10.876 1.240 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -4.840 11.319 -0.268 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.592 12.317 0.551 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.109 13.180 0.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.964 14.095 -1.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.662 13.124 -1.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.255 12.575 -1.763 1.00 0.00 H new ATOM 600 N ILE A 39 -8.288 6.964 -2.406 1.00 0.00 N ATOM 601 CA ILE A 39 -9.051 6.920 -3.638 1.00 0.00 C ATOM 602 C ILE A 39 -10.051 8.061 -3.679 1.00 0.00 C ATOM 603 O ILE A 39 -10.973 8.118 -2.865 1.00 0.00 O ATOM 604 CB ILE A 39 -9.806 5.580 -3.781 1.00 0.00 C ATOM 605 CG1 ILE A 39 -8.845 4.404 -3.582 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.482 5.494 -5.145 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.525 3.051 -3.583 1.00 0.00 C ATOM 0 H ILE A 39 -8.676 6.395 -1.654 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.347 7.017 -4.465 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.576 5.530 -3.011 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.094 4.423 -4.372 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.317 4.534 -2.637 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.010 4.544 -5.230 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.192 6.314 -5.252 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.728 5.562 -5.930 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.780 2.269 -3.437 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.256 3.011 -2.776 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.029 2.898 -4.537 1.00 0.00 H new ATOM 619 N GLN A 40 -9.852 8.984 -4.606 1.00 0.00 N ATOM 620 CA GLN A 40 -10.790 10.077 -4.778 1.00 0.00 C ATOM 621 C GLN A 40 -12.065 9.544 -5.424 1.00 0.00 C ATOM 622 O GLN A 40 -12.012 8.637 -6.257 1.00 0.00 O ATOM 623 CB GLN A 40 -10.181 11.194 -5.636 1.00 0.00 C ATOM 624 CG GLN A 40 -8.873 11.767 -5.090 1.00 0.00 C ATOM 625 CD GLN A 40 -8.944 12.127 -3.616 1.00 0.00 C ATOM 626 OE1 GLN A 40 -8.480 11.229 -2.757 1.00 0.00 O flip ATOM 627 NE2 GLN A 40 -9.363 13.221 -3.252 1.00 0.00 N flip ATOM 0 H GLN A 40 -9.057 8.997 -5.245 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.025 10.501 -3.802 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.004 10.809 -6.640 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -10.907 12.002 -5.728 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.075 11.040 -5.241 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -8.607 12.656 -5.662 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -9.713 13.888 -3.940 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.362 13.464 -2.261 1.00 0.00 H new ATOM 636 N PHE A 41 -13.208 10.097 -5.036 1.00 0.00 N ATOM 637 CA PHE A 41 -14.500 9.640 -5.550 1.00 0.00 C ATOM 638 C PHE A 41 -14.604 9.828 -7.061 1.00 0.00 C ATOM 639 O PHE A 41 -15.404 9.165 -7.721 1.00 0.00 O ATOM 640 CB PHE A 41 -15.648 10.370 -4.849 1.00 0.00 C ATOM 641 CG PHE A 41 -16.062 9.759 -3.536 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.192 8.956 -2.815 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.331 9.986 -3.028 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.580 8.395 -1.612 1.00 0.00 C ATOM 645 CE2 PHE A 41 -17.724 9.427 -1.827 1.00 0.00 C ATOM 646 CZ PHE A 41 -16.847 8.631 -1.118 1.00 0.00 C ATOM 0 H PHE A 41 -13.270 10.864 -4.366 1.00 0.00 H new ATOM 0 HA PHE A 41 -14.575 8.573 -5.339 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.354 11.405 -4.678 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.511 10.390 -5.515 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.200 8.766 -3.197 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.022 10.608 -3.578 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -14.892 7.773 -1.059 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -18.716 9.613 -1.443 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.152 8.194 -0.179 1.00 0.00 H new ATOM 656 N ALA A 42 -13.788 10.724 -7.604 1.00 0.00 N ATOM 657 CA ALA A 42 -13.750 10.958 -9.042 1.00 0.00 C ATOM 658 C ALA A 42 -13.250 9.721 -9.791 1.00 0.00 C ATOM 659 O ALA A 42 -13.648 9.475 -10.928 1.00 0.00 O ATOM 660 CB ALA A 42 -12.868 12.158 -9.359 1.00 0.00 C ATOM 0 H ALA A 42 -13.142 11.302 -7.067 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.766 11.167 -9.376 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -12.849 12.321 -10.437 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.267 13.044 -8.865 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -11.855 11.969 -9.003 1.00 0.00 H new ATOM 666 N SER A 43 -12.388 8.941 -9.142 1.00 0.00 N ATOM 667 CA SER A 43 -11.813 7.751 -9.758 1.00 0.00 C ATOM 668 C SER A 43 -12.831 6.612 -9.798 1.00 0.00 C ATOM 669 O SER A 43 -12.969 5.921 -10.809 1.00 0.00 O ATOM 670 CB SER A 43 -10.564 7.314 -8.986 1.00 0.00 C ATOM 671 OG SER A 43 -9.671 8.400 -8.818 1.00 0.00 O ATOM 0 H SER A 43 -12.073 9.114 -8.187 1.00 0.00 H new ATOM 0 HA SER A 43 -11.534 7.995 -10.783 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.853 6.921 -8.011 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.065 6.506 -9.521 1.00 0.00 H new ATOM 0 HG SER A 43 -9.067 8.449 -9.588 1.00 0.00 H new ATOM 677 N ILE A 44 -13.546 6.423 -8.695 1.00 0.00 N ATOM 678 CA ILE A 44 -14.555 5.374 -8.619 1.00 0.00 C ATOM 679 C ILE A 44 -15.805 5.774 -9.398 1.00 0.00 C ATOM 680 O ILE A 44 -16.502 4.926 -9.959 1.00 0.00 O ATOM 681 CB ILE A 44 -14.917 5.033 -7.150 1.00 0.00 C ATOM 682 CG1 ILE A 44 -16.024 3.975 -7.099 1.00 0.00 C ATOM 683 CG2 ILE A 44 -15.333 6.281 -6.386 1.00 0.00 C ATOM 684 CD1 ILE A 44 -16.441 3.597 -5.696 1.00 0.00 C ATOM 0 H ILE A 44 -13.447 6.979 -7.846 1.00 0.00 H new ATOM 0 HA ILE A 44 -14.131 4.477 -9.072 1.00 0.00 H new ATOM 0 HB ILE A 44 -14.028 4.625 -6.670 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.895 4.347 -7.639 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -15.683 3.080 -7.620 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.581 6.013 -5.359 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.512 6.998 -6.386 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -16.204 6.728 -6.865 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -17.228 2.844 -5.741 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -15.583 3.194 -5.158 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -16.813 4.480 -5.177 1.00 0.00 H new ATOM 696 N GLY A 45 -16.058 7.073 -9.456 1.00 0.00 N ATOM 697 CA GLY A 45 -17.222 7.569 -10.155 1.00 0.00 C ATOM 698 C GLY A 45 -18.413 7.698 -9.238 1.00 0.00 C ATOM 699 O GLY A 45 -19.552 7.470 -9.644 1.00 0.00 O ATOM 0 H GLY A 45 -15.475 7.793 -9.030 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -16.995 8.540 -10.595 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.467 6.896 -10.977 1.00 0.00 H new ATOM 703 N ALA A 46 -18.148 8.052 -7.993 1.00 0.00 N ATOM 704 CA ALA A 46 -19.202 8.225 -7.008 1.00 0.00 C ATOM 705 C ALA A 46 -19.165 9.632 -6.422 1.00 0.00 C ATOM 706 O ALA A 46 -18.166 10.337 -6.542 1.00 0.00 O ATOM 707 CB ALA A 46 -19.075 7.186 -5.903 1.00 0.00 C ATOM 0 H ALA A 46 -17.208 8.226 -7.639 1.00 0.00 H new ATOM 0 HA ALA A 46 -20.161 8.085 -7.506 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.872 7.331 -5.174 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -19.152 6.187 -6.332 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -18.109 7.295 -5.410 1.00 0.00 H new ATOM 713 N THR A 47 -20.261 10.038 -5.805 1.00 0.00 N ATOM 714 CA THR A 47 -20.330 11.330 -5.140 1.00 0.00 C ATOM 715 C THR A 47 -20.833 11.155 -3.707 1.00 0.00 C ATOM 716 O THR A 47 -20.434 11.881 -2.794 1.00 0.00 O ATOM 717 CB THR A 47 -21.249 12.306 -5.909 1.00 0.00 C ATOM 718 OG1 THR A 47 -20.835 12.383 -7.283 1.00 0.00 O ATOM 719 CG2 THR A 47 -21.214 13.696 -5.293 1.00 0.00 C ATOM 0 H THR A 47 -21.119 9.490 -5.750 1.00 0.00 H new ATOM 0 HA THR A 47 -19.326 11.755 -5.120 1.00 0.00 H new ATOM 0 HB THR A 47 -22.269 11.927 -5.849 1.00 0.00 H new ATOM 0 HG1 THR A 47 -21.421 13.001 -7.767 1.00 0.00 H new ATOM 0 HG21 THR A 47 -21.870 14.360 -5.856 1.00 0.00 H new ATOM 0 HG22 THR A 47 -21.552 13.644 -4.258 1.00 0.00 H new ATOM 0 HG23 THR A 47 -20.195 14.082 -5.323 1.00 0.00 H new ATOM 727 N THR A 48 -21.696 10.168 -3.514 1.00 0.00 N ATOM 728 CA THR A 48 -22.226 9.860 -2.201 1.00 0.00 C ATOM 729 C THR A 48 -21.390 8.782 -1.514 1.00 0.00 C ATOM 730 O THR A 48 -20.838 7.895 -2.170 1.00 0.00 O ATOM 731 CB THR A 48 -23.691 9.409 -2.306 1.00 0.00 C ATOM 732 OG1 THR A 48 -23.863 8.615 -3.486 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.624 10.610 -2.350 1.00 0.00 C ATOM 0 H THR A 48 -22.044 9.565 -4.259 1.00 0.00 H new ATOM 0 HA THR A 48 -22.179 10.766 -1.597 1.00 0.00 H new ATOM 0 HB THR A 48 -23.938 8.816 -1.426 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.797 8.326 -3.552 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.656 10.267 -2.424 1.00 0.00 H new ATOM 0 HG22 THR A 48 -24.502 11.199 -1.441 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.383 11.226 -3.216 1.00 0.00 H new ATOM 741 N LYS A 49 -21.312 8.866 -0.194 1.00 0.00 N ATOM 742 CA LYS A 49 -20.453 7.997 0.600 1.00 0.00 C ATOM 743 C LYS A 49 -20.844 6.521 0.461 1.00 0.00 C ATOM 744 O LYS A 49 -19.979 5.657 0.304 1.00 0.00 O ATOM 745 CB LYS A 49 -20.501 8.466 2.065 1.00 0.00 C ATOM 746 CG LYS A 49 -19.806 7.560 3.076 1.00 0.00 C ATOM 747 CD LYS A 49 -20.758 6.516 3.646 1.00 0.00 C ATOM 748 CE LYS A 49 -22.010 7.158 4.231 1.00 0.00 C ATOM 749 NZ LYS A 49 -22.983 6.142 4.709 1.00 0.00 N ATOM 0 H LYS A 49 -21.843 9.539 0.358 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.430 8.069 0.230 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -20.051 9.457 2.124 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -21.545 8.572 2.359 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.963 7.061 2.598 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -19.401 8.164 3.888 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -21.041 5.814 2.862 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -20.248 5.941 4.419 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -21.731 7.810 5.058 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -22.483 7.786 3.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -23.930 6.567 4.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -23.001 5.340 4.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -22.699 5.806 5.652 1.00 0.00 H new ATOM 763 N GLU A 50 -22.139 6.233 0.485 1.00 0.00 N ATOM 764 CA GLU A 50 -22.601 4.846 0.457 1.00 0.00 C ATOM 765 C GLU A 50 -22.577 4.276 -0.958 1.00 0.00 C ATOM 766 O GLU A 50 -22.570 3.059 -1.140 1.00 0.00 O ATOM 767 CB GLU A 50 -24.000 4.694 1.068 1.00 0.00 C ATOM 768 CG GLU A 50 -25.043 5.651 0.516 1.00 0.00 C ATOM 769 CD GLU A 50 -24.925 7.037 1.104 1.00 0.00 C ATOM 770 OE1 GLU A 50 -25.387 7.243 2.241 1.00 0.00 O ATOM 771 OE2 GLU A 50 -24.355 7.922 0.436 1.00 0.00 O ATOM 0 H GLU A 50 -22.883 6.930 0.523 1.00 0.00 H new ATOM 0 HA GLU A 50 -21.904 4.274 1.070 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.343 3.672 0.906 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -23.928 4.839 2.146 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.940 5.710 -0.568 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -26.038 5.256 0.721 1.00 0.00 H new ATOM 778 N ASP A 51 -22.557 5.144 -1.960 1.00 0.00 N ATOM 779 CA ASP A 51 -22.469 4.688 -3.344 1.00 0.00 C ATOM 780 C ASP A 51 -21.045 4.290 -3.683 1.00 0.00 C ATOM 781 O ASP A 51 -20.807 3.516 -4.609 1.00 0.00 O ATOM 782 CB ASP A 51 -22.969 5.752 -4.318 1.00 0.00 C ATOM 783 CG ASP A 51 -24.469 5.694 -4.509 1.00 0.00 C ATOM 784 OD1 ASP A 51 -25.162 5.081 -3.666 1.00 0.00 O ATOM 785 OD2 ASP A 51 -24.965 6.244 -5.515 1.00 0.00 O ATOM 0 H ASP A 51 -22.600 6.157 -1.845 1.00 0.00 H new ATOM 0 HA ASP A 51 -23.113 3.815 -3.445 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -22.689 6.739 -3.950 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -22.477 5.620 -5.281 1.00 0.00 H new ATOM 790 N ALA A 52 -20.098 4.823 -2.925 1.00 0.00 N ATOM 791 CA ALA A 52 -18.713 4.412 -3.049 1.00 0.00 C ATOM 792 C ALA A 52 -18.493 3.123 -2.274 1.00 0.00 C ATOM 793 O ALA A 52 -17.770 2.229 -2.719 1.00 0.00 O ATOM 794 CB ALA A 52 -17.783 5.506 -2.550 1.00 0.00 C ATOM 0 H ALA A 52 -20.266 5.540 -2.219 1.00 0.00 H new ATOM 0 HA ALA A 52 -18.487 4.235 -4.101 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.748 5.178 -2.651 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.936 6.411 -3.139 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.996 5.715 -1.502 1.00 0.00 H new ATOM 800 N ALA A 53 -19.149 3.030 -1.121 1.00 0.00 N ATOM 801 CA ALA A 53 -19.059 1.852 -0.271 1.00 0.00 C ATOM 802 C ALA A 53 -19.515 0.600 -1.011 1.00 0.00 C ATOM 803 O ALA A 53 -18.912 -0.463 -0.872 1.00 0.00 O ATOM 804 CB ALA A 53 -19.880 2.049 0.994 1.00 0.00 C ATOM 0 H ALA A 53 -19.753 3.765 -0.753 1.00 0.00 H new ATOM 0 HA ALA A 53 -18.013 1.716 0.005 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.803 1.160 1.620 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.502 2.912 1.542 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.924 2.216 0.728 1.00 0.00 H new ATOM 810 N LYS A 54 -20.564 0.745 -1.817 1.00 0.00 N ATOM 811 CA LYS A 54 -21.096 -0.366 -2.608 1.00 0.00 C ATOM 812 C LYS A 54 -19.998 -1.058 -3.418 1.00 0.00 C ATOM 813 O LYS A 54 -20.025 -2.274 -3.609 1.00 0.00 O ATOM 814 CB LYS A 54 -22.179 0.136 -3.567 1.00 0.00 C ATOM 815 CG LYS A 54 -23.434 0.647 -2.880 1.00 0.00 C ATOM 816 CD LYS A 54 -24.430 1.193 -3.891 1.00 0.00 C ATOM 817 CE LYS A 54 -25.712 1.661 -3.220 1.00 0.00 C ATOM 818 NZ LYS A 54 -25.473 2.782 -2.274 1.00 0.00 N ATOM 0 H LYS A 54 -21.066 1.624 -1.941 1.00 0.00 H new ATOM 0 HA LYS A 54 -21.521 -1.087 -1.909 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -21.763 0.936 -4.180 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.453 -0.674 -4.243 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -23.895 -0.160 -2.311 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -23.169 1.428 -2.168 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -23.979 2.024 -4.434 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -24.664 0.422 -4.625 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -26.425 1.976 -3.982 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -26.166 0.827 -2.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -26.374 3.068 -1.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -24.813 2.475 -1.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.064 3.589 -2.788 1.00 0.00 H new ATOM 832 N THR A 55 -19.034 -0.279 -3.882 1.00 0.00 N ATOM 833 CA THR A 55 -17.991 -0.797 -4.748 1.00 0.00 C ATOM 834 C THR A 55 -16.721 -1.151 -3.963 1.00 0.00 C ATOM 835 O THR A 55 -16.028 -2.115 -4.292 1.00 0.00 O ATOM 836 CB THR A 55 -17.655 0.231 -5.845 1.00 0.00 C ATOM 837 OG1 THR A 55 -18.870 0.728 -6.429 1.00 0.00 O ATOM 838 CG2 THR A 55 -16.788 -0.388 -6.930 1.00 0.00 C ATOM 0 H THR A 55 -18.954 0.716 -3.672 1.00 0.00 H new ATOM 0 HA THR A 55 -18.368 -1.712 -5.205 1.00 0.00 H new ATOM 0 HB THR A 55 -17.100 1.050 -5.387 1.00 0.00 H new ATOM 0 HG1 THR A 55 -18.654 1.383 -7.125 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.567 0.361 -7.691 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.856 -0.746 -6.491 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.318 -1.224 -7.387 1.00 0.00 H new ATOM 846 N LEU A 56 -16.433 -0.395 -2.910 1.00 0.00 N ATOM 847 CA LEU A 56 -15.164 -0.544 -2.200 1.00 0.00 C ATOM 848 C LEU A 56 -15.238 -1.576 -1.074 1.00 0.00 C ATOM 849 O LEU A 56 -14.226 -2.169 -0.715 1.00 0.00 O ATOM 850 CB LEU A 56 -14.693 0.798 -1.643 1.00 0.00 C ATOM 851 CG LEU A 56 -14.575 1.925 -2.670 1.00 0.00 C ATOM 852 CD1 LEU A 56 -14.154 3.219 -1.991 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.586 1.551 -3.766 1.00 0.00 C ATOM 0 H LEU A 56 -17.052 0.321 -2.530 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.442 -0.907 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -15.385 1.112 -0.861 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.721 0.656 -1.170 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.552 2.076 -3.128 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -14.074 4.011 -2.735 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.898 3.496 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -13.188 3.078 -1.507 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.516 2.366 -4.487 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.605 1.371 -3.325 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.928 0.648 -4.272 1.00 0.00 H new ATOM 865 N GLU A 57 -16.420 -1.801 -0.516 1.00 0.00 N ATOM 866 CA GLU A 57 -16.566 -2.799 0.548 1.00 0.00 C ATOM 867 C GLU A 57 -16.162 -4.203 0.068 1.00 0.00 C ATOM 868 O GLU A 57 -15.362 -4.873 0.725 1.00 0.00 O ATOM 869 CB GLU A 57 -17.988 -2.809 1.114 1.00 0.00 C ATOM 870 CG GLU A 57 -18.309 -1.585 1.953 1.00 0.00 C ATOM 871 CD GLU A 57 -19.665 -1.668 2.621 1.00 0.00 C ATOM 872 OE1 GLU A 57 -19.853 -2.550 3.484 1.00 0.00 O ATOM 873 OE2 GLU A 57 -20.550 -0.853 2.295 1.00 0.00 O ATOM 0 H GLU A 57 -17.281 -1.318 -0.773 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.886 -2.512 1.350 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.699 -2.873 0.290 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -18.123 -3.703 1.722 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -17.541 -1.462 2.716 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -18.275 -0.698 1.320 1.00 0.00 H new ATOM 880 N PRO A 58 -16.698 -4.680 -1.079 1.00 0.00 N ATOM 881 CA PRO A 58 -16.280 -5.962 -1.665 1.00 0.00 C ATOM 882 C PRO A 58 -14.847 -5.915 -2.201 1.00 0.00 C ATOM 883 O PRO A 58 -14.271 -6.940 -2.568 1.00 0.00 O ATOM 884 CB PRO A 58 -17.275 -6.182 -2.810 1.00 0.00 C ATOM 885 CG PRO A 58 -17.774 -4.823 -3.152 1.00 0.00 C ATOM 886 CD PRO A 58 -17.772 -4.044 -1.868 1.00 0.00 C ATOM 0 HA PRO A 58 -16.283 -6.764 -0.927 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -16.793 -6.653 -3.667 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.091 -6.837 -2.504 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.135 -4.349 -3.897 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.777 -4.871 -3.577 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.571 -2.987 -2.041 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.734 -4.106 -1.359 1.00 0.00 H new ATOM 894 N LEU A 59 -14.280 -4.715 -2.248 1.00 0.00 N ATOM 895 CA LEU A 59 -12.898 -4.526 -2.670 1.00 0.00 C ATOM 896 C LEU A 59 -11.949 -4.948 -1.553 1.00 0.00 C ATOM 897 O LEU A 59 -11.051 -5.767 -1.758 1.00 0.00 O ATOM 898 CB LEU A 59 -12.654 -3.057 -3.035 1.00 0.00 C ATOM 899 CG LEU A 59 -11.225 -2.700 -3.444 1.00 0.00 C ATOM 900 CD1 LEU A 59 -10.930 -3.205 -4.842 1.00 0.00 C ATOM 901 CD2 LEU A 59 -11.002 -1.197 -3.356 1.00 0.00 C ATOM 0 H LEU A 59 -14.762 -3.852 -1.997 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.711 -5.144 -3.548 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.323 -2.790 -3.853 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.932 -2.439 -2.181 1.00 0.00 H new ATOM 0 HG LEU A 59 -10.538 -3.187 -2.752 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -9.908 -2.942 -5.116 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -11.045 -4.289 -4.869 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.624 -2.749 -5.548 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -9.979 -0.963 -3.651 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.698 -0.686 -4.022 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.169 -0.864 -2.332 1.00 0.00 H new ATOM 913 N SER A 60 -12.170 -4.393 -0.371 1.00 0.00 N ATOM 914 CA SER A 60 -11.339 -4.674 0.792 1.00 0.00 C ATOM 915 C SER A 60 -11.487 -6.127 1.237 1.00 0.00 C ATOM 916 O SER A 60 -10.531 -6.749 1.699 1.00 0.00 O ATOM 917 CB SER A 60 -11.743 -3.737 1.924 1.00 0.00 C ATOM 918 OG SER A 60 -12.011 -2.443 1.422 1.00 0.00 O ATOM 0 H SER A 60 -12.929 -3.736 -0.190 1.00 0.00 H new ATOM 0 HA SER A 60 -10.294 -4.513 0.528 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.626 -4.128 2.430 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.946 -3.688 2.666 1.00 0.00 H new ATOM 0 HG SER A 60 -11.197 -1.900 1.467 1.00 0.00 H new ATOM 924 N ALA A 61 -12.689 -6.672 1.054 1.00 0.00 N ATOM 925 CA ALA A 61 -13.010 -8.029 1.496 1.00 0.00 C ATOM 926 C ALA A 61 -12.202 -9.095 0.754 1.00 0.00 C ATOM 927 O ALA A 61 -12.316 -10.286 1.049 1.00 0.00 O ATOM 928 CB ALA A 61 -14.498 -8.289 1.324 1.00 0.00 C ATOM 0 H ALA A 61 -13.463 -6.189 0.598 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.740 -8.099 2.550 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.731 -9.301 1.655 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.064 -7.573 1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.767 -8.180 0.274 1.00 0.00 H new ATOM 934 N LYS A 62 -11.382 -8.673 -0.200 1.00 0.00 N ATOM 935 CA LYS A 62 -10.583 -9.607 -0.977 1.00 0.00 C ATOM 936 C LYS A 62 -9.327 -10.031 -0.220 1.00 0.00 C ATOM 937 O LYS A 62 -8.693 -11.024 -0.575 1.00 0.00 O ATOM 938 CB LYS A 62 -10.232 -9.014 -2.343 1.00 0.00 C ATOM 939 CG LYS A 62 -11.448 -8.823 -3.234 1.00 0.00 C ATOM 940 CD LYS A 62 -11.065 -8.337 -4.622 1.00 0.00 C ATOM 941 CE LYS A 62 -12.270 -8.303 -5.549 1.00 0.00 C ATOM 942 NZ LYS A 62 -13.285 -7.301 -5.122 1.00 0.00 N ATOM 0 H LYS A 62 -11.254 -7.693 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.182 -10.503 -1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.738 -8.053 -2.200 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.519 -9.668 -2.845 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.989 -9.766 -3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -12.126 -8.105 -2.773 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.629 -7.341 -4.553 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.300 -8.991 -5.040 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.940 -8.073 -6.562 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.729 -9.291 -5.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.155 -7.430 -5.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.497 -7.430 -4.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.913 -6.342 -5.278 1.00 0.00 H new ATOM 956 N TYR A 63 -8.974 -9.290 0.828 1.00 0.00 N ATOM 957 CA TYR A 63 -7.887 -9.714 1.703 1.00 0.00 C ATOM 958 C TYR A 63 -8.452 -10.658 2.755 1.00 0.00 C ATOM 959 O TYR A 63 -8.044 -11.812 2.865 1.00 0.00 O ATOM 960 CB TYR A 63 -7.225 -8.508 2.386 1.00 0.00 C ATOM 961 CG TYR A 63 -6.613 -7.507 1.429 1.00 0.00 C ATOM 962 CD1 TYR A 63 -7.390 -6.526 0.823 1.00 0.00 C ATOM 963 CD2 TYR A 63 -5.258 -7.545 1.131 1.00 0.00 C ATOM 964 CE1 TYR A 63 -6.831 -5.611 -0.050 1.00 0.00 C ATOM 965 CE2 TYR A 63 -4.691 -6.633 0.261 1.00 0.00 C ATOM 966 CZ TYR A 63 -5.482 -5.671 -0.329 1.00 0.00 C ATOM 967 OH TYR A 63 -4.923 -4.758 -1.195 1.00 0.00 O ATOM 0 H TYR A 63 -9.417 -8.409 1.088 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.126 -10.220 1.108 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.969 -7.999 2.999 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.449 -8.869 3.061 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.447 -6.478 1.038 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -4.636 -8.301 1.587 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.448 -4.853 -0.511 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -3.634 -6.674 0.045 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.963 -4.936 -1.284 1.00 0.00 H new ATOM 977 N LYS A 64 -9.428 -10.154 3.497 1.00 0.00 N ATOM 978 CA LYS A 64 -10.217 -10.957 4.427 1.00 0.00 C ATOM 979 C LYS A 64 -9.324 -11.698 5.429 1.00 0.00 C ATOM 980 O LYS A 64 -9.470 -12.901 5.657 1.00 0.00 O ATOM 981 CB LYS A 64 -11.110 -11.918 3.630 1.00 0.00 C ATOM 982 CG LYS A 64 -12.150 -12.663 4.456 1.00 0.00 C ATOM 983 CD LYS A 64 -13.249 -13.268 3.585 1.00 0.00 C ATOM 984 CE LYS A 64 -12.694 -14.000 2.365 1.00 0.00 C ATOM 985 NZ LYS A 64 -12.516 -13.091 1.194 1.00 0.00 N ATOM 0 H LYS A 64 -9.698 -9.171 3.472 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.854 -10.299 5.018 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.623 -11.353 2.852 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.475 -12.648 3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.662 -13.454 5.025 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -12.596 -11.980 5.179 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -13.841 -13.962 4.182 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.922 -12.477 3.255 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -11.736 -14.453 2.620 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.368 -14.812 2.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -13.043 -13.466 0.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.874 -12.144 1.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.506 -13.028 0.953 1.00 0.00 H new ATOM 999 N ASN A 65 -8.403 -10.943 6.025 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.503 -11.443 7.070 1.00 0.00 C ATOM 1001 C ASN A 65 -6.795 -12.737 6.658 1.00 0.00 C ATOM 1002 O ASN A 65 -6.951 -13.781 7.290 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.260 -11.644 8.390 1.00 0.00 C ATOM 1004 CG ASN A 65 -7.328 -11.817 9.575 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -6.975 -12.936 9.957 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -6.920 -10.709 10.168 1.00 0.00 N ATOM 0 H ASN A 65 -8.257 -9.960 5.797 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.734 -10.685 7.215 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -8.911 -10.787 8.566 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.903 -12.520 8.307 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -6.292 -10.761 10.970 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.233 -9.801 9.824 1.00 0.00 H new ATOM 1013 N ILE A 66 -6.042 -12.666 5.573 1.00 0.00 N ATOM 1014 CA ILE A 66 -5.190 -13.777 5.144 1.00 0.00 C ATOM 1015 C ILE A 66 -4.182 -14.149 6.232 1.00 0.00 C ATOM 1016 O ILE A 66 -3.922 -15.324 6.492 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.428 -13.411 3.854 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.418 -13.001 2.768 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -3.571 -14.580 3.386 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -4.787 -12.316 1.578 1.00 0.00 C ATOM 0 H ILE A 66 -5.999 -11.848 4.966 1.00 0.00 H new ATOM 0 HA ILE A 66 -5.839 -14.632 4.953 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.766 -12.571 4.063 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.948 -13.888 2.423 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.162 -12.334 3.204 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.042 -14.301 2.475 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.849 -14.835 4.162 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.208 -15.441 3.186 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.560 -12.058 0.854 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.281 -11.408 1.907 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.064 -12.987 1.113 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.623 -13.131 6.866 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.654 -13.325 7.940 1.00 0.00 C ATOM 1034 C ALA A 67 -2.763 -12.200 8.958 1.00 0.00 C ATOM 1035 O ALA A 67 -3.553 -12.268 9.898 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.237 -13.398 7.379 1.00 0.00 C ATOM 0 H ALA A 67 -3.824 -12.153 6.655 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.875 -14.269 8.437 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.529 -13.543 8.195 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.164 -14.234 6.683 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.004 -12.470 6.857 1.00 0.00 H new ATOM 1042 N GLY A 68 -1.975 -11.159 8.746 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.061 -9.977 9.570 1.00 0.00 C ATOM 1044 C GLY A 68 -2.468 -8.781 8.744 1.00 0.00 C ATOM 1045 O GLY A 68 -2.103 -7.650 9.047 1.00 0.00 O ATOM 0 H GLY A 68 -1.271 -11.114 8.010 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.784 -10.137 10.370 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.098 -9.787 10.044 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.208 -9.050 7.673 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.666 -8.004 6.771 1.00 0.00 C ATOM 1051 C VAL A 69 -4.979 -7.412 7.258 1.00 0.00 C ATOM 1052 O VAL A 69 -6.017 -8.072 7.243 1.00 0.00 O ATOM 1053 CB VAL A 69 -3.827 -8.513 5.317 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.470 -8.730 4.679 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.636 -9.801 5.265 1.00 0.00 C ATOM 0 H VAL A 69 -3.504 -9.990 7.409 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.898 -7.230 6.769 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.368 -7.749 4.758 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.601 -9.088 3.658 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.919 -7.789 4.666 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.912 -9.469 5.253 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.730 -10.130 4.230 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.131 -10.572 5.847 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.628 -9.625 5.681 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.916 -6.176 7.711 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.096 -5.479 8.192 1.00 0.00 C ATOM 1067 C GLU A 70 -6.518 -4.421 7.179 1.00 0.00 C ATOM 1068 O GLU A 70 -5.792 -3.450 6.954 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.808 -4.819 9.544 1.00 0.00 C ATOM 1070 CG GLU A 70 -5.213 -5.763 10.581 1.00 0.00 C ATOM 1071 CD GLU A 70 -6.154 -6.884 10.980 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -7.030 -6.651 11.842 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -6.004 -8.009 10.464 1.00 0.00 O ATOM 0 H GLU A 70 -4.056 -5.630 7.757 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.904 -6.199 8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -5.122 -3.986 9.391 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.735 -4.401 9.937 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.293 -6.193 10.185 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.942 -5.192 11.469 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.668 -4.629 6.551 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.199 -3.684 5.576 1.00 0.00 C ATOM 1082 C GLU A 71 -9.162 -2.714 6.261 1.00 0.00 C ATOM 1083 O GLU A 71 -10.075 -3.133 6.980 1.00 0.00 O ATOM 1084 CB GLU A 71 -8.896 -4.419 4.414 1.00 0.00 C ATOM 1085 CG GLU A 71 -10.025 -5.363 4.828 1.00 0.00 C ATOM 1086 CD GLU A 71 -9.541 -6.674 5.423 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -9.354 -6.738 6.657 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -9.352 -7.646 4.660 1.00 0.00 O ATOM 0 H GLU A 71 -8.255 -5.450 6.701 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.369 -3.116 5.156 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.298 -3.677 3.724 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.148 -4.991 3.866 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -10.660 -4.857 5.555 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.645 -5.577 3.957 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.955 -1.420 6.048 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.715 -0.400 6.763 1.00 0.00 C ATOM 1097 C LYS A 72 -10.169 0.724 5.833 1.00 0.00 C ATOM 1098 O LYS A 72 -9.383 1.597 5.458 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.881 0.177 7.914 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.386 -0.881 8.885 1.00 0.00 C ATOM 1101 CD LYS A 72 -7.630 -0.280 10.056 1.00 0.00 C ATOM 1102 CE LYS A 72 -7.105 -1.363 10.986 1.00 0.00 C ATOM 1103 NZ LYS A 72 -8.194 -2.254 11.470 1.00 0.00 N ATOM 0 H LYS A 72 -8.270 -1.052 5.388 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.606 -0.879 7.168 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -8.025 0.711 7.501 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.480 0.907 8.457 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.235 -1.453 9.259 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.738 -1.580 8.357 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.798 0.320 9.686 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.286 0.392 10.610 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.355 -1.957 10.464 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.609 -0.900 11.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.849 -2.820 12.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.004 -1.678 11.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -8.491 -2.888 10.701 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.448 0.699 5.480 1.00 0.00 N ATOM 1118 CA LEU A 73 -12.044 1.737 4.649 1.00 0.00 C ATOM 1119 C LEU A 73 -12.405 2.959 5.483 1.00 0.00 C ATOM 1120 O LEU A 73 -13.357 2.926 6.265 1.00 0.00 O ATOM 1121 CB LEU A 73 -13.308 1.214 3.960 1.00 0.00 C ATOM 1122 CG LEU A 73 -13.080 0.298 2.760 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -14.391 -0.346 2.343 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -12.490 1.082 1.598 1.00 0.00 C ATOM 0 H LEU A 73 -12.098 -0.036 5.759 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.308 2.020 3.896 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.904 0.675 4.697 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.901 2.068 3.634 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.375 -0.483 3.045 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.220 -0.998 1.486 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.788 -0.932 3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -15.107 0.430 2.071 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -12.334 0.414 0.751 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.176 1.878 1.311 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.536 1.516 1.899 1.00 0.00 H new ATOM 1136 N THR A 74 -11.643 4.030 5.333 1.00 0.00 N ATOM 1137 CA THR A 74 -11.959 5.279 6.006 1.00 0.00 C ATOM 1138 C THR A 74 -12.528 6.290 5.015 1.00 0.00 C ATOM 1139 O THR A 74 -11.820 6.794 4.145 1.00 0.00 O ATOM 1140 CB THR A 74 -10.728 5.871 6.728 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.603 5.946 5.842 1.00 0.00 O ATOM 1142 CG2 THR A 74 -10.359 5.034 7.944 1.00 0.00 C ATOM 0 H THR A 74 -10.804 4.060 4.753 1.00 0.00 H new ATOM 0 HA THR A 74 -12.712 5.060 6.763 1.00 0.00 H new ATOM 0 HB THR A 74 -10.991 6.877 7.055 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.626 5.190 5.219 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.490 5.470 8.436 1.00 0.00 H new ATOM 0 HG22 THR A 74 -11.198 5.014 8.640 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.125 4.017 7.628 1.00 0.00 H new ATOM 1150 N TYR A 75 -13.816 6.563 5.133 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.482 7.500 4.241 1.00 0.00 C ATOM 1152 C TYR A 75 -14.450 8.900 4.832 1.00 0.00 C ATOM 1153 O TYR A 75 -14.847 9.105 5.979 1.00 0.00 O ATOM 1154 CB TYR A 75 -15.929 7.067 3.984 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.049 5.763 3.223 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.897 4.541 3.866 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.314 5.757 1.859 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.999 3.352 3.173 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.418 4.570 1.158 1.00 0.00 C ATOM 1160 CZ TYR A 75 -16.261 3.372 1.820 1.00 0.00 C ATOM 1161 OH TYR A 75 -16.356 2.188 1.126 1.00 0.00 O ATOM 0 H TYR A 75 -14.424 6.148 5.839 1.00 0.00 H new ATOM 0 HA TYR A 75 -13.951 7.506 3.289 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.444 6.968 4.939 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.440 7.851 3.426 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -15.695 4.521 4.927 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.441 6.695 1.338 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.874 2.411 3.688 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.621 4.582 0.097 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.915 1.559 1.628 1.00 0.00 H new ATOM 1171 N THR A 76 -13.963 9.858 4.063 1.00 0.00 N ATOM 1172 CA THR A 76 -13.903 11.231 4.527 1.00 0.00 C ATOM 1173 C THR A 76 -15.102 12.017 4.018 1.00 0.00 C ATOM 1174 O THR A 76 -15.913 12.515 4.797 1.00 0.00 O ATOM 1175 CB THR A 76 -12.602 11.915 4.074 1.00 0.00 C ATOM 1176 OG1 THR A 76 -11.492 11.033 4.287 1.00 0.00 O ATOM 1177 CG2 THR A 76 -12.377 13.212 4.837 1.00 0.00 C ATOM 0 H THR A 76 -13.605 9.711 3.119 1.00 0.00 H new ATOM 0 HA THR A 76 -13.922 11.214 5.617 1.00 0.00 H new ATOM 0 HB THR A 76 -12.688 12.148 3.013 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.781 11.241 3.646 1.00 0.00 H new ATOM 0 HG21 THR A 76 -11.451 13.677 4.499 1.00 0.00 H new ATOM 0 HG22 THR A 76 -13.211 13.890 4.656 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.308 12.999 5.904 1.00 0.00 H new ATOM 1185 N ASP A 77 -15.208 12.090 2.701 1.00 0.00 N ATOM 1186 CA ASP A 77 -16.295 12.813 2.036 1.00 0.00 C ATOM 1187 C ASP A 77 -16.156 12.703 0.525 1.00 0.00 C ATOM 1188 O ASP A 77 -16.936 12.027 -0.138 1.00 0.00 O ATOM 1189 CB ASP A 77 -16.300 14.296 2.431 1.00 0.00 C ATOM 1190 CG ASP A 77 -17.358 15.091 1.687 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -17.101 15.498 0.531 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -18.447 15.317 2.253 1.00 0.00 O ATOM 0 H ASP A 77 -14.547 11.653 2.058 1.00 0.00 H new ATOM 0 HA ASP A 77 -17.234 12.360 2.355 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -16.472 14.383 3.504 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -15.319 14.726 2.230 1.00 0.00 H new ATOM 1197 N THR A 78 -15.135 13.360 -0.005 1.00 0.00 N ATOM 1198 CA THR A 78 -14.914 13.410 -1.442 1.00 0.00 C ATOM 1199 C THR A 78 -13.968 12.292 -1.872 1.00 0.00 C ATOM 1200 O THR A 78 -13.657 12.125 -3.055 1.00 0.00 O ATOM 1201 CB THR A 78 -14.325 14.778 -1.840 1.00 0.00 C ATOM 1202 OG1 THR A 78 -14.999 15.827 -1.122 1.00 0.00 O ATOM 1203 CG2 THR A 78 -14.466 15.026 -3.334 1.00 0.00 C ATOM 0 H THR A 78 -14.442 13.869 0.544 1.00 0.00 H new ATOM 0 HA THR A 78 -15.871 13.274 -1.946 1.00 0.00 H new ATOM 0 HB THR A 78 -13.265 14.773 -1.587 1.00 0.00 H new ATOM 0 HG1 THR A 78 -15.821 15.474 -0.722 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.041 15.999 -3.583 1.00 0.00 H new ATOM 0 HG22 THR A 78 -13.937 14.248 -3.884 1.00 0.00 H new ATOM 0 HG23 THR A 78 -15.521 15.010 -3.608 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.529 11.512 -0.894 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.585 10.439 -1.131 1.00 0.00 C ATOM 1213 C TYR A 79 -12.635 9.425 -0.002 1.00 0.00 C ATOM 1214 O TYR A 79 -13.142 9.715 1.088 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.166 10.993 -1.277 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.723 11.883 -0.137 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -11.050 13.232 -0.127 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -9.984 11.379 0.927 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -10.654 14.054 0.905 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -9.585 12.198 1.966 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.924 13.534 1.950 1.00 0.00 C ATOM 1222 OH TYR A 79 -9.536 14.357 2.980 1.00 0.00 O ATOM 0 H TYR A 79 -13.818 11.608 0.080 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.863 9.941 -2.060 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.470 10.158 -1.362 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.103 11.557 -2.208 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -11.625 13.644 -0.943 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -9.718 10.332 0.942 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -10.915 15.102 0.894 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.011 11.793 2.786 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.029 13.839 3.640 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.118 8.240 -0.274 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.049 7.188 0.718 1.00 0.00 C ATOM 1234 C ALA A 80 -10.635 6.633 0.788 1.00 0.00 C ATOM 1235 O ALA A 80 -10.016 6.354 -0.238 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.040 6.083 0.393 1.00 0.00 C ATOM 0 H ALA A 80 -11.737 7.983 -1.184 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.311 7.605 1.691 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.974 5.301 1.149 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.050 6.492 0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.808 5.662 -0.585 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.119 6.501 1.994 1.00 0.00 N ATOM 1243 CA GLN A 81 -8.781 5.978 2.196 1.00 0.00 C ATOM 1244 C GLN A 81 -8.844 4.536 2.669 1.00 0.00 C ATOM 1245 O GLN A 81 -9.361 4.249 3.750 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.021 6.823 3.213 1.00 0.00 C ATOM 1247 CG GLN A 81 -7.884 8.281 2.811 1.00 0.00 C ATOM 1248 CD GLN A 81 -7.183 9.111 3.865 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -6.499 10.084 3.549 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -7.353 8.742 5.125 1.00 0.00 N ATOM 0 H GLN A 81 -10.609 6.750 2.853 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.253 6.018 1.243 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.532 6.766 4.174 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -7.027 6.399 3.355 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -7.330 8.346 1.875 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -8.874 8.697 2.625 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -7.928 7.929 5.345 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -6.909 9.271 5.876 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.338 3.637 1.848 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.249 2.235 2.213 1.00 0.00 C ATOM 1261 C GLU A 82 -6.893 1.964 2.849 1.00 0.00 C ATOM 1262 O GLU A 82 -5.863 1.997 2.176 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.466 1.349 0.979 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.266 -0.139 1.230 1.00 0.00 C ATOM 1265 CD GLU A 82 -8.987 -0.641 2.466 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -10.192 -0.931 2.378 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -8.340 -0.759 3.524 1.00 0.00 O ATOM 0 H GLU A 82 -7.980 3.853 0.918 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.029 1.996 2.936 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.477 1.509 0.605 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.781 1.668 0.193 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.616 -0.697 0.362 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -7.200 -0.343 1.332 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.897 1.737 4.150 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.670 1.486 4.880 1.00 0.00 C ATOM 1276 C ASN A 83 -5.485 -0.008 5.072 1.00 0.00 C ATOM 1277 O ASN A 83 -6.112 -0.616 5.940 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.691 2.191 6.240 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.371 2.061 6.976 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -4.146 1.108 7.724 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -3.492 3.026 6.782 1.00 0.00 N ATOM 0 H ASN A 83 -7.740 1.722 4.724 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.835 1.883 4.303 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.922 3.247 6.096 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.489 1.771 6.852 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.591 2.998 7.259 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.714 3.799 6.155 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.641 -0.601 4.245 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.404 -2.037 4.319 1.00 0.00 C ATOM 1290 C VAL A 84 -3.055 -2.313 4.960 1.00 0.00 C ATOM 1291 O VAL A 84 -2.017 -1.997 4.395 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.447 -2.710 2.928 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.248 -4.214 3.051 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.754 -2.405 2.219 1.00 0.00 C ATOM 0 H VAL A 84 -4.111 -0.118 3.520 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.205 -2.460 4.926 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.631 -2.301 2.332 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.282 -4.668 2.060 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.280 -4.417 3.510 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.039 -4.636 3.671 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.760 -2.890 1.243 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.587 -2.779 2.815 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.855 -1.327 2.090 1.00 0.00 H new ATOM 1304 N THR A 85 -3.065 -2.900 6.137 1.00 0.00 N ATOM 1305 CA THR A 85 -1.827 -3.186 6.830 1.00 0.00 C ATOM 1306 C THR A 85 -1.424 -4.632 6.588 1.00 0.00 C ATOM 1307 O THR A 85 -2.026 -5.549 7.138 1.00 0.00 O ATOM 1308 CB THR A 85 -1.956 -2.925 8.339 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.620 -1.671 8.552 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.583 -2.889 8.991 1.00 0.00 C ATOM 0 H THR A 85 -3.910 -3.187 6.632 1.00 0.00 H new ATOM 0 HA THR A 85 -1.058 -2.520 6.438 1.00 0.00 H new ATOM 0 HB THR A 85 -2.537 -3.731 8.787 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.704 -1.505 9.514 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.692 -2.703 10.059 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.083 -3.845 8.838 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.012 -2.093 8.543 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.434 -4.829 5.735 1.00 0.00 N ATOM 1319 CA ILE A 86 0.010 -6.168 5.386 1.00 0.00 C ATOM 1320 C ILE A 86 1.182 -6.604 6.260 1.00 0.00 C ATOM 1321 O ILE A 86 2.290 -6.077 6.138 1.00 0.00 O ATOM 1322 CB ILE A 86 0.426 -6.252 3.900 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.741 -5.838 2.998 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.898 -7.660 3.552 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.390 -5.798 1.526 1.00 0.00 C ATOM 0 H ILE A 86 0.078 -4.079 5.271 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.833 -6.838 5.557 1.00 0.00 H new ATOM 0 HB ILE A 86 1.255 -5.564 3.734 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.567 -6.533 3.146 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.094 -4.853 3.305 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.186 -7.698 2.501 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.755 -7.920 4.173 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.090 -8.369 3.732 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.266 -5.497 0.951 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.415 -5.081 1.363 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.066 -6.787 1.202 1.00 0.00 H new ATOM 1337 N ASP A 87 0.926 -7.544 7.161 1.00 0.00 N ATOM 1338 CA ASP A 87 1.996 -8.162 7.936 1.00 0.00 C ATOM 1339 C ASP A 87 2.800 -9.092 7.040 1.00 0.00 C ATOM 1340 O ASP A 87 2.294 -10.116 6.585 1.00 0.00 O ATOM 1341 CB ASP A 87 1.437 -8.945 9.127 1.00 0.00 C ATOM 1342 CG ASP A 87 2.532 -9.613 9.942 1.00 0.00 C ATOM 1343 OD1 ASP A 87 2.979 -10.715 9.564 1.00 0.00 O ATOM 1344 OD2 ASP A 87 2.945 -9.038 10.971 1.00 0.00 O ATOM 0 H ASP A 87 -0.008 -7.894 7.373 1.00 0.00 H new ATOM 0 HA ASP A 87 2.640 -7.372 8.323 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.870 -8.271 9.768 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.741 -9.703 8.767 1.00 0.00 H new ATOM 1349 N MET A 88 4.048 -8.730 6.793 1.00 0.00 N ATOM 1350 CA MET A 88 4.873 -9.431 5.818 1.00 0.00 C ATOM 1351 C MET A 88 5.735 -10.489 6.494 1.00 0.00 C ATOM 1352 O MET A 88 6.779 -10.882 5.976 1.00 0.00 O ATOM 1353 CB MET A 88 5.750 -8.419 5.081 1.00 0.00 C ATOM 1354 CG MET A 88 4.974 -7.213 4.585 1.00 0.00 C ATOM 1355 SD MET A 88 6.039 -5.914 3.943 1.00 0.00 S ATOM 1356 CE MET A 88 6.471 -6.583 2.345 1.00 0.00 C ATOM 0 H MET A 88 4.516 -7.951 7.256 1.00 0.00 H new ATOM 0 HA MET A 88 4.224 -9.938 5.104 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.546 -8.084 5.746 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.228 -8.910 4.234 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.282 -7.528 3.804 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.373 -6.813 5.401 1.00 0.00 H new ATOM 0 HE1 MET A 88 6.948 -5.809 1.744 1.00 0.00 H new ATOM 0 HE2 MET A 88 7.159 -7.418 2.474 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.570 -6.931 1.840 1.00 0.00 H new ATOM 1366 N GLU A 89 5.278 -10.963 7.640 1.00 0.00 N ATOM 1367 CA GLU A 89 5.988 -11.996 8.377 1.00 0.00 C ATOM 1368 C GLU A 89 5.166 -13.279 8.383 1.00 0.00 C ATOM 1369 O GLU A 89 5.701 -14.383 8.310 1.00 0.00 O ATOM 1370 CB GLU A 89 6.255 -11.531 9.810 1.00 0.00 C ATOM 1371 CG GLU A 89 7.249 -10.383 9.918 1.00 0.00 C ATOM 1372 CD GLU A 89 8.690 -10.854 9.978 1.00 0.00 C ATOM 1373 OE1 GLU A 89 9.240 -11.268 8.938 1.00 0.00 O ATOM 1374 OE2 GLU A 89 9.285 -10.815 11.077 1.00 0.00 O ATOM 0 H GLU A 89 4.415 -10.648 8.083 1.00 0.00 H new ATOM 0 HA GLU A 89 6.944 -12.189 7.891 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.312 -11.224 10.262 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.627 -12.375 10.391 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.124 -9.719 9.062 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.026 -9.798 10.810 1.00 0.00 H new ATOM 1381 N LYS A 90 3.854 -13.111 8.463 1.00 0.00 N ATOM 1382 CA LYS A 90 2.926 -14.233 8.496 1.00 0.00 C ATOM 1383 C LYS A 90 2.184 -14.353 7.158 1.00 0.00 C ATOM 1384 O LYS A 90 1.237 -15.132 7.028 1.00 0.00 O ATOM 1385 CB LYS A 90 1.933 -14.017 9.645 1.00 0.00 C ATOM 1386 CG LYS A 90 1.625 -15.262 10.466 1.00 0.00 C ATOM 1387 CD LYS A 90 0.648 -16.182 9.758 1.00 0.00 C ATOM 1388 CE LYS A 90 0.261 -17.355 10.639 1.00 0.00 C ATOM 1389 NZ LYS A 90 -0.744 -18.233 9.986 1.00 0.00 N ATOM 0 H LYS A 90 3.404 -12.197 8.507 1.00 0.00 H new ATOM 0 HA LYS A 90 3.476 -15.160 8.658 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.330 -13.250 10.310 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.001 -13.631 9.233 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.550 -15.802 10.667 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.212 -14.967 11.431 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.245 -15.623 9.479 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.095 -16.550 8.834 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.151 -17.938 10.878 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.140 -16.984 11.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.981 -19.022 10.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.603 -17.684 9.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.353 -18.609 9.099 1.00 0.00 H new ATOM 1403 N VAL A 91 2.628 -13.579 6.165 1.00 0.00 N ATOM 1404 CA VAL A 91 1.969 -13.538 4.851 1.00 0.00 C ATOM 1405 C VAL A 91 1.835 -14.913 4.214 1.00 0.00 C ATOM 1406 O VAL A 91 2.739 -15.746 4.288 1.00 0.00 O ATOM 1407 CB VAL A 91 2.708 -12.639 3.833 1.00 0.00 C ATOM 1408 CG1 VAL A 91 2.076 -11.260 3.753 1.00 0.00 C ATOM 1409 CG2 VAL A 91 4.186 -12.542 4.172 1.00 0.00 C ATOM 0 H VAL A 91 3.442 -12.970 6.243 1.00 0.00 H new ATOM 0 HA VAL A 91 0.983 -13.126 5.067 1.00 0.00 H new ATOM 0 HB VAL A 91 2.615 -13.102 2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.619 -10.652 3.029 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.036 -11.354 3.441 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.119 -10.783 4.732 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.686 -11.905 3.442 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.304 -12.115 5.168 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.631 -13.537 4.149 1.00 0.00 H new ATOM 1419 N ASP A 92 0.692 -15.129 3.588 1.00 0.00 N ATOM 1420 CA ASP A 92 0.494 -16.290 2.739 1.00 0.00 C ATOM 1421 C ASP A 92 0.638 -15.860 1.291 1.00 0.00 C ATOM 1422 O ASP A 92 -0.262 -15.233 0.725 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.881 -16.918 2.975 1.00 0.00 C ATOM 1424 CG ASP A 92 -1.175 -18.054 2.013 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -0.534 -19.120 2.133 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -2.051 -17.890 1.139 1.00 0.00 O ATOM 0 H ASP A 92 -0.117 -14.512 3.652 1.00 0.00 H new ATOM 0 HA ASP A 92 1.243 -17.044 2.980 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.936 -17.290 3.998 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.649 -16.152 2.872 1.00 0.00 H new ATOM 1431 N PHE A 93 1.782 -16.170 0.699 1.00 0.00 N ATOM 1432 CA PHE A 93 2.085 -15.713 -0.648 1.00 0.00 C ATOM 1433 C PHE A 93 1.232 -16.446 -1.678 1.00 0.00 C ATOM 1434 O PHE A 93 1.096 -15.996 -2.816 1.00 0.00 O ATOM 1435 CB PHE A 93 3.565 -15.887 -0.979 1.00 0.00 C ATOM 1436 CG PHE A 93 4.503 -15.063 -0.137 1.00 0.00 C ATOM 1437 CD1 PHE A 93 4.850 -15.459 1.146 1.00 0.00 C ATOM 1438 CD2 PHE A 93 5.050 -13.895 -0.641 1.00 0.00 C ATOM 1439 CE1 PHE A 93 5.721 -14.699 1.907 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.918 -13.133 0.114 1.00 0.00 C ATOM 1441 CZ PHE A 93 6.256 -13.535 1.391 1.00 0.00 C ATOM 0 H PHE A 93 2.514 -16.735 1.130 1.00 0.00 H new ATOM 0 HA PHE A 93 1.849 -14.650 -0.688 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.827 -16.939 -0.865 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.721 -15.631 -2.027 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.437 -16.369 1.555 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.793 -13.576 -1.640 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.983 -15.017 2.906 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.333 -12.223 -0.294 1.00 0.00 H new ATOM 0 HZ PHE A 93 6.936 -12.942 1.984 1.00 0.00 H new ATOM 1451 N LYS A 94 0.663 -17.577 -1.274 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.272 -18.312 -2.117 1.00 0.00 C ATOM 1453 C LYS A 94 -1.448 -17.417 -2.500 1.00 0.00 C ATOM 1454 O LYS A 94 -1.753 -17.239 -3.683 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.784 -19.548 -1.380 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.778 -20.376 -2.178 1.00 0.00 C ATOM 1457 CD LYS A 94 -2.545 -21.319 -1.272 1.00 0.00 C ATOM 1458 CE LYS A 94 -3.409 -20.545 -0.289 1.00 0.00 C ATOM 1459 NZ LYS A 94 -3.954 -21.415 0.783 1.00 0.00 N ATOM 0 H LYS A 94 0.834 -18.006 -0.364 1.00 0.00 H new ATOM 0 HA LYS A 94 0.247 -18.626 -3.023 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.065 -20.177 -1.113 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.254 -19.234 -0.448 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.474 -19.716 -2.696 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.251 -20.947 -2.942 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.172 -21.977 -1.873 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.847 -21.954 -0.727 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.819 -19.745 0.159 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.232 -20.072 -0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.536 -20.846 1.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.538 -22.164 0.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.170 -21.846 1.312 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.107 -16.857 -1.490 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.198 -15.917 -1.712 1.00 0.00 C ATOM 1475 C ALA A 95 -2.658 -14.565 -2.164 1.00 0.00 C ATOM 1476 O ALA A 95 -3.319 -13.840 -2.912 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.029 -15.761 -0.447 1.00 0.00 C ATOM 0 H ALA A 95 -1.903 -17.039 -0.507 1.00 0.00 H new ATOM 0 HA ALA A 95 -3.837 -16.312 -2.501 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.840 -15.056 -0.629 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.446 -16.728 -0.164 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.398 -15.388 0.359 1.00 0.00 H new ATOM 1483 N LEU A 96 -1.445 -14.244 -1.720 1.00 0.00 N ATOM 1484 CA LEU A 96 -0.790 -12.991 -2.089 1.00 0.00 C ATOM 1485 C LEU A 96 -0.648 -12.889 -3.601 1.00 0.00 C ATOM 1486 O LEU A 96 -0.748 -11.808 -4.170 1.00 0.00 O ATOM 1487 CB LEU A 96 0.596 -12.903 -1.447 1.00 0.00 C ATOM 1488 CG LEU A 96 1.221 -11.511 -1.436 1.00 0.00 C ATOM 1489 CD1 LEU A 96 0.527 -10.644 -0.412 1.00 0.00 C ATOM 1490 CD2 LEU A 96 2.710 -11.589 -1.152 1.00 0.00 C ATOM 0 H LEU A 96 -0.893 -14.838 -1.101 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.408 -12.169 -1.729 1.00 0.00 H new ATOM 0 HB2 LEU A 96 0.526 -13.260 -0.420 1.00 0.00 H new ATOM 0 HB3 LEU A 96 1.267 -13.581 -1.975 1.00 0.00 H new ATOM 0 HG LEU A 96 1.092 -11.063 -2.421 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.978 -9.652 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -0.531 -10.561 -0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.632 -11.093 0.576 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.133 -10.584 -1.149 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.871 -12.053 -0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.197 -12.186 -1.924 1.00 0.00 H new ATOM 1502 N GLN A 97 -0.421 -14.029 -4.239 1.00 0.00 N ATOM 1503 CA GLN A 97 -0.276 -14.096 -5.689 1.00 0.00 C ATOM 1504 C GLN A 97 -1.531 -13.588 -6.399 1.00 0.00 C ATOM 1505 O GLN A 97 -1.462 -13.086 -7.520 1.00 0.00 O ATOM 1506 CB GLN A 97 0.017 -15.540 -6.106 1.00 0.00 C ATOM 1507 CG GLN A 97 0.149 -15.744 -7.606 1.00 0.00 C ATOM 1508 CD GLN A 97 0.376 -17.197 -7.979 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -0.139 -18.110 -7.165 1.00 0.00 O flip ATOM 1510 NE2 GLN A 97 1.011 -17.499 -8.985 1.00 0.00 N flip ATOM 0 H GLN A 97 -0.332 -14.930 -3.770 1.00 0.00 H new ATOM 0 HA GLN A 97 0.554 -13.453 -5.982 1.00 0.00 H new ATOM 0 HB2 GLN A 97 0.939 -15.865 -5.625 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -0.781 -16.182 -5.733 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -0.754 -15.383 -8.099 1.00 0.00 H new ATOM 0 HG3 GLN A 97 0.978 -15.143 -7.979 1.00 0.00 H new ATOM 0 HE21 GLN A 97 1.392 -16.768 -9.586 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.158 -18.481 -9.220 1.00 0.00 H new ATOM 1519 N GLY A 98 -2.675 -13.711 -5.739 1.00 0.00 N ATOM 1520 CA GLY A 98 -3.922 -13.295 -6.348 1.00 0.00 C ATOM 1521 C GLY A 98 -4.124 -11.792 -6.293 1.00 0.00 C ATOM 1522 O GLY A 98 -4.371 -11.156 -7.317 1.00 0.00 O ATOM 0 H GLY A 98 -2.761 -14.090 -4.796 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -3.942 -13.623 -7.387 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -4.752 -13.788 -5.842 1.00 0.00 H new ATOM 1526 N ILE A 99 -4.009 -11.226 -5.101 1.00 0.00 N ATOM 1527 CA ILE A 99 -4.251 -9.800 -4.896 1.00 0.00 C ATOM 1528 C ILE A 99 -3.003 -8.965 -5.175 1.00 0.00 C ATOM 1529 O ILE A 99 -3.084 -7.904 -5.800 1.00 0.00 O ATOM 1530 CB ILE A 99 -4.738 -9.526 -3.458 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -3.835 -10.235 -2.440 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.183 -9.979 -3.297 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -4.228 -9.994 -1.000 1.00 0.00 C ATOM 0 H ILE A 99 -3.748 -11.733 -4.255 1.00 0.00 H new ATOM 0 HA ILE A 99 -5.026 -9.507 -5.604 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.687 -8.453 -3.271 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.854 -11.307 -2.637 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -2.808 -9.902 -2.587 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.515 -9.780 -2.278 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -6.815 -9.434 -3.998 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.254 -11.048 -3.500 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -3.543 -10.528 -0.342 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.181 -8.927 -0.784 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.244 -10.353 -0.835 1.00 0.00 H new ATOM 1545 N SER A 100 -1.864 -9.468 -4.710 1.00 0.00 N ATOM 1546 CA SER A 100 -0.564 -8.808 -4.843 1.00 0.00 C ATOM 1547 C SER A 100 -0.498 -7.493 -4.074 1.00 0.00 C ATOM 1548 O SER A 100 0.147 -7.402 -3.032 1.00 0.00 O ATOM 1549 CB SER A 100 -0.213 -8.582 -6.315 1.00 0.00 C ATOM 1550 OG SER A 100 -0.224 -9.803 -7.034 1.00 0.00 O ATOM 0 H SER A 100 -1.815 -10.362 -4.221 1.00 0.00 H new ATOM 0 HA SER A 100 0.174 -9.479 -4.403 1.00 0.00 H new ATOM 0 HB2 SER A 100 -0.926 -7.888 -6.760 1.00 0.00 H new ATOM 0 HB3 SER A 100 0.771 -8.120 -6.391 1.00 0.00 H new ATOM 0 HG SER A 100 0.002 -9.632 -7.972 1.00 0.00 H new ATOM 1556 N GLY A 101 -1.174 -6.491 -4.596 1.00 0.00 N ATOM 1557 CA GLY A 101 -1.100 -5.158 -4.028 1.00 0.00 C ATOM 1558 C GLY A 101 0.162 -4.439 -4.463 1.00 0.00 C ATOM 1559 O GLY A 101 0.494 -3.371 -3.951 1.00 0.00 O ATOM 0 H GLY A 101 -1.781 -6.572 -5.412 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -1.973 -4.582 -4.335 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -1.127 -5.223 -2.940 1.00 0.00 H new ATOM 1563 N ILE A 102 0.868 -5.040 -5.414 1.00 0.00 N ATOM 1564 CA ILE A 102 2.122 -4.497 -5.913 1.00 0.00 C ATOM 1565 C ILE A 102 2.120 -4.506 -7.436 1.00 0.00 C ATOM 1566 O ILE A 102 1.777 -5.518 -8.054 1.00 0.00 O ATOM 1567 CB ILE A 102 3.334 -5.322 -5.418 1.00 0.00 C ATOM 1568 CG1 ILE A 102 3.243 -5.575 -3.909 1.00 0.00 C ATOM 1569 CG2 ILE A 102 4.635 -4.605 -5.755 1.00 0.00 C ATOM 1570 CD1 ILE A 102 4.356 -6.446 -3.365 1.00 0.00 C ATOM 0 H ILE A 102 0.587 -5.914 -5.858 1.00 0.00 H new ATOM 0 HA ILE A 102 2.211 -3.478 -5.536 1.00 0.00 H new ATOM 0 HB ILE A 102 3.321 -6.286 -5.927 1.00 0.00 H new ATOM 0 HG12 ILE A 102 3.257 -4.617 -3.388 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.285 -6.045 -3.686 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.479 -5.197 -5.401 1.00 0.00 H new ATOM 0 HG22 ILE A 102 4.710 -4.476 -6.835 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.648 -3.628 -5.271 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.222 -6.579 -2.291 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.331 -7.418 -3.857 1.00 0.00 H new ATOM 0 HD13 ILE A 102 5.317 -5.968 -3.554 1.00 0.00 H new ATOM 1582 N ASN A 103 2.488 -3.385 -8.040 1.00 0.00 N ATOM 1583 CA ASN A 103 2.588 -3.304 -9.491 1.00 0.00 C ATOM 1584 C ASN A 103 3.886 -3.937 -9.959 1.00 0.00 C ATOM 1585 O ASN A 103 4.899 -3.259 -10.127 1.00 0.00 O ATOM 1586 CB ASN A 103 2.503 -1.854 -9.976 1.00 0.00 C ATOM 1587 CG ASN A 103 1.120 -1.263 -9.810 1.00 0.00 C ATOM 1588 OD1 ASN A 103 0.802 -0.666 -8.784 1.00 0.00 O ATOM 1589 ND2 ASN A 103 0.285 -1.423 -10.825 1.00 0.00 N ATOM 0 H ASN A 103 2.722 -2.521 -7.550 1.00 0.00 H new ATOM 0 HA ASN A 103 1.747 -3.850 -9.918 1.00 0.00 H new ATOM 0 HB2 ASN A 103 3.221 -1.248 -9.424 1.00 0.00 H new ATOM 0 HB3 ASN A 103 2.789 -1.809 -11.027 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -0.661 -1.044 -10.772 1.00 0.00 H new ATOM 0 HD22 ASN A 103 0.587 -1.925 -11.660 1.00 0.00 H new ATOM 1596 N VAL A 104 3.851 -5.252 -10.124 1.00 0.00 N ATOM 1597 CA VAL A 104 5.007 -6.012 -10.563 1.00 0.00 C ATOM 1598 C VAL A 104 4.572 -7.442 -10.886 1.00 0.00 C ATOM 1599 O VAL A 104 3.427 -7.820 -10.615 1.00 0.00 O ATOM 1600 CB VAL A 104 6.118 -6.024 -9.477 1.00 0.00 C ATOM 1601 CG1 VAL A 104 5.747 -6.939 -8.317 1.00 0.00 C ATOM 1602 CG2 VAL A 104 7.466 -6.415 -10.069 1.00 0.00 C ATOM 0 H VAL A 104 3.020 -5.819 -9.957 1.00 0.00 H new ATOM 0 HA VAL A 104 5.420 -5.539 -11.454 1.00 0.00 H new ATOM 0 HB VAL A 104 6.206 -5.010 -9.088 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.544 -6.926 -7.574 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.820 -6.591 -7.861 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.611 -7.956 -8.685 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.222 -6.414 -9.284 1.00 0.00 H new ATOM 0 HG22 VAL A 104 7.397 -7.412 -10.505 1.00 0.00 H new ATOM 0 HG23 VAL A 104 7.745 -5.699 -10.842 1.00 0.00 H new ATOM 1612 N SER A 105 5.465 -8.223 -11.471 1.00 0.00 N ATOM 1613 CA SER A 105 5.180 -9.612 -11.784 1.00 0.00 C ATOM 1614 C SER A 105 5.173 -10.449 -10.510 1.00 0.00 C ATOM 1615 O SER A 105 5.990 -10.230 -9.613 1.00 0.00 O ATOM 1616 CB SER A 105 6.225 -10.147 -12.758 1.00 0.00 C ATOM 1617 OG SER A 105 6.258 -9.368 -13.944 1.00 0.00 O ATOM 0 H SER A 105 6.399 -7.915 -11.740 1.00 0.00 H new ATOM 0 HA SER A 105 4.196 -9.676 -12.248 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.207 -10.138 -12.285 1.00 0.00 H new ATOM 0 HB3 SER A 105 6.000 -11.184 -13.006 1.00 0.00 H new ATOM 0 HG SER A 105 6.936 -9.728 -14.553 1.00 0.00 H new ATOM 1623 N ALA A 106 4.260 -11.413 -10.440 1.00 0.00 N ATOM 1624 CA ALA A 106 4.138 -12.268 -9.263 1.00 0.00 C ATOM 1625 C ALA A 106 5.396 -13.099 -9.055 1.00 0.00 C ATOM 1626 O ALA A 106 5.670 -13.561 -7.950 1.00 0.00 O ATOM 1627 CB ALA A 106 2.921 -13.170 -9.387 1.00 0.00 C ATOM 0 H ALA A 106 3.594 -11.622 -11.184 1.00 0.00 H new ATOM 0 HA ALA A 106 4.011 -11.626 -8.392 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.844 -13.801 -8.502 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.023 -12.559 -9.476 1.00 0.00 H new ATOM 0 HB3 ALA A 106 3.022 -13.798 -10.272 1.00 0.00 H new ATOM 1633 N GLU A 107 6.158 -13.276 -10.128 1.00 0.00 N ATOM 1634 CA GLU A 107 7.400 -14.039 -10.091 1.00 0.00 C ATOM 1635 C GLU A 107 8.359 -13.503 -9.028 1.00 0.00 C ATOM 1636 O GLU A 107 9.009 -14.281 -8.329 1.00 0.00 O ATOM 1637 CB GLU A 107 8.089 -14.020 -11.462 1.00 0.00 C ATOM 1638 CG GLU A 107 7.319 -14.730 -12.571 1.00 0.00 C ATOM 1639 CD GLU A 107 6.101 -13.958 -13.047 1.00 0.00 C ATOM 1640 OE1 GLU A 107 5.008 -14.150 -12.481 1.00 0.00 O ATOM 1641 OE2 GLU A 107 6.231 -13.160 -13.999 1.00 0.00 O ATOM 0 H GLU A 107 5.933 -12.895 -11.047 1.00 0.00 H new ATOM 0 HA GLU A 107 7.140 -15.065 -9.832 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.252 -12.984 -11.757 1.00 0.00 H new ATOM 0 HB3 GLU A 107 9.071 -14.483 -11.366 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.986 -14.899 -13.416 1.00 0.00 H new ATOM 0 HG3 GLU A 107 7.002 -15.710 -12.214 1.00 0.00 H new ATOM 1648 N ASP A 108 8.433 -12.179 -8.897 1.00 0.00 N ATOM 1649 CA ASP A 108 9.349 -11.567 -7.934 1.00 0.00 C ATOM 1650 C ASP A 108 8.858 -11.824 -6.512 1.00 0.00 C ATOM 1651 O ASP A 108 9.647 -12.011 -5.587 1.00 0.00 O ATOM 1652 CB ASP A 108 9.472 -10.054 -8.174 1.00 0.00 C ATOM 1653 CG ASP A 108 10.821 -9.503 -7.739 1.00 0.00 C ATOM 1654 OD1 ASP A 108 11.719 -10.298 -7.387 1.00 0.00 O ATOM 1655 OD2 ASP A 108 11.005 -8.269 -7.789 1.00 0.00 O ATOM 0 H ASP A 108 7.877 -11.516 -9.438 1.00 0.00 H new ATOM 0 HA ASP A 108 10.332 -12.018 -8.067 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.322 -9.844 -9.233 1.00 0.00 H new ATOM 0 HB3 ASP A 108 8.680 -9.538 -7.631 1.00 0.00 H new ATOM 1660 N ALA A 109 7.538 -11.862 -6.355 1.00 0.00 N ATOM 1661 CA ALA A 109 6.921 -12.074 -5.051 1.00 0.00 C ATOM 1662 C ALA A 109 7.043 -13.527 -4.613 1.00 0.00 C ATOM 1663 O ALA A 109 7.207 -13.817 -3.426 1.00 0.00 O ATOM 1664 CB ALA A 109 5.460 -11.650 -5.082 1.00 0.00 C ATOM 0 H ALA A 109 6.873 -11.748 -7.120 1.00 0.00 H new ATOM 0 HA ALA A 109 7.451 -11.459 -4.324 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.013 -11.814 -4.102 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.393 -10.593 -5.339 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.926 -12.239 -5.828 1.00 0.00 H new ATOM 1670 N LYS A 110 6.973 -14.440 -5.580 1.00 0.00 N ATOM 1671 CA LYS A 110 7.083 -15.871 -5.302 1.00 0.00 C ATOM 1672 C LYS A 110 8.430 -16.201 -4.667 1.00 0.00 C ATOM 1673 O LYS A 110 8.530 -17.090 -3.821 1.00 0.00 O ATOM 1674 CB LYS A 110 6.934 -16.691 -6.587 1.00 0.00 C ATOM 1675 CG LYS A 110 5.569 -16.598 -7.246 1.00 0.00 C ATOM 1676 CD LYS A 110 5.516 -17.458 -8.498 1.00 0.00 C ATOM 1677 CE LYS A 110 4.167 -17.371 -9.190 1.00 0.00 C ATOM 1678 NZ LYS A 110 4.092 -18.285 -10.360 1.00 0.00 N ATOM 0 H LYS A 110 6.840 -14.213 -6.566 1.00 0.00 H new ATOM 0 HA LYS A 110 6.281 -16.127 -4.610 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.690 -16.363 -7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.142 -17.737 -6.360 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.799 -16.920 -6.545 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.353 -15.561 -7.502 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.299 -17.143 -9.188 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.722 -18.495 -8.235 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.377 -17.621 -8.481 1.00 0.00 H new ATOM 0 HE3 LYS A 110 3.990 -16.346 -9.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 3.157 -18.199 -10.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 4.830 -18.031 -11.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.236 -19.265 -10.044 1.00 0.00 H new ATOM 1692 N LYS A 111 9.459 -15.471 -5.076 1.00 0.00 N ATOM 1693 CA LYS A 111 10.815 -15.758 -4.642 1.00 0.00 C ATOM 1694 C LYS A 111 11.181 -14.924 -3.414 1.00 0.00 C ATOM 1695 O LYS A 111 12.332 -14.920 -2.965 1.00 0.00 O ATOM 1696 CB LYS A 111 11.789 -15.498 -5.796 1.00 0.00 C ATOM 1697 CG LYS A 111 13.114 -16.228 -5.658 1.00 0.00 C ATOM 1698 CD LYS A 111 13.947 -16.109 -6.921 1.00 0.00 C ATOM 1699 CE LYS A 111 15.182 -16.988 -6.852 1.00 0.00 C ATOM 1700 NZ LYS A 111 15.961 -16.947 -8.115 1.00 0.00 N ATOM 0 H LYS A 111 9.378 -14.675 -5.709 1.00 0.00 H new ATOM 0 HA LYS A 111 10.882 -16.808 -4.356 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.316 -15.796 -6.732 1.00 0.00 H new ATOM 0 HB3 LYS A 111 11.980 -14.427 -5.863 1.00 0.00 H new ATOM 0 HG2 LYS A 111 13.670 -15.819 -4.814 1.00 0.00 H new ATOM 0 HG3 LYS A 111 12.930 -17.280 -5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 111 13.345 -16.392 -7.784 1.00 0.00 H new ATOM 0 HD3 LYS A 111 14.245 -15.071 -7.066 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.813 -16.663 -6.025 1.00 0.00 H new ATOM 0 HE3 LYS A 111 14.885 -18.015 -6.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 16.796 -17.560 -8.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.367 -17.281 -8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 16.266 -15.971 -8.303 1.00 0.00 H new ATOM 1714 N GLY A 112 10.197 -14.224 -2.865 1.00 0.00 N ATOM 1715 CA GLY A 112 10.410 -13.467 -1.647 1.00 0.00 C ATOM 1716 C GLY A 112 10.668 -11.996 -1.903 1.00 0.00 C ATOM 1717 O GLY A 112 11.464 -11.635 -2.770 1.00 0.00 O ATOM 0 H GLY A 112 9.251 -14.167 -3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.536 -13.571 -1.004 1.00 0.00 H new ATOM 0 HA3 GLY A 112 11.256 -13.890 -1.106 1.00 0.00 H new ATOM 1721 N ILE A 113 9.999 -11.144 -1.136 1.00 0.00 N ATOM 1722 CA ILE A 113 10.158 -9.705 -1.268 1.00 0.00 C ATOM 1723 C ILE A 113 11.019 -9.158 -0.134 1.00 0.00 C ATOM 1724 O ILE A 113 10.744 -9.403 1.038 1.00 0.00 O ATOM 1725 CB ILE A 113 8.795 -8.976 -1.257 1.00 0.00 C ATOM 1726 CG1 ILE A 113 7.907 -9.463 -2.409 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.997 -7.467 -1.341 1.00 0.00 C ATOM 1728 CD1 ILE A 113 8.478 -9.184 -3.784 1.00 0.00 C ATOM 0 H ILE A 113 9.338 -11.429 -0.413 1.00 0.00 H new ATOM 0 HA ILE A 113 10.644 -9.523 -2.227 1.00 0.00 H new ATOM 0 HB ILE A 113 8.292 -9.208 -0.318 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.748 -10.536 -2.303 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.930 -8.986 -2.328 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.027 -6.969 -1.332 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.585 -7.131 -0.487 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.523 -7.221 -2.264 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.793 -9.558 -4.545 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.611 -8.110 -3.912 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.441 -9.684 -3.886 1.00 0.00 H new ATOM 1740 N THR A 114 12.062 -8.429 -0.490 1.00 0.00 N ATOM 1741 CA THR A 114 12.913 -7.781 0.493 1.00 0.00 C ATOM 1742 C THR A 114 12.925 -6.282 0.244 1.00 0.00 C ATOM 1743 O THR A 114 12.163 -5.782 -0.589 1.00 0.00 O ATOM 1744 CB THR A 114 14.360 -8.315 0.445 1.00 0.00 C ATOM 1745 OG1 THR A 114 14.937 -8.065 -0.843 1.00 0.00 O ATOM 1746 CG2 THR A 114 14.404 -9.806 0.742 1.00 0.00 C ATOM 0 H THR A 114 12.341 -8.270 -1.458 1.00 0.00 H new ATOM 0 HA THR A 114 12.506 -8.001 1.480 1.00 0.00 H new ATOM 0 HB THR A 114 14.935 -7.792 1.209 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.431 -8.551 -1.528 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.436 -10.155 0.701 1.00 0.00 H new ATOM 0 HG22 THR A 114 13.997 -9.991 1.736 1.00 0.00 H new ATOM 0 HG23 THR A 114 13.810 -10.342 0.002 1.00 0.00 H new ATOM 1754 N MET A 115 13.784 -5.568 0.955 1.00 0.00 N ATOM 1755 CA MET A 115 13.941 -4.137 0.741 1.00 0.00 C ATOM 1756 C MET A 115 14.521 -3.890 -0.646 1.00 0.00 C ATOM 1757 O MET A 115 14.151 -2.934 -1.325 1.00 0.00 O ATOM 1758 CB MET A 115 14.853 -3.533 1.809 1.00 0.00 C ATOM 1759 CG MET A 115 14.888 -2.014 1.792 1.00 0.00 C ATOM 1760 SD MET A 115 13.274 -1.290 2.128 1.00 0.00 S ATOM 1761 CE MET A 115 13.655 0.453 1.987 1.00 0.00 C ATOM 0 H MET A 115 14.383 -5.955 1.684 1.00 0.00 H new ATOM 0 HA MET A 115 12.964 -3.658 0.814 1.00 0.00 H new ATOM 0 HB2 MET A 115 14.520 -3.869 2.791 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.865 -3.913 1.668 1.00 0.00 H new ATOM 0 HG2 MET A 115 15.604 -1.661 2.534 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.242 -1.672 0.820 1.00 0.00 H new ATOM 0 HE1 MET A 115 12.736 1.013 1.813 1.00 0.00 H new ATOM 0 HE2 MET A 115 14.122 0.799 2.909 1.00 0.00 H new ATOM 0 HE3 MET A 115 14.339 0.610 1.153 1.00 0.00 H new ATOM 1771 N ALA A 116 15.408 -4.788 -1.069 1.00 0.00 N ATOM 1772 CA ALA A 116 16.029 -4.700 -2.385 1.00 0.00 C ATOM 1773 C ALA A 116 14.971 -4.763 -3.479 1.00 0.00 C ATOM 1774 O ALA A 116 15.068 -4.056 -4.487 1.00 0.00 O ATOM 1775 CB ALA A 116 17.049 -5.814 -2.566 1.00 0.00 C ATOM 0 H ALA A 116 15.713 -5.588 -0.515 1.00 0.00 H new ATOM 0 HA ALA A 116 16.545 -3.743 -2.460 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.504 -5.734 -3.553 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.822 -5.727 -1.803 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.553 -6.780 -2.472 1.00 0.00 H new ATOM 1781 N GLN A 117 13.966 -5.617 -3.274 1.00 0.00 N ATOM 1782 CA GLN A 117 12.824 -5.677 -4.175 1.00 0.00 C ATOM 1783 C GLN A 117 12.179 -4.310 -4.291 1.00 0.00 C ATOM 1784 O GLN A 117 12.346 -3.647 -5.293 1.00 0.00 O ATOM 1785 CB GLN A 117 11.777 -6.689 -3.692 1.00 0.00 C ATOM 1786 CG GLN A 117 11.807 -8.026 -4.418 1.00 0.00 C ATOM 1787 CD GLN A 117 13.051 -8.834 -4.125 1.00 0.00 C ATOM 1788 OE1 GLN A 117 13.636 -8.727 -3.047 1.00 0.00 O ATOM 1789 NE2 GLN A 117 13.447 -9.667 -5.072 1.00 0.00 N ATOM 0 H GLN A 117 13.924 -6.272 -2.494 1.00 0.00 H new ATOM 0 HA GLN A 117 13.192 -5.999 -5.149 1.00 0.00 H new ATOM 0 HB2 GLN A 117 11.926 -6.865 -2.627 1.00 0.00 H new ATOM 0 HB3 GLN A 117 10.786 -6.250 -3.807 1.00 0.00 H new ATOM 0 HG2 GLN A 117 10.929 -8.606 -4.134 1.00 0.00 H new ATOM 0 HG3 GLN A 117 11.740 -7.851 -5.492 1.00 0.00 H new ATOM 0 HE21 GLN A 117 12.932 -9.723 -5.950 1.00 0.00 H new ATOM 0 HE22 GLN A 117 14.268 -10.254 -4.924 1.00 0.00 H new ATOM 1798 N MET A 118 11.470 -3.901 -3.244 1.00 0.00 N ATOM 1799 CA MET A 118 10.748 -2.621 -3.201 1.00 0.00 C ATOM 1800 C MET A 118 11.504 -1.470 -3.866 1.00 0.00 C ATOM 1801 O MET A 118 10.936 -0.758 -4.687 1.00 0.00 O ATOM 1802 CB MET A 118 10.421 -2.254 -1.753 1.00 0.00 C ATOM 1803 CG MET A 118 9.451 -3.218 -1.099 1.00 0.00 C ATOM 1804 SD MET A 118 7.869 -3.279 -1.959 1.00 0.00 S ATOM 1805 CE MET A 118 7.094 -4.665 -1.141 1.00 0.00 C ATOM 0 H MET A 118 11.376 -4.450 -2.389 1.00 0.00 H new ATOM 0 HA MET A 118 9.832 -2.766 -3.774 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.344 -2.228 -1.174 1.00 0.00 H new ATOM 0 HB3 MET A 118 9.999 -1.249 -1.726 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.890 -4.215 -1.079 1.00 0.00 H new ATOM 0 HG3 MET A 118 9.288 -2.920 -0.063 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.821 -5.418 -1.881 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.789 -5.098 -0.422 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.198 -4.326 -0.621 1.00 0.00 H new ATOM 1815 N GLU A 119 12.776 -1.291 -3.529 1.00 0.00 N ATOM 1816 CA GLU A 119 13.569 -0.207 -4.112 1.00 0.00 C ATOM 1817 C GLU A 119 13.593 -0.299 -5.644 1.00 0.00 C ATOM 1818 O GLU A 119 13.228 0.649 -6.343 1.00 0.00 O ATOM 1819 CB GLU A 119 15.002 -0.241 -3.573 1.00 0.00 C ATOM 1820 CG GLU A 119 15.100 -0.116 -2.060 1.00 0.00 C ATOM 1821 CD GLU A 119 14.667 1.240 -1.542 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.499 2.173 -1.535 1.00 0.00 O ATOM 1823 OE2 GLU A 119 13.501 1.380 -1.112 1.00 0.00 O ATOM 0 H GLU A 119 13.280 -1.875 -2.861 1.00 0.00 H new ATOM 0 HA GLU A 119 13.100 0.735 -3.828 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.472 -1.175 -3.881 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.570 0.568 -4.031 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.484 -0.887 -1.598 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.129 -0.303 -1.753 1.00 0.00 H new ATOM 1830 N LEU A 120 13.991 -1.461 -6.154 1.00 0.00 N ATOM 1831 CA LEU A 120 14.137 -1.667 -7.594 1.00 0.00 C ATOM 1832 C LEU A 120 12.781 -1.788 -8.287 1.00 0.00 C ATOM 1833 O LEU A 120 12.620 -1.401 -9.443 1.00 0.00 O ATOM 1834 CB LEU A 120 14.962 -2.932 -7.849 1.00 0.00 C ATOM 1835 CG LEU A 120 16.427 -2.852 -7.415 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.122 -4.185 -7.638 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.147 -1.740 -8.165 1.00 0.00 C ATOM 0 H LEU A 120 14.220 -2.279 -5.589 1.00 0.00 H new ATOM 0 HA LEU A 120 14.647 -0.798 -8.009 1.00 0.00 H new ATOM 0 HB2 LEU A 120 14.490 -3.765 -7.328 1.00 0.00 H new ATOM 0 HB3 LEU A 120 14.927 -3.161 -8.914 1.00 0.00 H new ATOM 0 HG LEU A 120 16.458 -2.622 -6.350 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.163 -4.110 -7.324 1.00 0.00 H new ATOM 0 HD12 LEU A 120 16.622 -4.958 -7.055 1.00 0.00 H new ATOM 0 HD13 LEU A 120 17.080 -4.445 -8.696 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.188 -1.698 -7.843 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.106 -1.938 -9.236 1.00 0.00 H new ATOM 0 HD23 LEU A 120 16.663 -0.786 -7.954 1.00 0.00 H new ATOM 1849 N VAL A 121 11.815 -2.307 -7.553 1.00 0.00 N ATOM 1850 CA VAL A 121 10.498 -2.639 -8.076 1.00 0.00 C ATOM 1851 C VAL A 121 9.605 -1.404 -8.134 1.00 0.00 C ATOM 1852 O VAL A 121 8.855 -1.210 -9.091 1.00 0.00 O ATOM 1853 CB VAL A 121 9.854 -3.748 -7.204 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.384 -3.955 -7.505 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.593 -5.056 -7.400 1.00 0.00 C ATOM 0 H VAL A 121 11.923 -2.514 -6.560 1.00 0.00 H new ATOM 0 HA VAL A 121 10.609 -3.011 -9.095 1.00 0.00 H new ATOM 0 HB VAL A 121 9.932 -3.417 -6.169 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.989 -4.743 -6.864 1.00 0.00 H new ATOM 0 HG12 VAL A 121 7.840 -3.029 -7.318 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.263 -4.242 -8.549 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.134 -5.829 -6.784 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.541 -5.349 -8.448 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.636 -4.932 -7.109 1.00 0.00 H new ATOM 1865 N MET A 122 9.703 -0.557 -7.122 1.00 0.00 N ATOM 1866 CA MET A 122 8.944 0.684 -7.103 1.00 0.00 C ATOM 1867 C MET A 122 9.528 1.674 -8.095 1.00 0.00 C ATOM 1868 O MET A 122 8.794 2.445 -8.711 1.00 0.00 O ATOM 1869 CB MET A 122 8.890 1.275 -5.693 1.00 0.00 C ATOM 1870 CG MET A 122 7.727 0.740 -4.870 1.00 0.00 C ATOM 1871 SD MET A 122 7.635 -1.062 -4.884 1.00 0.00 S ATOM 1872 CE MET A 122 5.986 -1.329 -4.245 1.00 0.00 C ATOM 0 H MET A 122 10.298 -0.704 -6.306 1.00 0.00 H new ATOM 0 HA MET A 122 7.919 0.466 -7.403 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.825 1.056 -5.177 1.00 0.00 H new ATOM 0 HB3 MET A 122 8.811 2.360 -5.762 1.00 0.00 H new ATOM 0 HG2 MET A 122 7.825 1.087 -3.841 1.00 0.00 H new ATOM 0 HG3 MET A 122 6.794 1.150 -5.257 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.893 -2.357 -3.896 1.00 0.00 H new ATOM 0 HE2 MET A 122 5.802 -0.646 -3.415 1.00 0.00 H new ATOM 0 HE3 MET A 122 5.256 -1.146 -5.034 1.00 0.00 H new ATOM 1882 N LYS A 123 10.845 1.643 -8.269 1.00 0.00 N ATOM 1883 CA LYS A 123 11.483 2.434 -9.314 1.00 0.00 C ATOM 1884 C LYS A 123 11.068 1.903 -10.684 1.00 0.00 C ATOM 1885 O LYS A 123 10.879 2.666 -11.632 1.00 0.00 O ATOM 1886 CB LYS A 123 13.007 2.398 -9.170 1.00 0.00 C ATOM 1887 CG LYS A 123 13.734 3.247 -10.202 1.00 0.00 C ATOM 1888 CD LYS A 123 15.242 3.186 -10.020 1.00 0.00 C ATOM 1889 CE LYS A 123 15.969 4.028 -11.059 1.00 0.00 C ATOM 1890 NZ LYS A 123 15.756 3.524 -12.443 1.00 0.00 N ATOM 0 H LYS A 123 11.486 1.084 -7.706 1.00 0.00 H new ATOM 0 HA LYS A 123 11.159 3.470 -9.216 1.00 0.00 H new ATOM 0 HB2 LYS A 123 13.278 2.742 -8.172 1.00 0.00 H new ATOM 0 HB3 LYS A 123 13.348 1.366 -9.255 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.474 2.904 -11.203 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.400 4.281 -10.123 1.00 0.00 H new ATOM 0 HD2 LYS A 123 15.502 3.536 -9.021 1.00 0.00 H new ATOM 0 HD3 LYS A 123 15.576 2.151 -10.092 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.624 5.060 -10.993 1.00 0.00 H new ATOM 0 HE3 LYS A 123 17.036 4.034 -10.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.422 3.993 -13.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.916 2.497 -12.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.781 3.729 -12.741 1.00 0.00 H new ATOM 1904 N ALA A 124 10.911 0.585 -10.764 1.00 0.00 N ATOM 1905 CA ALA A 124 10.474 -0.075 -11.986 1.00 0.00 C ATOM 1906 C ALA A 124 9.055 0.346 -12.357 1.00 0.00 C ATOM 1907 O ALA A 124 8.768 0.631 -13.519 1.00 0.00 O ATOM 1908 CB ALA A 124 10.558 -1.588 -11.823 1.00 0.00 C ATOM 0 H ALA A 124 11.083 -0.052 -9.986 1.00 0.00 H new ATOM 0 HA ALA A 124 11.136 0.229 -12.797 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.229 -2.072 -12.743 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.588 -1.874 -11.611 1.00 0.00 H new ATOM 0 HB3 ALA A 124 9.917 -1.901 -10.999 1.00 0.00 H new ATOM 1914 N ALA A 125 8.172 0.389 -11.365 1.00 0.00 N ATOM 1915 CA ALA A 125 6.788 0.802 -11.586 1.00 0.00 C ATOM 1916 C ALA A 125 6.686 2.310 -11.797 1.00 0.00 C ATOM 1917 O ALA A 125 5.766 2.795 -12.457 1.00 0.00 O ATOM 1918 CB ALA A 125 5.913 0.379 -10.417 1.00 0.00 C ATOM 0 H ALA A 125 8.389 0.143 -10.399 1.00 0.00 H new ATOM 0 HA ALA A 125 6.435 0.308 -12.491 1.00 0.00 H new ATOM 0 HB1 ALA A 125 4.886 0.695 -10.599 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.946 -0.705 -10.311 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.279 0.844 -9.502 1.00 0.00 H new ATOM 1924 N GLY A 126 7.630 3.045 -11.228 1.00 0.00 N ATOM 1925 CA GLY A 126 7.629 4.488 -11.366 1.00 0.00 C ATOM 1926 C GLY A 126 7.005 5.174 -10.168 1.00 0.00 C ATOM 1927 O GLY A 126 6.218 6.111 -10.317 1.00 0.00 O ATOM 0 H GLY A 126 8.398 2.668 -10.672 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.653 4.840 -11.493 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.083 4.765 -12.267 1.00 0.00 H new ATOM 1931 N PHE A 127 7.348 4.700 -8.981 1.00 0.00 N ATOM 1932 CA PHE A 127 6.841 5.275 -7.746 1.00 0.00 C ATOM 1933 C PHE A 127 7.914 6.132 -7.082 1.00 0.00 C ATOM 1934 O PHE A 127 9.092 5.773 -7.081 1.00 0.00 O ATOM 1935 CB PHE A 127 6.394 4.176 -6.778 1.00 0.00 C ATOM 1936 CG PHE A 127 5.277 3.307 -7.293 1.00 0.00 C ATOM 1937 CD1 PHE A 127 4.219 3.851 -8.002 1.00 0.00 C ATOM 1938 CD2 PHE A 127 5.283 1.941 -7.056 1.00 0.00 C ATOM 1939 CE1 PHE A 127 3.190 3.052 -8.466 1.00 0.00 C ATOM 1940 CE2 PHE A 127 4.256 1.136 -7.515 1.00 0.00 C ATOM 1941 CZ PHE A 127 3.209 1.693 -8.221 1.00 0.00 C ATOM 0 H PHE A 127 7.981 3.912 -8.847 1.00 0.00 H new ATOM 0 HA PHE A 127 5.981 5.898 -7.992 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.251 3.544 -6.545 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.076 4.639 -5.844 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.197 4.913 -8.195 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.101 1.499 -6.506 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.373 3.490 -9.019 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.273 0.074 -7.321 1.00 0.00 H new ATOM 0 HZ PHE A 127 2.406 1.067 -8.581 1.00 0.00 H new ATOM 1951 N LYS A 128 7.504 7.267 -6.537 1.00 0.00 N ATOM 1952 CA LYS A 128 8.419 8.155 -5.830 1.00 0.00 C ATOM 1953 C LYS A 128 8.228 8.004 -4.325 1.00 0.00 C ATOM 1954 O LYS A 128 7.105 7.791 -3.857 1.00 0.00 O ATOM 1955 CB LYS A 128 8.179 9.611 -6.242 1.00 0.00 C ATOM 1956 CG LYS A 128 6.824 10.146 -5.807 1.00 0.00 C ATOM 1957 CD LYS A 128 6.594 11.565 -6.293 1.00 0.00 C ATOM 1958 CE LYS A 128 5.301 12.137 -5.732 1.00 0.00 C ATOM 1959 NZ LYS A 128 4.137 11.251 -6.000 1.00 0.00 N ATOM 0 H LYS A 128 6.540 7.597 -6.570 1.00 0.00 H new ATOM 0 HA LYS A 128 9.441 7.883 -6.092 1.00 0.00 H new ATOM 0 HB2 LYS A 128 8.963 10.236 -5.814 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.263 9.693 -7.326 1.00 0.00 H new ATOM 0 HG2 LYS A 128 6.037 9.498 -6.193 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.755 10.119 -4.720 1.00 0.00 H new ATOM 0 HD2 LYS A 128 7.432 12.194 -5.995 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.558 11.577 -7.382 1.00 0.00 H new ATOM 0 HE2 LYS A 128 5.406 12.283 -4.657 1.00 0.00 H new ATOM 0 HE3 LYS A 128 5.118 13.118 -6.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 3.259 11.743 -5.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.111 11.008 -7.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 4.226 10.381 -5.437 1.00 0.00 H new ATOM 1973 N GLU A 129 9.311 8.111 -3.569 1.00 0.00 N ATOM 1974 CA GLU A 129 9.233 7.966 -2.123 1.00 0.00 C ATOM 1975 C GLU A 129 8.788 9.269 -1.475 1.00 0.00 C ATOM 1976 O GLU A 129 9.175 10.358 -1.899 1.00 0.00 O ATOM 1977 CB GLU A 129 10.574 7.540 -1.506 1.00 0.00 C ATOM 1978 CG GLU A 129 11.531 6.859 -2.469 1.00 0.00 C ATOM 1979 CD GLU A 129 12.392 7.851 -3.221 1.00 0.00 C ATOM 1980 OE1 GLU A 129 13.492 8.188 -2.725 1.00 0.00 O ATOM 1981 OE2 GLU A 129 11.973 8.307 -4.303 1.00 0.00 O ATOM 0 H GLU A 129 10.247 8.296 -3.929 1.00 0.00 H new ATOM 0 HA GLU A 129 8.501 7.182 -1.931 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.064 8.421 -1.092 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.377 6.864 -0.674 1.00 0.00 H new ATOM 0 HG2 GLU A 129 12.171 6.172 -1.916 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.962 6.262 -3.182 1.00 0.00 H new ATOM 1988 N VAL A 130 7.973 9.135 -0.447 1.00 0.00 N ATOM 1989 CA VAL A 130 7.570 10.251 0.382 1.00 0.00 C ATOM 1990 C VAL A 130 8.194 10.075 1.760 1.00 0.00 C ATOM 1991 O VAL A 130 7.635 9.432 2.652 1.00 0.00 O ATOM 1992 CB VAL A 130 6.026 10.384 0.465 1.00 0.00 C ATOM 1993 CG1 VAL A 130 5.598 11.315 1.593 1.00 0.00 C ATOM 1994 CG2 VAL A 130 5.490 10.892 -0.855 1.00 0.00 C ATOM 0 H VAL A 130 7.570 8.242 -0.163 1.00 0.00 H new ATOM 0 HA VAL A 130 7.926 11.179 -0.065 1.00 0.00 H new ATOM 0 HB VAL A 130 5.614 9.398 0.678 1.00 0.00 H new ATOM 0 HG11 VAL A 130 4.510 11.381 1.617 1.00 0.00 H new ATOM 0 HG12 VAL A 130 5.959 10.924 2.544 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.018 12.307 1.425 1.00 0.00 H new ATOM 0 HG21 VAL A 130 4.406 10.985 -0.796 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.926 11.866 -1.074 1.00 0.00 H new ATOM 0 HG23 VAL A 130 5.751 10.191 -1.648 1.00 0.00 H new ATOM 2004 N LYS A 131 9.398 10.599 1.889 1.00 0.00 N ATOM 2005 CA LYS A 131 10.180 10.462 3.103 1.00 0.00 C ATOM 2006 C LYS A 131 9.669 11.446 4.149 1.00 0.00 C ATOM 2007 O LYS A 131 10.044 12.620 4.147 1.00 0.00 O ATOM 2008 CB LYS A 131 11.649 10.725 2.769 1.00 0.00 C ATOM 2009 CG LYS A 131 12.639 10.347 3.857 1.00 0.00 C ATOM 2010 CD LYS A 131 14.066 10.527 3.360 1.00 0.00 C ATOM 2011 CE LYS A 131 14.326 9.674 2.125 1.00 0.00 C ATOM 2012 NZ LYS A 131 15.602 10.031 1.452 1.00 0.00 N ATOM 0 H LYS A 131 9.862 11.132 1.154 1.00 0.00 H new ATOM 0 HA LYS A 131 10.085 9.455 3.510 1.00 0.00 H new ATOM 0 HB2 LYS A 131 11.903 10.175 1.863 1.00 0.00 H new ATOM 0 HB3 LYS A 131 11.769 11.785 2.543 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.473 10.965 4.739 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.480 9.312 4.159 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.243 11.577 3.125 1.00 0.00 H new ATOM 0 HD3 LYS A 131 14.767 10.254 4.149 1.00 0.00 H new ATOM 0 HE2 LYS A 131 14.350 8.622 2.411 1.00 0.00 H new ATOM 0 HE3 LYS A 131 13.501 9.794 1.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.736 9.425 0.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 15.571 11.027 1.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 16.393 9.891 2.112 1.00 0.00 H new ATOM 2026 N LEU A 132 8.772 10.963 5.000 1.00 0.00 N ATOM 2027 CA LEU A 132 8.133 11.791 6.015 1.00 0.00 C ATOM 2028 C LEU A 132 9.165 12.438 6.939 1.00 0.00 C ATOM 2029 O LEU A 132 9.957 11.750 7.586 1.00 0.00 O ATOM 2030 CB LEU A 132 7.107 10.976 6.830 1.00 0.00 C ATOM 2031 CG LEU A 132 7.647 9.742 7.573 1.00 0.00 C ATOM 2032 CD1 LEU A 132 6.681 9.328 8.672 1.00 0.00 C ATOM 2033 CD2 LEU A 132 7.865 8.578 6.613 1.00 0.00 C ATOM 0 H LEU A 132 8.468 9.989 5.006 1.00 0.00 H new ATOM 0 HA LEU A 132 7.601 12.589 5.498 1.00 0.00 H new ATOM 0 HB2 LEU A 132 6.647 11.640 7.561 1.00 0.00 H new ATOM 0 HB3 LEU A 132 6.317 10.649 6.154 1.00 0.00 H new ATOM 0 HG LEU A 132 8.606 10.008 8.017 1.00 0.00 H new ATOM 0 HD11 LEU A 132 7.074 8.454 9.191 1.00 0.00 H new ATOM 0 HD12 LEU A 132 6.563 10.148 9.380 1.00 0.00 H new ATOM 0 HD13 LEU A 132 5.713 9.085 8.233 1.00 0.00 H new ATOM 0 HD21 LEU A 132 8.247 7.719 7.164 1.00 0.00 H new ATOM 0 HD22 LEU A 132 6.919 8.314 6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 132 8.585 8.868 5.848 1.00 0.00 H new ATOM 2045 N GLU A 133 9.133 13.771 6.971 1.00 0.00 N ATOM 2046 CA GLU A 133 10.050 14.584 7.769 1.00 0.00 C ATOM 2047 C GLU A 133 11.485 14.488 7.265 1.00 0.00 C ATOM 2048 O GLU A 133 12.256 13.625 7.686 1.00 0.00 O ATOM 2049 CB GLU A 133 9.991 14.227 9.256 1.00 0.00 C ATOM 2050 CG GLU A 133 8.751 14.751 9.958 1.00 0.00 C ATOM 2051 CD GLU A 133 8.778 14.490 11.447 1.00 0.00 C ATOM 2052 OE1 GLU A 133 9.578 15.136 12.153 1.00 0.00 O ATOM 2053 OE2 GLU A 133 8.001 13.631 11.920 1.00 0.00 O ATOM 0 H GLU A 133 8.461 14.322 6.437 1.00 0.00 H new ATOM 0 HA GLU A 133 9.716 15.615 7.654 1.00 0.00 H new ATOM 0 HB2 GLU A 133 10.028 13.143 9.363 1.00 0.00 H new ATOM 0 HB3 GLU A 133 10.875 14.626 9.752 1.00 0.00 H new ATOM 0 HG2 GLU A 133 8.662 15.823 9.781 1.00 0.00 H new ATOM 0 HG3 GLU A 133 7.867 14.283 9.526 1.00 0.00 H new ATOM 2060 N HIS A 134 11.834 15.387 6.353 1.00 0.00 N ATOM 2061 CA HIS A 134 13.205 15.498 5.878 1.00 0.00 C ATOM 2062 C HIS A 134 14.047 16.216 6.922 1.00 0.00 C ATOM 2063 O HIS A 134 14.088 17.447 6.973 1.00 0.00 O ATOM 2064 CB HIS A 134 13.265 16.241 4.539 1.00 0.00 C ATOM 2065 CG HIS A 134 12.610 15.501 3.413 1.00 0.00 C ATOM 2066 ND1 HIS A 134 11.304 15.715 3.034 1.00 0.00 N ATOM 2067 CD2 HIS A 134 13.089 14.544 2.583 1.00 0.00 C ATOM 2068 CE1 HIS A 134 11.005 14.922 2.023 1.00 0.00 C ATOM 2069 NE2 HIS A 134 12.070 14.203 1.730 1.00 0.00 N ATOM 0 H HIS A 134 11.185 16.050 5.928 1.00 0.00 H new ATOM 0 HA HIS A 134 13.603 14.496 5.720 1.00 0.00 H new ATOM 0 HB2 HIS A 134 12.786 17.214 4.651 1.00 0.00 H new ATOM 0 HB3 HIS A 134 14.308 16.427 4.283 1.00 0.00 H new ATOM 0 HD2 HIS A 134 14.085 14.128 2.591 1.00 0.00 H new ATOM 0 HE1 HIS A 134 10.050 14.871 1.521 1.00 0.00 H new ATOM 0 HE2 HIS A 134 12.127 13.505 0.988 1.00 0.00 H new ATOM 2078 N HIS A 135 14.688 15.437 7.777 1.00 0.00 N ATOM 2079 CA HIS A 135 15.475 15.983 8.867 1.00 0.00 C ATOM 2080 C HIS A 135 16.884 16.312 8.387 1.00 0.00 C ATOM 2081 O HIS A 135 17.523 15.501 7.720 1.00 0.00 O ATOM 2082 CB HIS A 135 15.525 14.982 10.029 1.00 0.00 C ATOM 2083 CG HIS A 135 15.955 15.582 11.334 1.00 0.00 C ATOM 2084 ND1 HIS A 135 15.070 15.872 12.349 1.00 0.00 N ATOM 2085 CD2 HIS A 135 17.180 15.941 11.790 1.00 0.00 C ATOM 2086 CE1 HIS A 135 15.730 16.388 13.371 1.00 0.00 C ATOM 2087 NE2 HIS A 135 17.013 16.440 13.057 1.00 0.00 N ATOM 0 H HIS A 135 14.678 14.418 7.735 1.00 0.00 H new ATOM 0 HA HIS A 135 15.006 16.903 9.216 1.00 0.00 H new ATOM 0 HB2 HIS A 135 14.538 14.536 10.154 1.00 0.00 H new ATOM 0 HB3 HIS A 135 16.209 14.174 9.770 1.00 0.00 H new ATOM 0 HD2 HIS A 135 18.114 15.851 11.255 1.00 0.00 H new ATOM 0 HE1 HIS A 135 15.295 16.712 14.305 1.00 0.00 H new ATOM 0 HE2 HIS A 135 17.757 16.793 13.658 1.00 0.00 H new ATOM 2096 N HIS A 136 17.360 17.505 8.720 1.00 0.00 N ATOM 2097 CA HIS A 136 18.702 17.925 8.331 1.00 0.00 C ATOM 2098 C HIS A 136 19.474 18.444 9.535 1.00 0.00 C ATOM 2099 O HIS A 136 18.946 19.207 10.345 1.00 0.00 O ATOM 2100 CB HIS A 136 18.660 18.988 7.218 1.00 0.00 C ATOM 2101 CG HIS A 136 17.929 20.249 7.582 1.00 0.00 C ATOM 2102 ND1 HIS A 136 18.558 21.385 8.051 1.00 0.00 N ATOM 2103 CD2 HIS A 136 16.613 20.551 7.524 1.00 0.00 C ATOM 2104 CE1 HIS A 136 17.659 22.324 8.267 1.00 0.00 C ATOM 2105 NE2 HIS A 136 16.471 21.846 7.955 1.00 0.00 N ATOM 0 H HIS A 136 16.839 18.198 9.257 1.00 0.00 H new ATOM 0 HA HIS A 136 19.219 17.050 7.937 1.00 0.00 H new ATOM 0 HB2 HIS A 136 19.682 19.244 6.940 1.00 0.00 H new ATOM 0 HB3 HIS A 136 18.189 18.553 6.336 1.00 0.00 H new ATOM 0 HD2 HIS A 136 15.820 19.894 7.199 1.00 0.00 H new ATOM 0 HE1 HIS A 136 17.862 23.318 8.637 1.00 0.00 H new ATOM 0 HE2 HIS A 136 15.590 22.355 8.023 1.00 0.00 H new ATOM 2114 N HIS A 137 20.719 18.014 9.651 1.00 0.00 N ATOM 2115 CA HIS A 137 21.585 18.443 10.738 1.00 0.00 C ATOM 2116 C HIS A 137 22.449 19.606 10.263 1.00 0.00 C ATOM 2117 O HIS A 137 22.434 20.688 10.846 1.00 0.00 O ATOM 2118 CB HIS A 137 22.452 17.262 11.194 1.00 0.00 C ATOM 2119 CG HIS A 137 23.352 17.556 12.356 1.00 0.00 C ATOM 2120 ND1 HIS A 137 22.946 17.443 13.666 1.00 0.00 N ATOM 2121 CD2 HIS A 137 24.650 17.929 12.398 1.00 0.00 C ATOM 2122 CE1 HIS A 137 23.955 17.735 14.462 1.00 0.00 C ATOM 2123 NE2 HIS A 137 25.005 18.032 13.718 1.00 0.00 N ATOM 0 H HIS A 137 21.156 17.362 9.000 1.00 0.00 H new ATOM 0 HA HIS A 137 20.988 18.779 11.586 1.00 0.00 H new ATOM 0 HB2 HIS A 137 21.799 16.431 11.459 1.00 0.00 H new ATOM 0 HB3 HIS A 137 23.063 16.932 10.354 1.00 0.00 H new ATOM 0 HD2 HIS A 137 25.290 18.112 11.548 1.00 0.00 H new ATOM 0 HE1 HIS A 137 23.928 17.732 15.542 1.00 0.00 H new ATOM 0 HE2 HIS A 137 25.927 18.294 14.067 1.00 0.00 H new ATOM 2132 N HIS A 138 23.183 19.367 9.186 1.00 0.00 N ATOM 2133 CA HIS A 138 23.991 20.390 8.531 1.00 0.00 C ATOM 2134 C HIS A 138 24.343 19.923 7.128 1.00 0.00 C ATOM 2135 O HIS A 138 23.810 20.429 6.142 1.00 0.00 O ATOM 2136 CB HIS A 138 25.271 20.704 9.321 1.00 0.00 C ATOM 2137 CG HIS A 138 25.154 21.907 10.209 1.00 0.00 C ATOM 2138 ND1 HIS A 138 25.662 21.957 11.490 1.00 0.00 N ATOM 2139 CD2 HIS A 138 24.598 23.122 9.982 1.00 0.00 C ATOM 2140 CE1 HIS A 138 25.419 23.147 12.010 1.00 0.00 C ATOM 2141 NE2 HIS A 138 24.777 23.869 11.117 1.00 0.00 N ATOM 0 H HIS A 138 23.236 18.452 8.738 1.00 0.00 H new ATOM 0 HA HIS A 138 23.407 21.309 8.485 1.00 0.00 H new ATOM 0 HB2 HIS A 138 25.533 19.839 9.930 1.00 0.00 H new ATOM 0 HB3 HIS A 138 26.091 20.860 8.620 1.00 0.00 H new ATOM 0 HD2 HIS A 138 24.106 23.442 9.076 1.00 0.00 H new ATOM 0 HE1 HIS A 138 25.700 23.472 13.001 1.00 0.00 H new ATOM 0 HE2 HIS A 138 24.463 24.830 11.248 1.00 0.00 H new ATOM 2150 N HIS A 139 25.234 18.945 7.056 1.00 0.00 N ATOM 2151 CA HIS A 139 25.587 18.294 5.802 1.00 0.00 C ATOM 2152 C HIS A 139 26.371 17.023 6.096 1.00 0.00 C ATOM 2153 O HIS A 139 27.607 17.014 5.934 1.00 0.00 O ATOM 2154 CB HIS A 139 26.371 19.233 4.861 1.00 0.00 C ATOM 2155 CG HIS A 139 27.528 19.954 5.489 1.00 0.00 C ATOM 2156 ND1 HIS A 139 28.774 19.395 5.646 1.00 0.00 N ATOM 2157 CD2 HIS A 139 27.622 21.211 5.981 1.00 0.00 C ATOM 2158 CE1 HIS A 139 29.585 20.272 6.204 1.00 0.00 C ATOM 2159 NE2 HIS A 139 28.911 21.386 6.417 1.00 0.00 N ATOM 2160 OXT HIS A 139 25.747 16.050 6.556 1.00 0.00 O ATOM 0 H HIS A 139 25.734 18.580 7.867 1.00 0.00 H new ATOM 0 HA HIS A 139 24.667 18.034 5.278 1.00 0.00 H new ATOM 0 HB2 HIS A 139 26.743 18.649 4.019 1.00 0.00 H new ATOM 0 HB3 HIS A 139 25.681 19.973 4.456 1.00 0.00 H new ATOM 0 HD1 HIS A 139 29.032 18.447 5.373 1.00 0.00 H new ATOM 0 HD2 HIS A 139 26.828 21.942 6.023 1.00 0.00 H new ATOM 0 HE1 HIS A 139 30.625 20.107 6.446 1.00 0.00 H new TER 2169 HIS A 139