USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=47 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 97 GLN : amide:sc= -0.15 K(o=1,f=-10!) USER MOD Set 1.2: A 110 LYS NZ :NH3+ 174:sc= 1.17 (180deg=0) USER MOD Set 2.1: A 74 THR OG1 : rot 178:sc= -1.99! USER MOD Set 2.2: A 81 GLN : amide:sc= 0 K(o=-2,f=-3) USER MOD Set 3.1: A 33 GLN :FLIP amide:sc= -3.58 F(o=-7.6!,f=-5) USER MOD Set 3.2: A 88 MET CE :methyl -130:sc= -1.47 (180deg=-4.1!) USER MOD Set 4.1: A 9 LYS NZ :NH3+ -179:sc= 1.77 (180deg=0.515) USER MOD Set 4.2: A 22 THR OG1 : rot 100:sc= 0.336 USER MOD Set 5.1: A 8 LYS NZ :NH3+ -160:sc= 1.98 (180deg=-0.0716) USER MOD Set 5.2: A 25 TYR OH : rot 69:sc= 1.85 USER MOD Single : A 1 MET CE :methyl 155:sc= -0.23 (180deg=-1.03) USER MOD Single : A 1 MET N :NH3+ -160:sc= 1.23 (180deg=0.979) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.294 K(o=-0.29,f=-4!) USER MOD Single : A 15 ASN : amide:sc= -0.276 K(o=-0.28,f=-1.2) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -113:sc= -0.131 (180deg=-0.44) USER MOD Single : A 32 LYS NZ :NH3+ 160:sc= 0.994 (180deg=0.753) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -148:sc= -3.76! USER MOD Single : A 38 LYS NZ :NH3+ 158:sc= 1.1 (180deg=0.745) USER MOD Single : A 40 GLN :FLIP amide:sc= -0.143 F(o=-0.86,f=-0.14) USER MOD Single : A 43 SER OG : rot -121:sc= -1.13! USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00663) USER MOD Single : A 54 LYS NZ :NH3+ 143:sc= -0.896 (180deg=-2.8!) USER MOD Single : A 55 THR OG1 : rot 74:sc= 1.2 USER MOD Single : A 60 SER OG : rot -70:sc= 0.45 USER MOD Single : A 62 LYS NZ :NH3+ -179:sc= 1.27 (180deg=1.26) USER MOD Single : A 63 TYR OH : rot 85:sc= 1.2 USER MOD Single : A 64 LYS NZ :NH3+ 138:sc= 0.054 (180deg=-2.22!) USER MOD Single : A 65 ASN : amide:sc= -0.0347 X(o=-0.035,f=-0.13) USER MOD Single : A 72 LYS NZ :NH3+ -167:sc= -0.0233 (180deg=-0.204) USER MOD Single : A 75 TYR OH : rot -139:sc= -2.44 USER MOD Single : A 76 THR OG1 : rot -59:sc= 2.08 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 ASN :FLIP amide:sc= -0.335 F(o=-1.1,f=-0.33) 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 100 SER OG : rot 48:sc= 0.235 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -103:sc= 0.928 (180deg=-0.746!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 MET CE :methyl -129:sc= -1.69 (180deg=-9.59!) USER MOD Single : A 117 GLN : amide:sc= -2.17! C(o=-2.2!,f=-14!) USER MOD Single : A 118 MET CE :methyl -161:sc= -3.19 (180deg=-3.88!) USER MOD Single : A 122 MET CE :methyl -179:sc= -4.01! (180deg=-4.02!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 166:sc= -0.0133 (180deg=-0.191) USER MOD Single : A 131 LYS NZ :NH3+ 172:sc= 0.603 (180deg=0.459) USER MOD Single : A 134 HIS : no HD1:sc= -0.633 X(o=-0.63,f=-0.29) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 137 HIS : no HD1:sc= 1.03 K(o=1,f=-3.9!) USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 21.761 3.366 14.284 1.00 0.00 N ATOM 2 CA MET A 1 21.551 4.834 14.321 1.00 0.00 C ATOM 3 C MET A 1 20.238 5.203 13.632 1.00 0.00 C ATOM 4 O MET A 1 19.273 5.596 14.284 1.00 0.00 O ATOM 5 CB MET A 1 22.721 5.546 13.635 1.00 0.00 C ATOM 6 CG MET A 1 22.571 7.059 13.569 1.00 0.00 C ATOM 7 SD MET A 1 23.901 7.844 12.636 1.00 0.00 S ATOM 8 CE MET A 1 23.710 7.050 11.040 1.00 0.00 C ATOM 0 H1 MET A 1 22.444 3.094 15.019 1.00 0.00 H new ATOM 0 H2 MET A 1 20.857 2.882 14.456 1.00 0.00 H new ATOM 0 H3 MET A 1 22.129 3.091 13.351 1.00 0.00 H new ATOM 0 HA MET A 1 21.499 5.153 15.362 1.00 0.00 H new ATOM 0 HB2 MET A 1 23.642 5.305 14.166 1.00 0.00 H new ATOM 0 HB3 MET A 1 22.826 5.157 12.622 1.00 0.00 H new ATOM 0 HG2 MET A 1 21.614 7.306 13.110 1.00 0.00 H new ATOM 0 HG3 MET A 1 22.553 7.464 14.581 1.00 0.00 H new ATOM 0 HE1 MET A 1 24.117 7.695 10.262 1.00 0.00 H new ATOM 0 HE2 MET A 1 24.245 6.100 11.040 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.652 6.871 10.847 1.00 0.00 H new ATOM 20 N GLY A 2 20.211 5.063 12.317 1.00 0.00 N ATOM 21 CA GLY A 2 19.008 5.321 11.551 1.00 0.00 C ATOM 22 C GLY A 2 18.774 4.188 10.589 1.00 0.00 C ATOM 23 O GLY A 2 18.543 4.395 9.401 1.00 0.00 O ATOM 0 H GLY A 2 21.013 4.771 11.758 1.00 0.00 H new ATOM 0 HA2 GLY A 2 18.154 5.427 12.220 1.00 0.00 H new ATOM 0 HA3 GLY A 2 19.105 6.260 11.007 1.00 0.00 H new ATOM 27 N ASP A 3 18.858 2.987 11.132 1.00 0.00 N ATOM 28 CA ASP A 3 18.935 1.770 10.338 1.00 0.00 C ATOM 29 C ASP A 3 18.105 0.653 10.961 1.00 0.00 C ATOM 30 O ASP A 3 18.049 -0.461 10.439 1.00 0.00 O ATOM 31 CB ASP A 3 20.402 1.342 10.244 1.00 0.00 C ATOM 32 CG ASP A 3 21.137 1.541 11.561 1.00 0.00 C ATOM 33 OD1 ASP A 3 21.029 0.676 12.451 1.00 0.00 O ATOM 34 OD2 ASP A 3 21.797 2.598 11.729 1.00 0.00 O ATOM 0 H ASP A 3 18.875 2.826 12.139 1.00 0.00 H new ATOM 0 HA ASP A 3 18.533 1.966 9.344 1.00 0.00 H new ATOM 0 HB2 ASP A 3 20.456 0.293 9.953 1.00 0.00 H new ATOM 0 HB3 ASP A 3 20.898 1.916 9.461 1.00 0.00 H new ATOM 39 N LYS A 4 17.454 0.958 12.073 1.00 0.00 N ATOM 40 CA LYS A 4 16.677 -0.037 12.791 1.00 0.00 C ATOM 41 C LYS A 4 15.207 0.356 12.814 1.00 0.00 C ATOM 42 O LYS A 4 14.827 1.332 13.466 1.00 0.00 O ATOM 43 CB LYS A 4 17.221 -0.214 14.211 1.00 0.00 C ATOM 44 CG LYS A 4 16.440 -1.213 15.050 1.00 0.00 C ATOM 45 CD LYS A 4 17.173 -1.556 16.340 1.00 0.00 C ATOM 46 CE LYS A 4 17.503 -0.313 17.154 1.00 0.00 C ATOM 47 NZ LYS A 4 18.216 -0.655 18.411 1.00 0.00 N ATOM 0 H LYS A 4 17.449 1.886 12.496 1.00 0.00 H new ATOM 0 HA LYS A 4 16.764 -0.992 12.274 1.00 0.00 H new ATOM 0 HB2 LYS A 4 18.261 -0.537 14.154 1.00 0.00 H new ATOM 0 HB3 LYS A 4 17.215 0.752 14.715 1.00 0.00 H new ATOM 0 HG2 LYS A 4 15.459 -0.802 15.287 1.00 0.00 H new ATOM 0 HG3 LYS A 4 16.274 -2.122 14.473 1.00 0.00 H new ATOM 0 HD2 LYS A 4 16.559 -2.229 16.938 1.00 0.00 H new ATOM 0 HD3 LYS A 4 18.093 -2.090 16.103 1.00 0.00 H new ATOM 0 HE2 LYS A 4 18.119 0.360 16.558 1.00 0.00 H new ATOM 0 HE3 LYS A 4 16.583 0.222 17.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 18.425 0.216 18.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 17.618 -1.277 18.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 19.106 -1.143 18.184 1.00 0.00 H new ATOM 61 N GLU A 5 14.404 -0.416 12.088 1.00 0.00 N ATOM 62 CA GLU A 5 12.973 -0.167 11.941 1.00 0.00 C ATOM 63 C GLU A 5 12.745 1.125 11.164 1.00 0.00 C ATOM 64 O GLU A 5 12.498 2.188 11.742 1.00 0.00 O ATOM 65 CB GLU A 5 12.265 -0.121 13.303 1.00 0.00 C ATOM 66 CG GLU A 5 10.751 0.014 13.205 1.00 0.00 C ATOM 67 CD GLU A 5 10.086 0.106 14.561 1.00 0.00 C ATOM 68 OE1 GLU A 5 9.980 1.229 15.100 1.00 0.00 O ATOM 69 OE2 GLU A 5 9.674 -0.941 15.097 1.00 0.00 O ATOM 0 H GLU A 5 14.730 -1.239 11.581 1.00 0.00 H new ATOM 0 HA GLU A 5 12.540 -0.995 11.381 1.00 0.00 H new ATOM 0 HB2 GLU A 5 12.504 -1.029 13.857 1.00 0.00 H new ATOM 0 HB3 GLU A 5 12.659 0.717 13.878 1.00 0.00 H new ATOM 0 HG2 GLU A 5 10.506 0.903 12.623 1.00 0.00 H new ATOM 0 HG3 GLU A 5 10.348 -0.842 12.664 1.00 0.00 H new ATOM 76 N GLU A 6 12.869 1.024 9.850 1.00 0.00 N ATOM 77 CA GLU A 6 12.704 2.170 8.972 1.00 0.00 C ATOM 78 C GLU A 6 11.299 2.197 8.390 1.00 0.00 C ATOM 79 O GLU A 6 10.769 1.161 7.984 1.00 0.00 O ATOM 80 CB GLU A 6 13.716 2.117 7.827 1.00 0.00 C ATOM 81 CG GLU A 6 15.166 2.192 8.266 1.00 0.00 C ATOM 82 CD GLU A 6 16.120 1.973 7.109 1.00 0.00 C ATOM 83 OE1 GLU A 6 16.135 2.811 6.178 1.00 0.00 O ATOM 84 OE2 GLU A 6 16.825 0.945 7.107 1.00 0.00 O ATOM 0 H GLU A 6 13.085 0.153 9.366 1.00 0.00 H new ATOM 0 HA GLU A 6 12.870 3.071 9.562 1.00 0.00 H new ATOM 0 HB2 GLU A 6 13.566 1.193 7.269 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.514 2.940 7.142 1.00 0.00 H new ATOM 0 HG2 GLU A 6 15.359 3.166 8.716 1.00 0.00 H new ATOM 0 HG3 GLU A 6 15.351 1.443 9.036 1.00 0.00 H new ATOM 91 N SER A 7 10.704 3.377 8.349 1.00 0.00 N ATOM 92 CA SER A 7 9.406 3.540 7.724 1.00 0.00 C ATOM 93 C SER A 7 9.605 4.062 6.305 1.00 0.00 C ATOM 94 O SER A 7 10.052 5.194 6.099 1.00 0.00 O ATOM 95 CB SER A 7 8.536 4.504 8.539 1.00 0.00 C ATOM 96 OG SER A 7 7.224 4.589 8.007 1.00 0.00 O ATOM 0 H SER A 7 11.099 4.232 8.740 1.00 0.00 H new ATOM 0 HA SER A 7 8.893 2.579 7.688 1.00 0.00 H new ATOM 0 HB2 SER A 7 8.490 4.168 9.575 1.00 0.00 H new ATOM 0 HB3 SER A 7 8.993 5.493 8.545 1.00 0.00 H new ATOM 0 HG SER A 7 6.691 5.209 8.547 1.00 0.00 H new ATOM 102 N LYS A 8 9.287 3.227 5.329 1.00 0.00 N ATOM 103 CA LYS A 8 9.526 3.565 3.940 1.00 0.00 C ATOM 104 C LYS A 8 8.196 3.720 3.211 1.00 0.00 C ATOM 105 O LYS A 8 7.594 2.739 2.780 1.00 0.00 O ATOM 106 CB LYS A 8 10.359 2.462 3.280 1.00 0.00 C ATOM 107 CG LYS A 8 11.343 2.949 2.224 1.00 0.00 C ATOM 108 CD LYS A 8 12.461 3.773 2.844 1.00 0.00 C ATOM 109 CE LYS A 8 13.606 4.009 1.868 1.00 0.00 C ATOM 110 NZ LYS A 8 14.369 2.763 1.570 1.00 0.00 N ATOM 0 H LYS A 8 8.863 2.311 5.475 1.00 0.00 H new ATOM 0 HA LYS A 8 10.072 4.507 3.885 1.00 0.00 H new ATOM 0 HB2 LYS A 8 10.912 1.931 4.055 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.683 1.741 2.821 1.00 0.00 H new ATOM 0 HG2 LYS A 8 11.768 2.094 1.699 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.816 3.549 1.482 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.063 4.732 3.175 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.839 3.262 3.730 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.209 4.419 0.939 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.284 4.756 2.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.307 3.011 1.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.481 2.208 2.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.852 2.200 0.865 1.00 0.00 H new ATOM 124 N LYS A 9 7.720 4.951 3.117 1.00 0.00 N ATOM 125 CA LYS A 9 6.501 5.234 2.380 1.00 0.00 C ATOM 126 C LYS A 9 6.849 5.675 0.967 1.00 0.00 C ATOM 127 O LYS A 9 7.622 6.605 0.778 1.00 0.00 O ATOM 128 CB LYS A 9 5.683 6.339 3.073 1.00 0.00 C ATOM 129 CG LYS A 9 4.349 6.635 2.391 1.00 0.00 C ATOM 130 CD LYS A 9 3.744 7.960 2.854 1.00 0.00 C ATOM 131 CE LYS A 9 3.297 7.930 4.313 1.00 0.00 C ATOM 132 NZ LYS A 9 2.101 7.067 4.529 1.00 0.00 N ATOM 0 H LYS A 9 8.159 5.768 3.541 1.00 0.00 H new ATOM 0 HA LYS A 9 5.901 4.325 2.348 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.496 6.046 4.106 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.276 7.253 3.103 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.493 6.661 1.311 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.649 5.826 2.599 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.477 8.755 2.720 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.890 8.204 2.222 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.118 7.569 4.933 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.072 8.945 4.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.829 7.095 5.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.312 7.414 3.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.326 6.088 4.259 1.00 0.00 H new ATOM 146 N PHE A 10 6.319 4.995 -0.026 1.00 0.00 N ATOM 147 CA PHE A 10 6.413 5.494 -1.382 1.00 0.00 C ATOM 148 C PHE A 10 5.044 6.002 -1.777 1.00 0.00 C ATOM 149 O PHE A 10 4.036 5.394 -1.420 1.00 0.00 O ATOM 150 CB PHE A 10 6.918 4.423 -2.369 1.00 0.00 C ATOM 151 CG PHE A 10 5.860 3.493 -2.913 1.00 0.00 C ATOM 152 CD1 PHE A 10 5.031 3.896 -3.951 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.707 2.217 -2.401 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.069 3.049 -4.460 1.00 0.00 C ATOM 155 CE2 PHE A 10 4.745 1.365 -2.909 1.00 0.00 C ATOM 156 CZ PHE A 10 3.925 1.783 -3.940 1.00 0.00 C ATOM 0 H PHE A 10 5.825 4.108 0.076 1.00 0.00 H new ATOM 0 HA PHE A 10 7.147 6.298 -1.422 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.402 4.925 -3.207 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.682 3.825 -1.871 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.141 4.887 -4.366 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.346 1.883 -1.596 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.430 3.379 -5.266 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.634 0.372 -2.500 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.173 1.117 -4.337 1.00 0.00 H new ATOM 166 N SER A 11 4.989 7.116 -2.475 1.00 0.00 N ATOM 167 CA SER A 11 3.700 7.672 -2.848 1.00 0.00 C ATOM 168 C SER A 11 3.687 8.150 -4.294 1.00 0.00 C ATOM 169 O SER A 11 4.592 8.852 -4.747 1.00 0.00 O ATOM 170 CB SER A 11 3.303 8.799 -1.885 1.00 0.00 C ATOM 171 OG SER A 11 2.107 9.442 -2.295 1.00 0.00 O ATOM 0 H SER A 11 5.800 7.647 -2.791 1.00 0.00 H new ATOM 0 HA SER A 11 2.959 6.877 -2.770 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.172 8.392 -0.882 1.00 0.00 H new ATOM 0 HB3 SER A 11 4.109 9.531 -1.829 1.00 0.00 H new ATOM 0 HG SER A 11 1.883 10.153 -1.659 1.00 0.00 H new ATOM 177 N ALA A 12 2.655 7.737 -5.014 1.00 0.00 N ATOM 178 CA ALA A 12 2.444 8.151 -6.388 1.00 0.00 C ATOM 179 C ALA A 12 0.986 8.531 -6.592 1.00 0.00 C ATOM 180 O ALA A 12 0.080 7.771 -6.238 1.00 0.00 O ATOM 181 CB ALA A 12 2.844 7.045 -7.349 1.00 0.00 C ATOM 0 H ALA A 12 1.939 7.103 -4.658 1.00 0.00 H new ATOM 0 HA ALA A 12 3.070 9.020 -6.593 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.678 7.376 -8.374 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.899 6.807 -7.211 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.243 6.157 -7.152 1.00 0.00 H new ATOM 187 N ASN A 13 0.764 9.705 -7.149 1.00 0.00 N ATOM 188 CA ASN A 13 -0.583 10.227 -7.318 1.00 0.00 C ATOM 189 C ASN A 13 -1.001 10.091 -8.776 1.00 0.00 C ATOM 190 O ASN A 13 -0.611 10.901 -9.618 1.00 0.00 O ATOM 191 CB ASN A 13 -0.658 11.702 -6.886 1.00 0.00 C ATOM 192 CG ASN A 13 -0.200 11.949 -5.451 1.00 0.00 C ATOM 193 OD1 ASN A 13 0.662 11.251 -4.916 1.00 0.00 O ATOM 194 ND2 ASN A 13 -0.772 12.954 -4.812 1.00 0.00 N ATOM 0 H ASN A 13 1.501 10.320 -7.495 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.261 9.653 -6.687 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.045 12.300 -7.561 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.685 12.051 -6.995 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.502 13.168 -3.852 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.483 13.516 -5.279 1.00 0.00 H new ATOM 201 N LEU A 14 -1.770 9.054 -9.078 1.00 0.00 N ATOM 202 CA LEU A 14 -2.134 8.762 -10.456 1.00 0.00 C ATOM 203 C LEU A 14 -3.599 8.356 -10.579 1.00 0.00 C ATOM 204 O LEU A 14 -4.134 7.662 -9.716 1.00 0.00 O ATOM 205 CB LEU A 14 -1.207 7.670 -11.018 1.00 0.00 C ATOM 206 CG LEU A 14 -1.068 6.396 -10.169 1.00 0.00 C ATOM 207 CD1 LEU A 14 -2.164 5.390 -10.493 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.304 5.772 -10.372 1.00 0.00 C ATOM 0 H LEU A 14 -2.152 8.404 -8.391 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.007 9.671 -11.044 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.571 7.386 -12.005 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.215 8.100 -11.156 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.175 6.678 -9.122 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.036 4.501 -9.875 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.138 5.835 -10.291 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.103 5.112 -11.545 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.387 4.871 -9.764 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.435 5.514 -11.423 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.075 6.483 -10.074 1.00 0.00 H new ATOM 220 N ASN A 15 -4.247 8.838 -11.641 1.00 0.00 N ATOM 221 CA ASN A 15 -5.624 8.455 -11.983 1.00 0.00 C ATOM 222 C ASN A 15 -6.599 8.804 -10.851 1.00 0.00 C ATOM 223 O ASN A 15 -7.653 8.184 -10.703 1.00 0.00 O ATOM 224 CB ASN A 15 -5.690 6.953 -12.309 1.00 0.00 C ATOM 225 CG ASN A 15 -6.980 6.552 -13.007 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.577 7.343 -13.742 1.00 0.00 O ATOM 227 ND2 ASN A 15 -7.419 5.323 -12.787 1.00 0.00 N ATOM 0 H ASN A 15 -3.834 9.506 -12.291 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.924 9.022 -12.864 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.843 6.687 -12.942 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.590 6.382 -11.386 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -8.279 5.001 -13.232 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.898 4.698 -12.173 1.00 0.00 H new ATOM 234 N GLY A 16 -6.255 9.815 -10.063 1.00 0.00 N ATOM 235 CA GLY A 16 -7.088 10.195 -8.934 1.00 0.00 C ATOM 236 C GLY A 16 -6.975 9.214 -7.783 1.00 0.00 C ATOM 237 O GLY A 16 -7.797 9.215 -6.865 1.00 0.00 O ATOM 0 H GLY A 16 -5.414 10.380 -10.184 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.801 11.189 -8.591 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.128 10.257 -9.256 1.00 0.00 H new ATOM 241 N THR A 17 -5.969 8.362 -7.846 1.00 0.00 N ATOM 242 CA THR A 17 -5.684 7.428 -6.778 1.00 0.00 C ATOM 243 C THR A 17 -4.297 7.713 -6.217 1.00 0.00 C ATOM 244 O THR A 17 -3.285 7.323 -6.800 1.00 0.00 O ATOM 245 CB THR A 17 -5.753 5.970 -7.273 1.00 0.00 C ATOM 246 OG1 THR A 17 -6.948 5.777 -8.041 1.00 0.00 O ATOM 247 CG2 THR A 17 -5.740 4.996 -6.104 1.00 0.00 C ATOM 0 H THR A 17 -5.329 8.299 -8.638 1.00 0.00 H new ATOM 0 HA THR A 17 -6.437 7.556 -6.000 1.00 0.00 H new ATOM 0 HB THR A 17 -4.878 5.778 -7.894 1.00 0.00 H new ATOM 0 HG1 THR A 17 -6.988 4.850 -8.356 1.00 0.00 H new ATOM 0 HG21 THR A 17 -5.790 3.974 -6.481 1.00 0.00 H new ATOM 0 HG22 THR A 17 -4.822 5.127 -5.531 1.00 0.00 H new ATOM 0 HG23 THR A 17 -6.599 5.188 -5.461 1.00 0.00 H new ATOM 255 N GLU A 18 -4.254 8.434 -5.110 1.00 0.00 N ATOM 256 CA GLU A 18 -2.988 8.805 -4.505 1.00 0.00 C ATOM 257 C GLU A 18 -2.492 7.653 -3.632 1.00 0.00 C ATOM 258 O GLU A 18 -2.916 7.494 -2.487 1.00 0.00 O ATOM 259 CB GLU A 18 -3.147 10.102 -3.696 1.00 0.00 C ATOM 260 CG GLU A 18 -4.079 11.108 -4.367 1.00 0.00 C ATOM 261 CD GLU A 18 -3.860 12.543 -3.917 1.00 0.00 C ATOM 262 OE1 GLU A 18 -4.060 12.842 -2.725 1.00 0.00 O ATOM 263 OE2 GLU A 18 -3.505 13.387 -4.766 1.00 0.00 O ATOM 0 H GLU A 18 -5.078 8.773 -4.614 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.246 8.994 -5.281 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.532 9.862 -2.705 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.168 10.559 -3.555 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.943 11.051 -5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.112 10.826 -4.161 1.00 0.00 H new ATOM 270 N ILE A 19 -1.622 6.834 -4.205 1.00 0.00 N ATOM 271 CA ILE A 19 -1.172 5.604 -3.561 1.00 0.00 C ATOM 272 C ILE A 19 0.090 5.845 -2.744 1.00 0.00 C ATOM 273 O ILE A 19 1.078 6.350 -3.264 1.00 0.00 O ATOM 274 CB ILE A 19 -0.879 4.506 -4.611 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.110 4.270 -5.492 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.454 3.210 -3.931 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.877 3.287 -6.620 1.00 0.00 C ATOM 0 H ILE A 19 -1.209 7.000 -5.123 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.975 5.274 -2.901 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.058 4.845 -5.243 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.927 3.906 -4.869 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.431 5.223 -5.914 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.253 2.451 -4.687 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.448 3.386 -3.344 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.253 2.865 -3.274 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.794 3.173 -7.198 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -1.083 3.658 -7.268 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.586 2.321 -6.207 1.00 0.00 H new ATOM 289 N ALA A 20 0.046 5.488 -1.472 1.00 0.00 N ATOM 290 CA ALA A 20 1.224 5.570 -0.627 1.00 0.00 C ATOM 291 C ALA A 20 1.359 4.314 0.223 1.00 0.00 C ATOM 292 O ALA A 20 0.650 4.129 1.210 1.00 0.00 O ATOM 293 CB ALA A 20 1.180 6.812 0.249 1.00 0.00 C ATOM 0 H ALA A 20 -0.790 5.140 -1.003 1.00 0.00 H new ATOM 0 HA ALA A 20 2.100 5.645 -1.271 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.074 6.850 0.872 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.139 7.700 -0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.295 6.778 0.885 1.00 0.00 H new ATOM 299 N ILE A 21 2.265 3.441 -0.180 1.00 0.00 N ATOM 300 CA ILE A 21 2.530 2.229 0.570 1.00 0.00 C ATOM 301 C ILE A 21 3.684 2.461 1.534 1.00 0.00 C ATOM 302 O ILE A 21 4.812 2.728 1.124 1.00 0.00 O ATOM 303 CB ILE A 21 2.833 1.031 -0.354 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.596 0.689 -1.194 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.281 -0.176 0.459 1.00 0.00 C ATOM 306 CD1 ILE A 21 1.815 -0.438 -2.182 1.00 0.00 C ATOM 0 H ILE A 21 2.829 3.550 -1.023 1.00 0.00 H new ATOM 0 HA ILE A 21 1.630 1.982 1.133 1.00 0.00 H new ATOM 0 HB ILE A 21 3.646 1.306 -1.026 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.779 0.419 -0.525 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.281 1.580 -1.738 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.489 -1.009 -0.212 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.183 0.075 1.017 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.491 -0.459 1.155 1.00 0.00 H new ATOM 0 HD11 ILE A 21 0.895 -0.619 -2.737 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.609 -0.164 -2.876 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.099 -1.343 -1.645 1.00 0.00 H new ATOM 318 N THR A 22 3.372 2.390 2.813 1.00 0.00 N ATOM 319 CA THR A 22 4.337 2.613 3.867 1.00 0.00 C ATOM 320 C THR A 22 4.765 1.284 4.466 1.00 0.00 C ATOM 321 O THR A 22 4.037 0.692 5.260 1.00 0.00 O ATOM 322 CB THR A 22 3.718 3.490 4.964 1.00 0.00 C ATOM 323 OG1 THR A 22 2.961 4.538 4.346 1.00 0.00 O ATOM 324 CG2 THR A 22 4.788 4.086 5.865 1.00 0.00 C ATOM 0 H THR A 22 2.434 2.174 3.151 1.00 0.00 H new ATOM 0 HA THR A 22 5.207 3.118 3.447 1.00 0.00 H new ATOM 0 HB THR A 22 3.069 2.871 5.584 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.010 4.303 4.355 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.317 4.702 6.631 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.352 3.283 6.340 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.463 4.701 5.270 1.00 0.00 H new ATOM 332 N TYR A 23 5.922 0.797 4.067 1.00 0.00 N ATOM 333 CA TYR A 23 6.397 -0.479 4.563 1.00 0.00 C ATOM 334 C TYR A 23 7.532 -0.290 5.560 1.00 0.00 C ATOM 335 O TYR A 23 8.503 0.422 5.300 1.00 0.00 O ATOM 336 CB TYR A 23 6.808 -1.406 3.408 1.00 0.00 C ATOM 337 CG TYR A 23 7.693 -0.768 2.360 1.00 0.00 C ATOM 338 CD1 TYR A 23 7.141 -0.060 1.299 1.00 0.00 C ATOM 339 CD2 TYR A 23 9.073 -0.887 2.420 1.00 0.00 C ATOM 340 CE1 TYR A 23 7.941 0.518 0.334 1.00 0.00 C ATOM 341 CE2 TYR A 23 9.880 -0.314 1.458 1.00 0.00 C ATOM 342 CZ TYR A 23 9.308 0.388 0.419 1.00 0.00 C ATOM 343 OH TYR A 23 10.110 0.959 -0.542 1.00 0.00 O ATOM 0 H TYR A 23 6.546 1.260 3.407 1.00 0.00 H new ATOM 0 HA TYR A 23 5.574 -0.961 5.090 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.327 -2.270 3.823 1.00 0.00 H new ATOM 0 HB3 TYR A 23 5.906 -1.778 2.922 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.068 0.040 1.228 1.00 0.00 H new ATOM 0 HD2 TYR A 23 9.524 -1.437 3.233 1.00 0.00 H new ATOM 0 HE1 TYR A 23 7.497 1.069 -0.482 1.00 0.00 H new ATOM 0 HE2 TYR A 23 10.954 -0.415 1.519 1.00 0.00 H new ATOM 0 HH TYR A 23 11.050 0.776 -0.335 1.00 0.00 H new ATOM 353 N VAL A 24 7.372 -0.908 6.716 1.00 0.00 N ATOM 354 CA VAL A 24 8.374 -0.871 7.765 1.00 0.00 C ATOM 355 C VAL A 24 9.276 -2.093 7.643 1.00 0.00 C ATOM 356 O VAL A 24 8.811 -3.236 7.722 1.00 0.00 O ATOM 357 CB VAL A 24 7.708 -0.816 9.161 1.00 0.00 C ATOM 358 CG1 VAL A 24 8.692 -1.145 10.275 1.00 0.00 C ATOM 359 CG2 VAL A 24 7.081 0.551 9.390 1.00 0.00 C ATOM 0 H VAL A 24 6.542 -1.451 6.954 1.00 0.00 H new ATOM 0 HA VAL A 24 8.976 0.031 7.652 1.00 0.00 H new ATOM 0 HB VAL A 24 6.927 -1.576 9.184 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.182 -1.095 11.237 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.088 -2.150 10.126 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.512 -0.427 10.260 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.616 0.577 10.375 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.852 1.319 9.332 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.325 0.737 8.627 1.00 0.00 H new ATOM 369 N TYR A 25 10.556 -1.852 7.420 1.00 0.00 N ATOM 370 CA TYR A 25 11.485 -2.938 7.158 1.00 0.00 C ATOM 371 C TYR A 25 12.698 -2.873 8.071 1.00 0.00 C ATOM 372 O TYR A 25 12.958 -1.855 8.720 1.00 0.00 O ATOM 373 CB TYR A 25 11.925 -2.932 5.686 1.00 0.00 C ATOM 374 CG TYR A 25 12.769 -1.739 5.274 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.221 -0.464 5.182 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.115 -1.895 4.966 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.990 0.617 4.796 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.889 -0.818 4.575 1.00 0.00 C ATOM 379 CZ TYR A 25 14.323 0.436 4.491 1.00 0.00 C ATOM 380 OH TYR A 25 15.090 1.513 4.096 1.00 0.00 O ATOM 0 H TYR A 25 10.974 -0.922 7.415 1.00 0.00 H new ATOM 0 HA TYR A 25 10.962 -3.871 7.366 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.489 -3.843 5.487 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.036 -2.964 5.056 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.177 -0.316 5.416 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.564 -2.875 5.033 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.549 1.601 4.733 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.933 -0.959 4.336 1.00 0.00 H new ATOM 0 HH TYR A 25 15.215 2.121 4.854 1.00 0.00 H new ATOM 390 N LYS A 26 13.421 -3.978 8.121 1.00 0.00 N ATOM 391 CA LYS A 26 14.640 -4.079 8.900 1.00 0.00 C ATOM 392 C LYS A 26 15.657 -4.924 8.142 1.00 0.00 C ATOM 393 O LYS A 26 15.583 -6.155 8.138 1.00 0.00 O ATOM 394 CB LYS A 26 14.342 -4.668 10.284 1.00 0.00 C ATOM 395 CG LYS A 26 14.346 -3.623 11.392 1.00 0.00 C ATOM 396 CD LYS A 26 13.899 -4.189 12.733 1.00 0.00 C ATOM 397 CE LYS A 26 12.420 -4.543 12.730 1.00 0.00 C ATOM 398 NZ LYS A 26 11.931 -4.926 14.081 1.00 0.00 N ATOM 0 H LYS A 26 13.177 -4.833 7.620 1.00 0.00 H new ATOM 0 HA LYS A 26 15.061 -3.085 9.051 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.370 -5.161 10.261 1.00 0.00 H new ATOM 0 HB3 LYS A 26 15.082 -5.434 10.513 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.350 -3.210 11.493 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.689 -2.800 11.112 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.485 -5.078 12.966 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.097 -3.461 13.519 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.845 -3.692 12.365 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.246 -5.365 12.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.919 -5.159 14.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 12.460 -5.755 14.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.071 -4.133 14.739 1.00 0.00 H new ATOM 412 N GLY A 27 16.587 -4.251 7.480 1.00 0.00 N ATOM 413 CA GLY A 27 17.528 -4.934 6.616 1.00 0.00 C ATOM 414 C GLY A 27 16.936 -5.177 5.243 1.00 0.00 C ATOM 415 O GLY A 27 16.211 -4.332 4.721 1.00 0.00 O ATOM 0 H GLY A 27 16.707 -3.239 7.526 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.437 -4.340 6.523 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.814 -5.885 7.065 1.00 0.00 H new ATOM 419 N ASP A 28 17.221 -6.332 4.658 1.00 0.00 N ATOM 420 CA ASP A 28 16.642 -6.687 3.364 1.00 0.00 C ATOM 421 C ASP A 28 15.290 -7.356 3.560 1.00 0.00 C ATOM 422 O ASP A 28 14.665 -7.823 2.604 1.00 0.00 O ATOM 423 CB ASP A 28 17.562 -7.619 2.568 1.00 0.00 C ATOM 424 CG ASP A 28 18.861 -6.961 2.153 1.00 0.00 C ATOM 425 OD1 ASP A 28 18.828 -6.029 1.325 1.00 0.00 O ATOM 426 OD2 ASP A 28 19.927 -7.384 2.652 1.00 0.00 O ATOM 0 H ASP A 28 17.844 -7.036 5.053 1.00 0.00 H new ATOM 0 HA ASP A 28 16.519 -5.764 2.797 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.784 -8.500 3.169 1.00 0.00 H new ATOM 0 HB3 ASP A 28 17.036 -7.965 1.678 1.00 0.00 H new ATOM 431 N LYS A 29 14.838 -7.385 4.803 1.00 0.00 N ATOM 432 CA LYS A 29 13.597 -8.047 5.146 1.00 0.00 C ATOM 433 C LYS A 29 12.521 -7.022 5.487 1.00 0.00 C ATOM 434 O LYS A 29 12.619 -6.314 6.493 1.00 0.00 O ATOM 435 CB LYS A 29 13.810 -8.986 6.338 1.00 0.00 C ATOM 436 CG LYS A 29 13.048 -10.299 6.233 1.00 0.00 C ATOM 437 CD LYS A 29 11.550 -10.072 6.113 1.00 0.00 C ATOM 438 CE LYS A 29 10.784 -11.379 6.075 1.00 0.00 C ATOM 439 NZ LYS A 29 9.318 -11.154 5.982 1.00 0.00 N ATOM 0 H LYS A 29 15.318 -6.954 5.593 1.00 0.00 H new ATOM 0 HA LYS A 29 13.270 -8.629 4.285 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.874 -9.202 6.432 1.00 0.00 H new ATOM 0 HB3 LYS A 29 13.506 -8.473 7.251 1.00 0.00 H new ATOM 0 HG2 LYS A 29 13.402 -10.857 5.366 1.00 0.00 H new ATOM 0 HG3 LYS A 29 13.254 -10.911 7.111 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.205 -9.473 6.955 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.340 -9.501 5.208 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.116 -11.971 5.222 1.00 0.00 H new ATOM 0 HE3 LYS A 29 11.007 -11.958 6.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.861 -11.473 6.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.130 -10.141 5.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.935 -11.691 5.178 1.00 0.00 H new ATOM 453 N VAL A 30 11.510 -6.933 4.639 1.00 0.00 N ATOM 454 CA VAL A 30 10.342 -6.121 4.941 1.00 0.00 C ATOM 455 C VAL A 30 9.422 -6.911 5.863 1.00 0.00 C ATOM 456 O VAL A 30 9.077 -8.060 5.573 1.00 0.00 O ATOM 457 CB VAL A 30 9.572 -5.713 3.669 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.481 -4.709 4.006 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.520 -5.146 2.621 1.00 0.00 C ATOM 0 H VAL A 30 11.474 -7.411 3.739 1.00 0.00 H new ATOM 0 HA VAL A 30 10.681 -5.204 5.423 1.00 0.00 H new ATOM 0 HB VAL A 30 9.103 -6.604 3.253 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.948 -4.432 3.097 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.783 -5.155 4.715 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.929 -3.820 4.449 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.954 -4.865 1.733 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.024 -4.267 3.023 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.262 -5.899 2.356 1.00 0.00 H new ATOM 469 N LEU A 31 9.051 -6.312 6.983 1.00 0.00 N ATOM 470 CA LEU A 31 8.304 -7.028 8.007 1.00 0.00 C ATOM 471 C LEU A 31 6.864 -6.535 8.094 1.00 0.00 C ATOM 472 O LEU A 31 5.950 -7.309 8.372 1.00 0.00 O ATOM 473 CB LEU A 31 9.010 -6.876 9.358 1.00 0.00 C ATOM 474 CG LEU A 31 10.450 -7.403 9.388 1.00 0.00 C ATOM 475 CD1 LEU A 31 11.113 -7.106 10.717 1.00 0.00 C ATOM 476 CD2 LEU A 31 10.479 -8.895 9.121 1.00 0.00 C ATOM 0 H LEU A 31 9.253 -5.337 7.206 1.00 0.00 H new ATOM 0 HA LEU A 31 8.270 -8.083 7.735 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.017 -5.821 9.633 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.429 -7.399 10.118 1.00 0.00 H new ATOM 0 HG LEU A 31 11.005 -6.891 8.602 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.133 -7.491 10.709 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.133 -6.029 10.881 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.551 -7.584 11.519 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.510 -9.249 9.147 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.898 -9.413 9.885 1.00 0.00 H new ATOM 0 HD23 LEU A 31 10.050 -9.097 8.140 1.00 0.00 H new ATOM 488 N LYS A 32 6.659 -5.254 7.846 1.00 0.00 N ATOM 489 CA LYS A 32 5.329 -4.671 7.920 1.00 0.00 C ATOM 490 C LYS A 32 5.031 -3.840 6.686 1.00 0.00 C ATOM 491 O LYS A 32 5.928 -3.235 6.104 1.00 0.00 O ATOM 492 CB LYS A 32 5.209 -3.793 9.163 1.00 0.00 C ATOM 493 CG LYS A 32 5.200 -4.554 10.475 1.00 0.00 C ATOM 494 CD LYS A 32 3.846 -5.180 10.744 1.00 0.00 C ATOM 495 CE LYS A 32 3.764 -5.712 12.160 1.00 0.00 C ATOM 496 NZ LYS A 32 4.506 -6.989 12.331 1.00 0.00 N ATOM 0 H LYS A 32 7.396 -4.596 7.591 1.00 0.00 H new ATOM 0 HA LYS A 32 4.607 -5.486 7.976 1.00 0.00 H new ATOM 0 HB2 LYS A 32 6.039 -3.086 9.174 1.00 0.00 H new ATOM 0 HB3 LYS A 32 4.292 -3.208 9.091 1.00 0.00 H new ATOM 0 HG2 LYS A 32 5.963 -5.332 10.451 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.458 -3.879 11.291 1.00 0.00 H new ATOM 0 HD2 LYS A 32 3.061 -4.440 10.584 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.669 -5.990 10.037 1.00 0.00 H new ATOM 0 HE2 LYS A 32 4.164 -4.968 12.848 1.00 0.00 H new ATOM 0 HE3 LYS A 32 2.718 -5.864 12.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 4.712 -7.139 13.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.928 -7.777 11.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 5.398 -6.946 11.798 1.00 0.00 H new ATOM 510 N GLN A 33 3.771 -3.814 6.295 1.00 0.00 N ATOM 511 CA GLN A 33 3.341 -3.028 5.156 1.00 0.00 C ATOM 512 C GLN A 33 2.049 -2.288 5.469 1.00 0.00 C ATOM 513 O GLN A 33 1.173 -2.808 6.145 1.00 0.00 O ATOM 514 CB GLN A 33 3.133 -3.940 3.949 1.00 0.00 C ATOM 515 CG GLN A 33 2.703 -3.207 2.690 1.00 0.00 C ATOM 516 CD GLN A 33 2.490 -4.142 1.518 1.00 0.00 C ATOM 517 OE1 GLN A 33 2.719 -3.644 0.317 1.00 0.00 O flip ATOM 518 NE2 GLN A 33 2.126 -5.302 1.690 1.00 0.00 N flip ATOM 0 H GLN A 33 3.023 -4.333 6.754 1.00 0.00 H new ATOM 0 HA GLN A 33 4.115 -2.294 4.930 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.060 -4.476 3.747 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.380 -4.688 4.197 1.00 0.00 H new ATOM 0 HG2 GLN A 33 1.780 -2.662 2.888 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.460 -2.468 2.428 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.959 -5.650 2.634 1.00 0.00 H new ATOM 0 HE22 GLN A 33 1.990 -5.918 0.888 1.00 0.00 H new ATOM 527 N SER A 34 1.964 -1.054 5.023 1.00 0.00 N ATOM 528 CA SER A 34 0.718 -0.319 5.041 1.00 0.00 C ATOM 529 C SER A 34 0.390 0.158 3.631 1.00 0.00 C ATOM 530 O SER A 34 1.068 1.018 3.085 1.00 0.00 O ATOM 531 CB SER A 34 0.817 0.871 5.999 1.00 0.00 C ATOM 532 OG SER A 34 1.195 0.448 7.300 1.00 0.00 O ATOM 0 H SER A 34 2.753 -0.533 4.639 1.00 0.00 H new ATOM 0 HA SER A 34 -0.080 -0.973 5.391 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.546 1.588 5.620 1.00 0.00 H new ATOM 0 HB3 SER A 34 -0.143 1.386 6.045 1.00 0.00 H new ATOM 0 HG SER A 34 1.253 1.226 7.893 1.00 0.00 H new ATOM 538 N SER A 35 -0.649 -0.404 3.051 1.00 0.00 N ATOM 539 CA SER A 35 -1.064 -0.031 1.715 1.00 0.00 C ATOM 540 C SER A 35 -2.193 0.978 1.823 1.00 0.00 C ATOM 541 O SER A 35 -3.340 0.628 2.091 1.00 0.00 O ATOM 542 CB SER A 35 -1.519 -1.268 0.935 1.00 0.00 C ATOM 543 OG SER A 35 -0.510 -2.265 0.939 1.00 0.00 O ATOM 0 H SER A 35 -1.225 -1.125 3.486 1.00 0.00 H new ATOM 0 HA SER A 35 -0.227 0.414 1.177 1.00 0.00 H new ATOM 0 HB2 SER A 35 -2.432 -1.667 1.377 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.757 -0.989 -0.091 1.00 0.00 H new ATOM 0 HG SER A 35 -0.821 -3.047 0.437 1.00 0.00 H new ATOM 549 N GLU A 36 -1.834 2.239 1.665 1.00 0.00 N ATOM 550 CA GLU A 36 -2.750 3.333 1.888 1.00 0.00 C ATOM 551 C GLU A 36 -3.016 4.078 0.582 1.00 0.00 C ATOM 552 O GLU A 36 -2.142 4.753 0.037 1.00 0.00 O ATOM 553 CB GLU A 36 -2.151 4.227 2.977 1.00 0.00 C ATOM 554 CG GLU A 36 -2.544 5.694 2.924 1.00 0.00 C ATOM 555 CD GLU A 36 -1.764 6.523 3.931 1.00 0.00 C ATOM 556 OE1 GLU A 36 -0.562 6.798 3.693 1.00 0.00 O ATOM 557 OE2 GLU A 36 -2.344 6.881 4.976 1.00 0.00 O ATOM 0 H GLU A 36 -0.899 2.529 1.379 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.721 2.974 2.229 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.443 3.828 3.948 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -1.065 4.160 2.918 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.369 6.081 1.920 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.611 5.792 3.121 1.00 0.00 H new ATOM 564 N THR A 37 -4.218 3.904 0.065 1.00 0.00 N ATOM 565 CA THR A 37 -4.620 4.516 -1.185 1.00 0.00 C ATOM 566 C THR A 37 -5.678 5.588 -0.949 1.00 0.00 C ATOM 567 O THR A 37 -6.597 5.406 -0.151 1.00 0.00 O ATOM 568 CB THR A 37 -5.182 3.456 -2.149 1.00 0.00 C ATOM 569 OG1 THR A 37 -6.129 2.644 -1.455 1.00 0.00 O ATOM 570 CG2 THR A 37 -4.074 2.584 -2.718 1.00 0.00 C ATOM 0 H THR A 37 -4.943 3.334 0.501 1.00 0.00 H new ATOM 0 HA THR A 37 -3.737 4.977 -1.627 1.00 0.00 H new ATOM 0 HB THR A 37 -5.667 3.967 -2.981 1.00 0.00 H new ATOM 0 HG1 THR A 37 -6.111 1.735 -1.821 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.504 1.846 -3.395 1.00 0.00 H new ATOM 0 HG22 THR A 37 -3.365 3.207 -3.263 1.00 0.00 H new ATOM 0 HG23 THR A 37 -3.558 2.074 -1.904 1.00 0.00 H new ATOM 578 N LYS A 38 -5.532 6.711 -1.622 1.00 0.00 N ATOM 579 CA LYS A 38 -6.523 7.769 -1.557 1.00 0.00 C ATOM 580 C LYS A 38 -7.290 7.836 -2.871 1.00 0.00 C ATOM 581 O LYS A 38 -6.804 8.389 -3.858 1.00 0.00 O ATOM 582 CB LYS A 38 -5.841 9.098 -1.255 1.00 0.00 C ATOM 583 CG LYS A 38 -6.788 10.279 -1.149 1.00 0.00 C ATOM 584 CD LYS A 38 -6.010 11.555 -0.915 1.00 0.00 C ATOM 585 CE LYS A 38 -6.875 12.792 -1.035 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.045 14.019 -1.132 1.00 0.00 N ATOM 0 H LYS A 38 -4.734 6.916 -2.223 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.231 7.558 -0.756 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.289 9.005 -0.319 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.110 9.303 -2.037 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.376 10.366 -2.063 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.491 10.118 -0.332 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.560 11.525 0.077 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.193 11.616 -1.634 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.512 12.710 -1.916 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -7.535 12.863 -0.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.600 14.779 -1.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.750 14.315 -0.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.203 13.824 -1.710 1.00 0.00 H new ATOM 600 N ILE A 39 -8.477 7.251 -2.881 1.00 0.00 N ATOM 601 CA ILE A 39 -9.276 7.160 -4.094 1.00 0.00 C ATOM 602 C ILE A 39 -10.291 8.294 -4.154 1.00 0.00 C ATOM 603 O ILE A 39 -11.126 8.442 -3.260 1.00 0.00 O ATOM 604 CB ILE A 39 -10.029 5.808 -4.200 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.066 4.619 -4.092 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.811 5.733 -5.506 1.00 0.00 C ATOM 607 CD1 ILE A 39 -8.766 4.195 -2.670 1.00 0.00 C ATOM 0 H ILE A 39 -8.911 6.830 -2.059 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.581 7.234 -4.931 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.727 5.753 -3.365 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -9.490 3.772 -4.631 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.130 4.877 -4.588 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.333 4.778 -5.563 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.536 6.546 -5.543 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.124 5.822 -6.347 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.078 3.349 -2.680 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -8.311 5.026 -2.131 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -9.692 3.904 -2.174 1.00 0.00 H new ATOM 619 N GLN A 40 -10.206 9.104 -5.197 1.00 0.00 N ATOM 620 CA GLN A 40 -11.181 10.159 -5.422 1.00 0.00 C ATOM 621 C GLN A 40 -12.500 9.558 -5.901 1.00 0.00 C ATOM 622 O GLN A 40 -12.503 8.581 -6.655 1.00 0.00 O ATOM 623 CB GLN A 40 -10.665 11.158 -6.460 1.00 0.00 C ATOM 624 CG GLN A 40 -9.366 11.849 -6.071 1.00 0.00 C ATOM 625 CD GLN A 40 -9.492 12.662 -4.800 1.00 0.00 C ATOM 626 OE1 GLN A 40 -9.146 12.063 -3.670 1.00 0.00 O flip ATOM 627 NE2 GLN A 40 -9.876 13.830 -4.835 1.00 0.00 N flip ATOM 0 H GLN A 40 -9.471 9.051 -5.902 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.343 10.684 -4.480 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.517 10.637 -7.406 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.430 11.916 -6.629 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.586 11.099 -5.941 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -9.049 12.502 -6.884 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -10.134 14.256 -5.725 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.937 14.373 -3.974 1.00 0.00 H new ATOM 636 N PHE A 41 -13.615 10.140 -5.468 1.00 0.00 N ATOM 637 CA PHE A 41 -14.936 9.660 -5.871 1.00 0.00 C ATOM 638 C PHE A 41 -15.104 9.700 -7.385 1.00 0.00 C ATOM 639 O PHE A 41 -15.770 8.844 -7.966 1.00 0.00 O ATOM 640 CB PHE A 41 -16.042 10.479 -5.199 1.00 0.00 C ATOM 641 CG PHE A 41 -16.447 9.966 -3.843 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.602 9.151 -3.106 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.679 10.304 -3.308 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.982 8.680 -1.863 1.00 0.00 C ATOM 645 CE2 PHE A 41 -18.063 9.836 -2.066 1.00 0.00 C ATOM 646 CZ PHE A 41 -17.213 9.024 -1.342 1.00 0.00 C ATOM 0 H PHE A 41 -13.632 10.943 -4.839 1.00 0.00 H new ATOM 0 HA PHE A 41 -15.019 8.623 -5.545 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.706 11.511 -5.100 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.917 10.490 -5.848 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.636 8.881 -3.507 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.347 10.941 -3.868 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.316 8.043 -1.300 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -19.028 10.105 -1.662 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.511 8.659 -0.370 1.00 0.00 H new ATOM 656 N ALA A 42 -14.473 10.678 -8.023 1.00 0.00 N ATOM 657 CA ALA A 42 -14.547 10.818 -9.471 1.00 0.00 C ATOM 658 C ALA A 42 -13.835 9.663 -10.177 1.00 0.00 C ATOM 659 O ALA A 42 -14.215 9.270 -11.278 1.00 0.00 O ATOM 660 CB ALA A 42 -13.951 12.150 -9.899 1.00 0.00 C ATOM 0 H ALA A 42 -13.904 11.386 -7.560 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.597 10.790 -9.761 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -14.012 12.244 -10.983 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.506 12.964 -9.433 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.907 12.198 -9.588 1.00 0.00 H new ATOM 666 N SER A 43 -12.811 9.118 -9.533 1.00 0.00 N ATOM 667 CA SER A 43 -12.026 8.040 -10.119 1.00 0.00 C ATOM 668 C SER A 43 -12.744 6.701 -9.987 1.00 0.00 C ATOM 669 O SER A 43 -12.790 5.917 -10.936 1.00 0.00 O ATOM 670 CB SER A 43 -10.656 7.977 -9.448 1.00 0.00 C ATOM 671 OG SER A 43 -9.988 9.221 -9.558 1.00 0.00 O ATOM 0 H SER A 43 -12.505 9.405 -8.604 1.00 0.00 H new ATOM 0 HA SER A 43 -11.897 8.245 -11.182 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.772 7.712 -8.397 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.055 7.194 -9.910 1.00 0.00 H new ATOM 0 HG SER A 43 -9.137 9.095 -10.027 1.00 0.00 H new ATOM 677 N ILE A 44 -13.308 6.443 -8.812 1.00 0.00 N ATOM 678 CA ILE A 44 -14.046 5.207 -8.577 1.00 0.00 C ATOM 679 C ILE A 44 -15.397 5.243 -9.297 1.00 0.00 C ATOM 680 O ILE A 44 -15.958 4.205 -9.656 1.00 0.00 O ATOM 681 CB ILE A 44 -14.251 4.947 -7.060 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.087 3.682 -6.830 1.00 0.00 C ATOM 683 CG2 ILE A 44 -14.894 6.149 -6.384 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.362 3.386 -5.370 1.00 0.00 C ATOM 0 H ILE A 44 -13.269 7.071 -8.009 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.453 4.386 -8.980 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.270 4.791 -6.611 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.037 3.785 -7.355 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.569 2.831 -7.272 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.027 5.941 -5.322 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.252 7.021 -6.506 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.865 6.346 -6.839 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -15.958 2.477 -5.289 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.418 3.249 -4.842 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -15.908 4.219 -4.927 1.00 0.00 H new ATOM 696 N GLY A 45 -15.903 6.449 -9.525 1.00 0.00 N ATOM 697 CA GLY A 45 -17.178 6.604 -10.196 1.00 0.00 C ATOM 698 C GLY A 45 -18.339 6.399 -9.247 1.00 0.00 C ATOM 699 O GLY A 45 -19.449 6.064 -9.667 1.00 0.00 O ATOM 0 H GLY A 45 -15.452 7.323 -9.256 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.239 7.599 -10.636 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.247 5.889 -11.015 1.00 0.00 H new ATOM 703 N ALA A 46 -18.080 6.612 -7.965 1.00 0.00 N ATOM 704 CA ALA A 46 -19.084 6.411 -6.934 1.00 0.00 C ATOM 705 C ALA A 46 -20.096 7.545 -6.936 1.00 0.00 C ATOM 706 O ALA A 46 -19.761 8.689 -7.248 1.00 0.00 O ATOM 707 CB ALA A 46 -18.423 6.296 -5.568 1.00 0.00 C ATOM 0 H ALA A 46 -17.176 6.926 -7.614 1.00 0.00 H new ATOM 0 HA ALA A 46 -19.612 5.482 -7.149 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.187 6.146 -4.805 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -17.737 5.449 -5.566 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.871 7.211 -5.353 1.00 0.00 H new ATOM 713 N THR A 47 -21.332 7.220 -6.599 1.00 0.00 N ATOM 714 CA THR A 47 -22.385 8.218 -6.521 1.00 0.00 C ATOM 715 C THR A 47 -22.361 8.908 -5.154 1.00 0.00 C ATOM 716 O THR A 47 -22.369 10.136 -5.061 1.00 0.00 O ATOM 717 CB THR A 47 -23.764 7.575 -6.766 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.737 6.822 -7.990 1.00 0.00 O ATOM 719 CG2 THR A 47 -24.857 8.632 -6.846 1.00 0.00 C ATOM 0 H THR A 47 -21.632 6.271 -6.375 1.00 0.00 H new ATOM 0 HA THR A 47 -22.209 8.963 -7.297 1.00 0.00 H new ATOM 0 HB THR A 47 -23.984 6.914 -5.928 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.615 6.413 -8.142 1.00 0.00 H new ATOM 0 HG21 THR A 47 -25.819 8.149 -7.019 1.00 0.00 H new ATOM 0 HG22 THR A 47 -24.894 9.189 -5.910 1.00 0.00 H new ATOM 0 HG23 THR A 47 -24.642 9.317 -7.666 1.00 0.00 H new ATOM 727 N THR A 48 -22.316 8.104 -4.101 1.00 0.00 N ATOM 728 CA THR A 48 -22.235 8.604 -2.738 1.00 0.00 C ATOM 729 C THR A 48 -21.254 7.759 -1.930 1.00 0.00 C ATOM 730 O THR A 48 -20.660 6.820 -2.462 1.00 0.00 O ATOM 731 CB THR A 48 -23.614 8.578 -2.048 1.00 0.00 C ATOM 732 OG1 THR A 48 -24.188 7.268 -2.156 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.554 9.606 -2.659 1.00 0.00 C ATOM 0 H THR A 48 -22.335 7.086 -4.169 1.00 0.00 H new ATOM 0 HA THR A 48 -21.888 9.636 -2.783 1.00 0.00 H new ATOM 0 HB THR A 48 -23.473 8.829 -0.997 1.00 0.00 H new ATOM 0 HG1 THR A 48 -25.063 7.257 -1.715 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.518 9.564 -2.152 1.00 0.00 H new ATOM 0 HG22 THR A 48 -24.127 10.602 -2.545 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.691 9.389 -3.718 1.00 0.00 H new ATOM 741 N LYS A 49 -21.098 8.078 -0.650 1.00 0.00 N ATOM 742 CA LYS A 49 -20.176 7.347 0.218 1.00 0.00 C ATOM 743 C LYS A 49 -20.619 5.897 0.427 1.00 0.00 C ATOM 744 O LYS A 49 -19.784 5.006 0.577 1.00 0.00 O ATOM 745 CB LYS A 49 -20.016 8.069 1.560 1.00 0.00 C ATOM 746 CG LYS A 49 -21.321 8.565 2.162 1.00 0.00 C ATOM 747 CD LYS A 49 -21.076 9.337 3.449 1.00 0.00 C ATOM 748 CE LYS A 49 -22.327 10.064 3.915 1.00 0.00 C ATOM 749 NZ LYS A 49 -23.433 9.131 4.258 1.00 0.00 N ATOM 0 H LYS A 49 -21.597 8.838 -0.188 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.207 7.319 -0.280 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -19.536 7.393 2.268 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -19.346 8.918 1.425 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.836 9.204 1.444 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -21.977 7.718 2.363 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.743 8.651 4.227 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -20.273 10.057 3.294 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -22.086 10.673 4.786 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -22.660 10.745 3.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -24.245 9.672 4.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -23.718 8.603 3.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -23.111 8.464 4.988 1.00 0.00 H new ATOM 763 N GLU A 50 -21.927 5.656 0.422 1.00 0.00 N ATOM 764 CA GLU A 50 -22.445 4.299 0.554 1.00 0.00 C ATOM 765 C GLU A 50 -22.154 3.502 -0.714 1.00 0.00 C ATOM 766 O GLU A 50 -21.720 2.351 -0.655 1.00 0.00 O ATOM 767 CB GLU A 50 -23.953 4.309 0.829 1.00 0.00 C ATOM 768 CG GLU A 50 -24.531 2.918 1.038 1.00 0.00 C ATOM 769 CD GLU A 50 -26.022 2.929 1.293 1.00 0.00 C ATOM 770 OE1 GLU A 50 -26.427 3.082 2.465 1.00 0.00 O ATOM 771 OE2 GLU A 50 -26.796 2.767 0.325 1.00 0.00 O ATOM 0 H GLU A 50 -22.642 6.377 0.329 1.00 0.00 H new ATOM 0 HA GLU A 50 -21.946 3.826 1.400 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.151 4.915 1.713 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.465 4.787 -0.006 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.323 2.308 0.159 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -24.027 2.444 1.881 1.00 0.00 H new ATOM 778 N ASP A 51 -22.382 4.136 -1.858 1.00 0.00 N ATOM 779 CA ASP A 51 -22.116 3.512 -3.150 1.00 0.00 C ATOM 780 C ASP A 51 -20.623 3.245 -3.313 1.00 0.00 C ATOM 781 O ASP A 51 -20.215 2.289 -3.971 1.00 0.00 O ATOM 782 CB ASP A 51 -22.626 4.400 -4.283 1.00 0.00 C ATOM 783 CG ASP A 51 -22.371 3.817 -5.658 1.00 0.00 C ATOM 784 OD1 ASP A 51 -23.010 2.803 -6.009 1.00 0.00 O ATOM 785 OD2 ASP A 51 -21.539 4.384 -6.396 1.00 0.00 O ATOM 0 H ASP A 51 -22.752 5.085 -1.918 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.644 2.559 -3.192 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -23.697 4.561 -4.156 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -22.147 5.377 -4.215 1.00 0.00 H new ATOM 790 N ALA A 52 -19.811 4.091 -2.695 1.00 0.00 N ATOM 791 CA ALA A 52 -18.373 3.888 -2.682 1.00 0.00 C ATOM 792 C ALA A 52 -18.024 2.611 -1.924 1.00 0.00 C ATOM 793 O ALA A 52 -17.205 1.814 -2.378 1.00 0.00 O ATOM 794 CB ALA A 52 -17.670 5.086 -2.060 1.00 0.00 C ATOM 0 H ALA A 52 -20.125 4.924 -2.197 1.00 0.00 H new ATOM 0 HA ALA A 52 -18.029 3.785 -3.711 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.593 4.916 -2.059 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.895 5.981 -2.639 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -18.017 5.220 -1.036 1.00 0.00 H new ATOM 800 N ALA A 53 -18.673 2.409 -0.780 1.00 0.00 N ATOM 801 CA ALA A 53 -18.408 1.238 0.047 1.00 0.00 C ATOM 802 C ALA A 53 -18.860 -0.043 -0.638 1.00 0.00 C ATOM 803 O ALA A 53 -18.130 -1.026 -0.651 1.00 0.00 O ATOM 804 CB ALA A 53 -19.070 1.364 1.408 1.00 0.00 C ATOM 0 H ALA A 53 -19.383 3.039 -0.407 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.329 1.186 0.190 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.854 0.475 2.001 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -18.684 2.245 1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.148 1.462 1.281 1.00 0.00 H new ATOM 810 N LYS A 54 -20.050 -0.028 -1.232 1.00 0.00 N ATOM 811 CA LYS A 54 -20.579 -1.217 -1.904 1.00 0.00 C ATOM 812 C LYS A 54 -19.699 -1.607 -3.093 1.00 0.00 C ATOM 813 O LYS A 54 -19.826 -2.701 -3.642 1.00 0.00 O ATOM 814 CB LYS A 54 -22.028 -0.993 -2.363 1.00 0.00 C ATOM 815 CG LYS A 54 -22.176 0.074 -3.434 1.00 0.00 C ATOM 816 CD LYS A 54 -23.635 0.374 -3.766 1.00 0.00 C ATOM 817 CE LYS A 54 -24.246 -0.648 -4.719 1.00 0.00 C ATOM 818 NZ LYS A 54 -24.441 -1.977 -4.085 1.00 0.00 N ATOM 0 H LYS A 54 -20.664 0.786 -1.263 1.00 0.00 H new ATOM 0 HA LYS A 54 -20.571 -2.036 -1.185 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.428 -1.933 -2.743 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.633 -0.714 -1.500 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -21.688 0.989 -3.100 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -21.661 -0.250 -4.338 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.216 0.397 -2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -23.705 1.366 -4.211 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -25.206 -0.276 -5.077 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -23.601 -0.757 -5.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -25.324 -2.402 -4.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -23.641 -2.597 -4.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -24.495 -1.865 -3.053 1.00 0.00 H new ATOM 832 N THR A 55 -18.804 -0.703 -3.478 1.00 0.00 N ATOM 833 CA THR A 55 -17.868 -0.962 -4.555 1.00 0.00 C ATOM 834 C THR A 55 -16.501 -1.383 -4.001 1.00 0.00 C ATOM 835 O THR A 55 -15.892 -2.335 -4.484 1.00 0.00 O ATOM 836 CB THR A 55 -17.698 0.285 -5.448 1.00 0.00 C ATOM 837 OG1 THR A 55 -18.984 0.779 -5.853 1.00 0.00 O ATOM 838 CG2 THR A 55 -16.867 -0.035 -6.682 1.00 0.00 C ATOM 0 H THR A 55 -18.711 0.220 -3.054 1.00 0.00 H new ATOM 0 HA THR A 55 -18.275 -1.776 -5.155 1.00 0.00 H new ATOM 0 HB THR A 55 -17.179 1.047 -4.867 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.420 1.217 -5.093 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.763 0.861 -7.293 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.880 -0.382 -6.376 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.362 -0.814 -7.262 1.00 0.00 H new ATOM 846 N LEU A 56 -16.033 -0.683 -2.967 1.00 0.00 N ATOM 847 CA LEU A 56 -14.693 -0.913 -2.426 1.00 0.00 C ATOM 848 C LEU A 56 -14.638 -2.094 -1.460 1.00 0.00 C ATOM 849 O LEU A 56 -13.655 -2.835 -1.456 1.00 0.00 O ATOM 850 CB LEU A 56 -14.171 0.342 -1.725 1.00 0.00 C ATOM 851 CG LEU A 56 -13.876 1.525 -2.644 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.377 2.712 -1.835 1.00 0.00 C ATOM 853 CD2 LEU A 56 -12.857 1.138 -3.705 1.00 0.00 C ATOM 0 H LEU A 56 -16.561 0.047 -2.488 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.057 -1.154 -3.278 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.904 0.654 -0.981 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.259 0.085 -1.186 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.801 1.811 -3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.171 3.547 -2.504 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.138 3.005 -1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.464 2.435 -1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.660 1.994 -4.350 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.930 0.826 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.249 0.316 -4.303 1.00 0.00 H new ATOM 865 N GLU A 57 -15.681 -2.272 -0.648 1.00 0.00 N ATOM 866 CA GLU A 57 -15.691 -3.334 0.361 1.00 0.00 C ATOM 867 C GLU A 57 -15.366 -4.704 -0.251 1.00 0.00 C ATOM 868 O GLU A 57 -14.457 -5.380 0.222 1.00 0.00 O ATOM 869 CB GLU A 57 -17.021 -3.395 1.122 1.00 0.00 C ATOM 870 CG GLU A 57 -17.228 -2.230 2.069 1.00 0.00 C ATOM 871 CD GLU A 57 -18.201 -2.553 3.185 1.00 0.00 C ATOM 872 OE1 GLU A 57 -17.798 -3.239 4.149 1.00 0.00 O ATOM 873 OE2 GLU A 57 -19.373 -2.124 3.109 1.00 0.00 O ATOM 0 H GLU A 57 -16.525 -1.699 -0.668 1.00 0.00 H new ATOM 0 HA GLU A 57 -14.907 -3.084 1.076 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -17.841 -3.420 0.404 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.065 -4.326 1.688 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.269 -1.942 2.500 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -17.596 -1.371 1.508 1.00 0.00 H new ATOM 880 N PRO A 58 -16.098 -5.135 -1.309 1.00 0.00 N ATOM 881 CA PRO A 58 -15.814 -6.389 -2.027 1.00 0.00 C ATOM 882 C PRO A 58 -14.327 -6.601 -2.331 1.00 0.00 C ATOM 883 O PRO A 58 -13.848 -7.738 -2.373 1.00 0.00 O ATOM 884 CB PRO A 58 -16.588 -6.224 -3.333 1.00 0.00 C ATOM 885 CG PRO A 58 -17.739 -5.344 -2.995 1.00 0.00 C ATOM 886 CD PRO A 58 -17.294 -4.459 -1.858 1.00 0.00 C ATOM 0 HA PRO A 58 -16.099 -7.255 -1.430 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -15.964 -5.777 -4.107 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -16.927 -7.187 -3.714 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -18.034 -4.746 -3.857 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.607 -5.937 -2.706 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.057 -3.454 -2.207 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.075 -4.359 -1.104 1.00 0.00 H new ATOM 894 N LEU A 59 -13.601 -5.512 -2.547 1.00 0.00 N ATOM 895 CA LEU A 59 -12.183 -5.587 -2.870 1.00 0.00 C ATOM 896 C LEU A 59 -11.342 -5.719 -1.605 1.00 0.00 C ATOM 897 O LEU A 59 -10.635 -6.710 -1.421 1.00 0.00 O ATOM 898 CB LEU A 59 -11.736 -4.353 -3.668 1.00 0.00 C ATOM 899 CG LEU A 59 -12.086 -4.353 -5.164 1.00 0.00 C ATOM 900 CD1 LEU A 59 -13.591 -4.343 -5.380 1.00 0.00 C ATOM 901 CD2 LEU A 59 -11.445 -3.159 -5.855 1.00 0.00 C ATOM 0 H LEU A 59 -13.973 -4.563 -2.504 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.031 -6.474 -3.484 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.181 -3.469 -3.211 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -10.655 -4.253 -3.568 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.691 -5.270 -5.601 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -13.805 -4.343 -6.449 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -14.030 -5.229 -4.922 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -14.018 -3.449 -4.925 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -11.701 -3.171 -6.914 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.812 -2.237 -5.404 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.362 -3.212 -5.743 1.00 0.00 H new ATOM 913 N SER A 60 -11.445 -4.732 -0.727 1.00 0.00 N ATOM 914 CA SER A 60 -10.618 -4.672 0.471 1.00 0.00 C ATOM 915 C SER A 60 -10.930 -5.819 1.442 1.00 0.00 C ATOM 916 O SER A 60 -10.062 -6.258 2.199 1.00 0.00 O ATOM 917 CB SER A 60 -10.827 -3.324 1.158 1.00 0.00 C ATOM 918 OG SER A 60 -10.820 -2.270 0.207 1.00 0.00 O ATOM 0 H SER A 60 -12.099 -3.955 -0.823 1.00 0.00 H new ATOM 0 HA SER A 60 -9.575 -4.780 0.172 1.00 0.00 H new ATOM 0 HB2 SER A 60 -11.774 -3.328 1.697 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.041 -3.160 1.896 1.00 0.00 H new ATOM 0 HG SER A 60 -9.913 -2.154 -0.147 1.00 0.00 H new ATOM 924 N ALA A 61 -12.163 -6.321 1.402 1.00 0.00 N ATOM 925 CA ALA A 61 -12.589 -7.383 2.312 1.00 0.00 C ATOM 926 C ALA A 61 -11.955 -8.726 1.958 1.00 0.00 C ATOM 927 O ALA A 61 -12.148 -9.714 2.663 1.00 0.00 O ATOM 928 CB ALA A 61 -14.106 -7.507 2.321 1.00 0.00 C ATOM 0 H ALA A 61 -12.884 -6.010 0.750 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.248 -7.107 3.310 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.402 -8.303 3.004 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.546 -6.565 2.648 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.458 -7.742 1.316 1.00 0.00 H new ATOM 934 N LYS A 62 -11.194 -8.766 0.872 1.00 0.00 N ATOM 935 CA LYS A 62 -10.491 -9.983 0.489 1.00 0.00 C ATOM 936 C LYS A 62 -9.278 -10.206 1.389 1.00 0.00 C ATOM 937 O LYS A 62 -8.711 -11.296 1.431 1.00 0.00 O ATOM 938 CB LYS A 62 -10.050 -9.922 -0.976 1.00 0.00 C ATOM 939 CG LYS A 62 -11.197 -9.956 -1.973 1.00 0.00 C ATOM 940 CD LYS A 62 -10.681 -10.034 -3.402 1.00 0.00 C ATOM 941 CE LYS A 62 -11.816 -10.173 -4.405 1.00 0.00 C ATOM 942 NZ LYS A 62 -12.626 -8.933 -4.511 1.00 0.00 N ATOM 0 H LYS A 62 -11.048 -7.975 0.244 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.179 -10.820 0.609 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.474 -9.010 -1.133 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.382 -10.760 -1.178 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.836 -10.815 -1.767 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.813 -9.064 -1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.103 -9.138 -3.629 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.005 -10.883 -3.498 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.405 -10.421 -5.384 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.460 -11.001 -4.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.398 -9.080 -5.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.026 -8.699 -3.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.022 -8.150 -4.834 1.00 0.00 H new ATOM 956 N TYR A 63 -8.896 -9.166 2.118 1.00 0.00 N ATOM 957 CA TYR A 63 -7.722 -9.227 2.977 1.00 0.00 C ATOM 958 C TYR A 63 -8.030 -9.833 4.337 1.00 0.00 C ATOM 959 O TYR A 63 -7.173 -10.476 4.932 1.00 0.00 O ATOM 960 CB TYR A 63 -7.125 -7.832 3.167 1.00 0.00 C ATOM 961 CG TYR A 63 -6.219 -7.419 2.038 1.00 0.00 C ATOM 962 CD1 TYR A 63 -4.963 -7.987 1.911 1.00 0.00 C ATOM 963 CD2 TYR A 63 -6.617 -6.479 1.095 1.00 0.00 C ATOM 964 CE1 TYR A 63 -4.122 -7.636 0.883 1.00 0.00 C ATOM 965 CE2 TYR A 63 -5.780 -6.123 0.054 1.00 0.00 C ATOM 966 CZ TYR A 63 -4.532 -6.703 -0.046 1.00 0.00 C ATOM 967 OH TYR A 63 -3.700 -6.366 -1.090 1.00 0.00 O ATOM 0 H TYR A 63 -9.383 -8.270 2.131 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.001 -9.874 2.477 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.933 -7.107 3.260 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.565 -7.807 4.102 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -4.638 -8.720 2.634 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -7.592 -6.021 1.176 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -3.145 -8.088 0.803 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.101 -5.395 -0.677 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.821 -7.004 -1.824 1.00 0.00 H new ATOM 977 N LYS A 64 -9.258 -9.673 4.805 1.00 0.00 N ATOM 978 CA LYS A 64 -9.593 -9.972 6.201 1.00 0.00 C ATOM 979 C LYS A 64 -9.707 -11.476 6.484 1.00 0.00 C ATOM 980 O LYS A 64 -10.504 -11.908 7.320 1.00 0.00 O ATOM 981 CB LYS A 64 -10.874 -9.234 6.601 1.00 0.00 C ATOM 982 CG LYS A 64 -12.097 -9.582 5.771 1.00 0.00 C ATOM 983 CD LYS A 64 -13.182 -8.510 5.870 1.00 0.00 C ATOM 984 CE LYS A 64 -13.791 -8.389 7.267 1.00 0.00 C ATOM 985 NZ LYS A 64 -12.859 -7.783 8.259 1.00 0.00 N ATOM 0 H LYS A 64 -10.042 -9.339 4.245 1.00 0.00 H new ATOM 0 HA LYS A 64 -8.766 -9.615 6.815 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.089 -9.451 7.647 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.696 -8.161 6.528 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.804 -9.706 4.728 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -12.501 -10.538 6.104 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -12.759 -7.548 5.582 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.973 -8.737 5.155 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.696 -7.785 7.211 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -14.089 -9.378 7.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -13.378 -7.109 8.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.452 -8.532 8.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -12.095 -7.285 7.759 1.00 0.00 H new ATOM 999 N ASN A 65 -8.884 -12.262 5.802 1.00 0.00 N ATOM 1000 CA ASN A 65 -8.742 -13.683 6.096 1.00 0.00 C ATOM 1001 C ASN A 65 -7.260 -14.042 6.274 1.00 0.00 C ATOM 1002 O ASN A 65 -6.926 -15.113 6.783 1.00 0.00 O ATOM 1003 CB ASN A 65 -9.363 -14.532 4.975 1.00 0.00 C ATOM 1004 CG ASN A 65 -9.356 -16.022 5.289 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -8.407 -16.740 4.959 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -10.416 -16.500 5.925 1.00 0.00 N ATOM 0 H ASN A 65 -8.299 -11.935 5.033 1.00 0.00 H new ATOM 0 HA ASN A 65 -9.271 -13.898 7.025 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.389 -14.206 4.805 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.816 -14.358 4.048 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.467 -17.492 6.158 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.181 -15.876 6.182 1.00 0.00 H new ATOM 1013 N ILE A 66 -6.372 -13.123 5.890 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.934 -13.393 5.891 1.00 0.00 C ATOM 1015 C ILE A 66 -4.318 -13.023 7.250 1.00 0.00 C ATOM 1016 O ILE A 66 -5.044 -12.774 8.212 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.219 -12.611 4.758 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.145 -12.443 3.553 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -2.950 -13.336 4.324 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -4.593 -11.515 2.495 1.00 0.00 C ATOM 0 H ILE A 66 -6.624 -12.186 5.575 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.795 -14.460 5.715 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.954 -11.627 5.145 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.330 -13.420 3.107 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.107 -12.061 3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.463 -12.772 3.529 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.273 -13.424 5.174 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.206 -14.331 3.959 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.301 -11.442 1.670 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.434 -10.526 2.925 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.645 -11.907 2.126 1.00 0.00 H new ATOM 1032 N ALA A 67 -2.990 -12.980 7.327 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.296 -12.741 8.591 1.00 0.00 C ATOM 1034 C ALA A 67 -1.873 -11.286 8.754 1.00 0.00 C ATOM 1035 O ALA A 67 -1.253 -10.708 7.860 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.071 -13.629 8.693 1.00 0.00 C ATOM 0 H ALA A 67 -2.371 -13.108 6.527 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.001 -12.978 9.388 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.563 -13.441 9.639 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.375 -14.675 8.646 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.393 -13.410 7.868 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.215 -10.711 9.905 1.00 0.00 N ATOM 1043 CA GLY A 68 -1.754 -9.377 10.258 1.00 0.00 C ATOM 1044 C GLY A 68 -2.218 -8.307 9.295 1.00 0.00 C ATOM 1045 O GLY A 68 -1.580 -7.264 9.159 1.00 0.00 O ATOM 0 H GLY A 68 -2.810 -11.151 10.607 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.107 -9.132 11.260 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.665 -9.375 10.295 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.325 -8.562 8.624 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.860 -7.613 7.672 1.00 0.00 C ATOM 1051 C VAL A 69 -5.085 -6.909 8.237 1.00 0.00 C ATOM 1052 O VAL A 69 -5.944 -7.532 8.866 1.00 0.00 O ATOM 1053 CB VAL A 69 -4.194 -8.279 6.322 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.921 -8.563 5.539 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.966 -9.562 6.533 1.00 0.00 C ATOM 0 H VAL A 69 -3.870 -9.419 8.722 1.00 0.00 H new ATOM 0 HA VAL A 69 -3.085 -6.869 7.489 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.815 -7.589 5.750 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.175 -9.033 4.589 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.393 -7.628 5.351 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -2.281 -9.232 6.115 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.191 -10.014 5.567 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.368 -10.253 7.127 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.897 -9.345 7.057 1.00 0.00 H new ATOM 1065 N GLU A 70 -5.140 -5.603 8.031 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.204 -4.771 8.575 1.00 0.00 C ATOM 1067 C GLU A 70 -6.730 -3.823 7.508 1.00 0.00 C ATOM 1068 O GLU A 70 -6.078 -2.835 7.176 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.688 -3.960 9.767 1.00 0.00 C ATOM 1070 CG GLU A 70 -5.125 -4.814 10.889 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.539 -3.996 12.018 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -5.192 -3.026 12.461 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -3.428 -4.331 12.478 1.00 0.00 O ATOM 0 H GLU A 70 -4.450 -5.089 7.483 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.012 -5.422 8.907 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.914 -3.274 9.421 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.502 -3.350 10.160 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.915 -5.453 11.283 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.354 -5.471 10.486 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.887 -4.134 6.955 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.489 -3.290 5.939 1.00 0.00 C ATOM 1082 C GLU A 71 -9.306 -2.164 6.582 1.00 0.00 C ATOM 1083 O GLU A 71 -10.443 -2.356 7.022 1.00 0.00 O ATOM 1084 CB GLU A 71 -9.328 -4.129 4.946 1.00 0.00 C ATOM 1085 CG GLU A 71 -10.589 -4.790 5.512 1.00 0.00 C ATOM 1086 CD GLU A 71 -10.334 -5.745 6.664 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -9.267 -6.390 6.696 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -11.204 -5.846 7.553 1.00 0.00 O ATOM 0 H GLU A 71 -8.429 -4.965 7.192 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.692 -2.821 5.363 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.622 -3.485 4.117 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.689 -4.909 4.532 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.274 -4.011 5.847 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.091 -5.332 4.711 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.697 -0.990 6.670 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.351 0.168 7.254 1.00 0.00 C ATOM 1097 C LYS A 72 -9.883 1.078 6.155 1.00 0.00 C ATOM 1098 O LYS A 72 -9.129 1.810 5.512 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.377 0.931 8.158 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.999 2.124 8.867 1.00 0.00 C ATOM 1101 CD LYS A 72 -7.981 2.862 9.723 1.00 0.00 C ATOM 1102 CE LYS A 72 -7.449 1.990 10.854 1.00 0.00 C ATOM 1103 NZ LYS A 72 -8.531 1.542 11.770 1.00 0.00 N ATOM 0 H LYS A 72 -7.747 -0.816 6.342 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.190 -0.172 7.862 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.977 0.245 8.905 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.535 1.276 7.558 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.418 2.808 8.129 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -9.824 1.786 9.493 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.151 3.191 9.097 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.440 3.758 10.141 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.946 1.119 10.434 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.702 2.547 11.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -8.111 1.144 12.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.133 2.353 12.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -9.106 0.815 11.298 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.183 1.004 5.929 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.824 1.794 4.893 1.00 0.00 C ATOM 1119 C LEU A 73 -12.397 3.082 5.470 1.00 0.00 C ATOM 1120 O LEU A 73 -13.417 3.073 6.157 1.00 0.00 O ATOM 1121 CB LEU A 73 -12.921 0.977 4.209 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.421 -0.187 3.352 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.589 -1.031 2.866 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.618 0.336 2.172 1.00 0.00 C ATOM 0 H LEU A 73 -11.818 0.401 6.452 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.073 2.062 4.150 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.591 0.584 4.974 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.511 1.644 3.581 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.774 -0.815 3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.215 -1.854 2.258 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.131 -1.430 3.723 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.260 -0.414 2.268 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.268 -0.502 1.570 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.248 0.983 1.561 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.762 0.903 2.537 1.00 0.00 H new ATOM 1136 N THR A 74 -11.722 4.183 5.190 1.00 0.00 N ATOM 1137 CA THR A 74 -12.140 5.487 5.677 1.00 0.00 C ATOM 1138 C THR A 74 -12.840 6.286 4.581 1.00 0.00 C ATOM 1139 O THR A 74 -12.211 6.728 3.624 1.00 0.00 O ATOM 1140 CB THR A 74 -10.934 6.281 6.210 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.724 5.821 5.592 1.00 0.00 O ATOM 1142 CG2 THR A 74 -10.818 6.136 7.713 1.00 0.00 C ATOM 0 H THR A 74 -10.874 4.200 4.623 1.00 0.00 H new ATOM 0 HA THR A 74 -12.846 5.323 6.491 1.00 0.00 H new ATOM 0 HB THR A 74 -11.088 7.332 5.967 1.00 0.00 H new ATOM 0 HG1 THR A 74 -8.969 6.356 5.914 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.959 6.705 8.068 1.00 0.00 H new ATOM 0 HG22 THR A 74 -11.724 6.514 8.186 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.687 5.084 7.968 1.00 0.00 H new ATOM 1150 N TYR A 75 -14.143 6.462 4.726 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.934 7.143 3.710 1.00 0.00 C ATOM 1152 C TYR A 75 -15.285 8.562 4.133 1.00 0.00 C ATOM 1153 O TYR A 75 -15.611 8.814 5.295 1.00 0.00 O ATOM 1154 CB TYR A 75 -16.225 6.369 3.427 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.000 4.990 2.855 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.852 4.803 1.489 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -15.941 3.876 3.682 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.651 3.545 0.960 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -15.742 2.614 3.159 1.00 0.00 C ATOM 1160 CZ TYR A 75 -15.597 2.455 1.800 1.00 0.00 C ATOM 1161 OH TYR A 75 -15.401 1.199 1.278 1.00 0.00 O ATOM 0 H TYR A 75 -14.676 6.144 5.535 1.00 0.00 H new ATOM 0 HA TYR A 75 -14.327 7.189 2.806 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.793 6.279 4.353 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.837 6.944 2.732 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -15.895 5.656 0.828 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.052 3.999 4.749 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.537 3.416 -0.106 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -15.700 1.756 3.813 1.00 0.00 H new ATOM 0 HH TYR A 75 -15.979 0.558 1.743 1.00 0.00 H new ATOM 1171 N THR A 76 -15.196 9.482 3.185 1.00 0.00 N ATOM 1172 CA THR A 76 -15.695 10.832 3.380 1.00 0.00 C ATOM 1173 C THR A 76 -16.786 11.103 2.349 1.00 0.00 C ATOM 1174 O THR A 76 -17.363 10.166 1.799 1.00 0.00 O ATOM 1175 CB THR A 76 -14.574 11.890 3.250 1.00 0.00 C ATOM 1176 OG1 THR A 76 -13.957 11.804 1.959 1.00 0.00 O ATOM 1177 CG2 THR A 76 -13.520 11.705 4.334 1.00 0.00 C ATOM 0 H THR A 76 -14.780 9.316 2.269 1.00 0.00 H new ATOM 0 HA THR A 76 -16.094 10.909 4.391 1.00 0.00 H new ATOM 0 HB THR A 76 -15.026 12.874 3.369 1.00 0.00 H new ATOM 0 HG1 THR A 76 -13.579 10.908 1.836 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.744 12.462 4.220 1.00 0.00 H new ATOM 0 HG22 THR A 76 -13.985 11.807 5.315 1.00 0.00 H new ATOM 0 HG23 THR A 76 -13.076 10.713 4.245 1.00 0.00 H new ATOM 1185 N ASP A 77 -17.069 12.367 2.087 1.00 0.00 N ATOM 1186 CA ASP A 77 -18.056 12.723 1.077 1.00 0.00 C ATOM 1187 C ASP A 77 -17.347 13.126 -0.209 1.00 0.00 C ATOM 1188 O ASP A 77 -17.969 13.335 -1.249 1.00 0.00 O ATOM 1189 CB ASP A 77 -18.939 13.868 1.583 1.00 0.00 C ATOM 1190 CG ASP A 77 -20.112 14.155 0.667 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -21.090 13.377 0.691 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -20.072 15.165 -0.065 1.00 0.00 O ATOM 0 H ASP A 77 -16.633 13.162 2.555 1.00 0.00 H new ATOM 0 HA ASP A 77 -18.692 11.861 0.876 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -19.312 13.621 2.577 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -18.334 14.769 1.685 1.00 0.00 H new ATOM 1197 N THR A 78 -16.027 13.218 -0.129 1.00 0.00 N ATOM 1198 CA THR A 78 -15.223 13.664 -1.253 1.00 0.00 C ATOM 1199 C THR A 78 -14.343 12.538 -1.800 1.00 0.00 C ATOM 1200 O THR A 78 -14.183 12.393 -3.015 1.00 0.00 O ATOM 1201 CB THR A 78 -14.341 14.858 -0.835 1.00 0.00 C ATOM 1202 OG1 THR A 78 -15.150 15.839 -0.171 1.00 0.00 O ATOM 1203 CG2 THR A 78 -13.661 15.491 -2.042 1.00 0.00 C ATOM 0 H THR A 78 -15.490 12.988 0.707 1.00 0.00 H new ATOM 0 HA THR A 78 -15.906 13.973 -2.044 1.00 0.00 H new ATOM 0 HB THR A 78 -13.567 14.493 -0.160 1.00 0.00 H new ATOM 0 HG1 THR A 78 -14.590 16.598 0.097 1.00 0.00 H new ATOM 0 HG21 THR A 78 -13.046 16.330 -1.715 1.00 0.00 H new ATOM 0 HG22 THR A 78 -13.031 14.750 -2.535 1.00 0.00 H new ATOM 0 HG23 THR A 78 -14.418 15.847 -2.741 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.781 11.731 -0.907 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.880 10.664 -1.320 1.00 0.00 C ATOM 1213 C TYR A 79 -12.945 9.484 -0.357 1.00 0.00 C ATOM 1214 O TYR A 79 -13.529 9.576 0.726 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.438 11.185 -1.416 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.824 11.574 -0.087 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -11.132 12.785 0.519 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -9.928 10.729 0.558 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -10.569 13.142 1.729 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -9.362 11.077 1.767 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.685 12.283 2.350 1.00 0.00 C ATOM 1222 OH TYR A 79 -9.118 12.633 3.554 1.00 0.00 O ATOM 0 H TYR A 79 -13.932 11.795 0.100 1.00 0.00 H new ATOM 0 HA TYR A 79 -13.200 10.321 -2.304 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.817 10.418 -1.879 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.421 12.051 -2.078 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -11.824 13.459 0.036 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -9.670 9.783 0.104 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -10.819 14.088 2.186 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -8.669 10.407 2.254 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.521 11.917 3.855 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.347 8.379 -0.761 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.274 7.197 0.076 1.00 0.00 C ATOM 1234 C ALA A 80 -10.822 6.793 0.282 1.00 0.00 C ATOM 1235 O ALA A 80 -10.074 6.617 -0.678 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.064 6.057 -0.547 1.00 0.00 C ATOM 0 H ALA A 80 -11.901 8.276 -1.672 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.713 7.425 1.047 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.999 5.177 0.093 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.108 6.353 -0.653 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.652 5.823 -1.529 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.421 6.678 1.535 1.00 0.00 N ATOM 1243 CA GLN A 81 -9.065 6.280 1.864 1.00 0.00 C ATOM 1244 C GLN A 81 -9.032 4.809 2.245 1.00 0.00 C ATOM 1245 O GLN A 81 -9.631 4.403 3.245 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.515 7.123 3.017 1.00 0.00 C ATOM 1247 CG GLN A 81 -7.023 6.927 3.248 1.00 0.00 C ATOM 1248 CD GLN A 81 -6.486 7.764 4.391 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -7.199 8.072 5.344 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -5.215 8.125 4.312 1.00 0.00 N ATOM 0 H GLN A 81 -11.017 6.855 2.343 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.440 6.441 0.986 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.709 8.176 2.813 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -9.053 6.871 3.931 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.828 5.874 3.453 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -6.483 7.179 2.335 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -4.656 7.850 3.505 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.795 8.678 5.059 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.353 4.018 1.439 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.152 2.613 1.732 1.00 0.00 C ATOM 1261 C GLU A 82 -6.817 2.443 2.442 1.00 0.00 C ATOM 1262 O GLU A 82 -5.763 2.428 1.812 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.184 1.791 0.441 1.00 0.00 C ATOM 1264 CG GLU A 82 -7.891 0.311 0.636 1.00 0.00 C ATOM 1265 CD GLU A 82 -7.785 -0.438 -0.677 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -6.939 -0.059 -1.520 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -8.556 -1.403 -0.875 1.00 0.00 O ATOM 0 H GLU A 82 -7.927 4.329 0.566 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.953 2.255 2.378 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.166 1.898 -0.020 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.457 2.205 -0.258 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.960 0.198 1.191 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.679 -0.135 1.242 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.861 2.365 3.758 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.650 2.216 4.546 1.00 0.00 C ATOM 1276 C ASN A 83 -5.559 0.790 5.061 1.00 0.00 C ATOM 1277 O ASN A 83 -6.195 0.433 6.051 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.640 3.218 5.706 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.321 3.249 6.455 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -3.446 4.167 6.076 1.00 0.00 O flip ATOM 1281 ND2 ASN A 83 -4.099 2.477 7.388 1.00 0.00 N flip ATOM 0 H ASN A 83 -7.721 2.402 4.305 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.782 2.423 3.920 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.855 4.214 5.319 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.440 2.967 6.402 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.797 1.782 7.652 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.217 2.532 7.897 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.796 -0.034 4.370 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.740 -1.454 4.691 1.00 0.00 C ATOM 1290 C VAL A 84 -3.409 -1.809 5.331 1.00 0.00 C ATOM 1291 O VAL A 84 -2.361 -1.393 4.864 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.957 -2.331 3.435 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.909 -3.812 3.787 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -6.280 -1.990 2.770 1.00 0.00 C ATOM 0 H VAL A 84 -4.208 0.249 3.586 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.546 -1.655 5.397 1.00 0.00 H new ATOM 0 HB VAL A 84 -4.148 -2.121 2.735 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -5.064 -4.405 2.886 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.937 -4.053 4.217 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.692 -4.040 4.511 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -6.416 -2.616 1.888 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -7.096 -2.167 3.471 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -6.278 -0.941 2.473 1.00 0.00 H new ATOM 1304 N THR A 85 -3.451 -2.560 6.410 1.00 0.00 N ATOM 1305 CA THR A 85 -2.234 -3.013 7.048 1.00 0.00 C ATOM 1306 C THR A 85 -1.953 -4.451 6.636 1.00 0.00 C ATOM 1307 O THR A 85 -2.880 -5.238 6.469 1.00 0.00 O ATOM 1308 CB THR A 85 -2.336 -2.909 8.579 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.935 -1.655 8.934 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.959 -3.012 9.215 1.00 0.00 C ATOM 0 H THR A 85 -4.311 -2.869 6.863 1.00 0.00 H new ATOM 0 HA THR A 85 -1.413 -2.372 6.726 1.00 0.00 H new ATOM 0 HB THR A 85 -2.952 -3.730 8.945 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.002 -1.589 9.909 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.052 -2.936 10.298 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.509 -3.970 8.956 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.327 -2.203 8.848 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.687 -4.772 6.435 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.278 -6.104 6.023 1.00 0.00 C ATOM 1320 C ILE A 86 0.967 -6.524 6.796 1.00 0.00 C ATOM 1321 O ILE A 86 1.962 -5.797 6.830 1.00 0.00 O ATOM 1322 CB ILE A 86 0.012 -6.166 4.501 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -1.238 -5.782 3.700 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.495 -7.555 4.101 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -1.030 -5.770 2.202 1.00 0.00 C ATOM 0 H ILE A 86 0.086 -4.117 6.553 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.099 -6.787 6.240 1.00 0.00 H new ATOM 0 HB ILE A 86 0.802 -5.450 4.274 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.039 -6.481 3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.571 -4.794 4.018 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.693 -7.577 3.029 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.410 -7.792 4.644 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.272 -8.291 4.344 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.960 -5.489 1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.252 -5.050 1.948 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.728 -6.763 1.869 1.00 0.00 H new ATOM 1337 N ASP A 87 0.901 -7.677 7.437 1.00 0.00 N ATOM 1338 CA ASP A 87 2.035 -8.200 8.182 1.00 0.00 C ATOM 1339 C ASP A 87 2.841 -9.158 7.317 1.00 0.00 C ATOM 1340 O ASP A 87 2.421 -10.286 7.069 1.00 0.00 O ATOM 1341 CB ASP A 87 1.556 -8.910 9.450 1.00 0.00 C ATOM 1342 CG ASP A 87 2.678 -9.606 10.191 1.00 0.00 C ATOM 1343 OD1 ASP A 87 3.446 -8.921 10.893 1.00 0.00 O ATOM 1344 OD2 ASP A 87 2.790 -10.846 10.080 1.00 0.00 O ATOM 0 H ASP A 87 0.072 -8.271 7.457 1.00 0.00 H new ATOM 0 HA ASP A 87 2.675 -7.366 8.469 1.00 0.00 H new ATOM 0 HB2 ASP A 87 1.085 -8.183 10.112 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.793 -9.642 9.185 1.00 0.00 H new ATOM 1349 N MET A 88 4.011 -8.714 6.874 1.00 0.00 N ATOM 1350 CA MET A 88 4.842 -9.511 5.974 1.00 0.00 C ATOM 1351 C MET A 88 5.620 -10.573 6.733 1.00 0.00 C ATOM 1352 O MET A 88 6.584 -11.133 6.211 1.00 0.00 O ATOM 1353 CB MET A 88 5.834 -8.639 5.209 1.00 0.00 C ATOM 1354 CG MET A 88 5.206 -7.687 4.210 1.00 0.00 C ATOM 1355 SD MET A 88 6.366 -7.239 2.905 1.00 0.00 S ATOM 1356 CE MET A 88 5.412 -6.034 1.995 1.00 0.00 C ATOM 0 H MET A 88 4.407 -7.807 7.122 1.00 0.00 H new ATOM 0 HA MET A 88 4.162 -9.990 5.270 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.415 -8.059 5.926 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.534 -9.287 4.681 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.323 -8.150 3.770 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.871 -6.787 4.725 1.00 0.00 H new ATOM 0 HE1 MET A 88 5.430 -6.282 0.934 1.00 0.00 H new ATOM 0 HE2 MET A 88 4.382 -6.041 2.352 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.841 -5.043 2.143 1.00 0.00 H new ATOM 1366 N GLU A 89 5.205 -10.863 7.952 1.00 0.00 N ATOM 1367 CA GLU A 89 5.914 -11.827 8.767 1.00 0.00 C ATOM 1368 C GLU A 89 5.140 -13.129 8.805 1.00 0.00 C ATOM 1369 O GLU A 89 5.691 -14.187 9.113 1.00 0.00 O ATOM 1370 CB GLU A 89 6.132 -11.285 10.181 1.00 0.00 C ATOM 1371 CG GLU A 89 6.952 -10.004 10.217 1.00 0.00 C ATOM 1372 CD GLU A 89 7.285 -9.565 11.626 1.00 0.00 C ATOM 1373 OE1 GLU A 89 8.213 -10.142 12.223 1.00 0.00 O ATOM 1374 OE2 GLU A 89 6.621 -8.644 12.144 1.00 0.00 O ATOM 0 H GLU A 89 4.386 -10.447 8.396 1.00 0.00 H new ATOM 0 HA GLU A 89 6.894 -12.011 8.326 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.163 -11.101 10.645 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.633 -12.045 10.780 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.876 -10.153 9.659 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.400 -9.210 9.714 1.00 0.00 H new ATOM 1381 N LYS A 90 3.856 -13.044 8.486 1.00 0.00 N ATOM 1382 CA LYS A 90 3.007 -14.220 8.452 1.00 0.00 C ATOM 1383 C LYS A 90 2.033 -14.180 7.266 1.00 0.00 C ATOM 1384 O LYS A 90 1.314 -15.152 7.024 1.00 0.00 O ATOM 1385 CB LYS A 90 2.233 -14.325 9.768 1.00 0.00 C ATOM 1386 CG LYS A 90 1.590 -15.681 10.008 1.00 0.00 C ATOM 1387 CD LYS A 90 0.742 -15.666 11.265 1.00 0.00 C ATOM 1388 CE LYS A 90 0.168 -17.036 11.572 1.00 0.00 C ATOM 1389 NZ LYS A 90 -0.726 -16.995 12.755 1.00 0.00 N ATOM 0 H LYS A 90 3.383 -12.173 8.248 1.00 0.00 H new ATOM 0 HA LYS A 90 3.641 -15.097 8.325 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.911 -14.106 10.593 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.457 -13.560 9.782 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.972 -15.951 9.152 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.364 -16.444 10.096 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.346 -15.328 12.107 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.071 -14.949 11.147 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.386 -17.402 10.708 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.980 -17.741 11.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.102 -17.947 12.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.190 -16.669 13.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.514 -16.341 12.572 1.00 0.00 H new ATOM 1403 N VAL A 91 1.998 -13.065 6.526 1.00 0.00 N ATOM 1404 CA VAL A 91 1.085 -12.944 5.391 1.00 0.00 C ATOM 1405 C VAL A 91 1.355 -14.044 4.377 1.00 0.00 C ATOM 1406 O VAL A 91 2.506 -14.399 4.113 1.00 0.00 O ATOM 1407 CB VAL A 91 1.167 -11.565 4.681 1.00 0.00 C ATOM 1408 CG1 VAL A 91 2.502 -11.375 3.981 1.00 0.00 C ATOM 1409 CG2 VAL A 91 0.034 -11.408 3.677 1.00 0.00 C ATOM 0 H VAL A 91 2.584 -12.246 6.692 1.00 0.00 H new ATOM 0 HA VAL A 91 0.079 -13.040 5.800 1.00 0.00 H new ATOM 0 HB VAL A 91 1.072 -10.799 5.451 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.523 -10.399 3.496 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.308 -11.434 4.712 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.634 -12.156 3.232 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.110 -10.435 3.191 1.00 0.00 H new ATOM 0 HG22 VAL A 91 0.102 -12.195 2.926 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.923 -11.481 4.194 1.00 0.00 H new ATOM 1419 N ASP A 92 0.294 -14.592 3.829 1.00 0.00 N ATOM 1420 CA ASP A 92 0.420 -15.664 2.867 1.00 0.00 C ATOM 1421 C ASP A 92 0.238 -15.130 1.460 1.00 0.00 C ATOM 1422 O ASP A 92 -0.839 -14.657 1.097 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.594 -16.765 3.161 1.00 0.00 C ATOM 1424 CG ASP A 92 -0.502 -17.906 2.172 1.00 0.00 C ATOM 1425 OD1 ASP A 92 0.628 -18.274 1.783 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -1.555 -18.442 1.788 1.00 0.00 O ATOM 0 H ASP A 92 -0.666 -14.313 4.033 1.00 0.00 H new ATOM 0 HA ASP A 92 1.420 -16.090 2.947 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.432 -17.146 4.169 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.600 -16.346 3.137 1.00 0.00 H new ATOM 1431 N PHE A 93 1.300 -15.204 0.672 1.00 0.00 N ATOM 1432 CA PHE A 93 1.277 -14.700 -0.690 1.00 0.00 C ATOM 1433 C PHE A 93 0.501 -15.649 -1.597 1.00 0.00 C ATOM 1434 O PHE A 93 0.112 -15.290 -2.705 1.00 0.00 O ATOM 1435 CB PHE A 93 2.698 -14.502 -1.213 1.00 0.00 C ATOM 1436 CG PHE A 93 3.474 -13.443 -0.478 1.00 0.00 C ATOM 1437 CD1 PHE A 93 3.374 -12.112 -0.850 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.306 -13.778 0.578 1.00 0.00 C ATOM 1439 CE1 PHE A 93 4.085 -11.135 -0.180 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.020 -12.805 1.252 1.00 0.00 C ATOM 1441 CZ PHE A 93 4.910 -11.482 0.871 1.00 0.00 C ATOM 0 H PHE A 93 2.192 -15.610 0.955 1.00 0.00 H new ATOM 0 HA PHE A 93 0.773 -13.733 -0.691 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.236 -15.447 -1.143 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.653 -14.238 -2.270 1.00 0.00 H new ATOM 0 HD1 PHE A 93 2.733 -11.835 -1.674 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.398 -14.811 0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.995 -10.101 -0.478 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.663 -13.079 2.075 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.469 -10.720 1.394 1.00 0.00 H new ATOM 1451 N LYS A 94 0.272 -16.862 -1.107 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.566 -17.823 -1.812 1.00 0.00 C ATOM 1453 C LYS A 94 -2.032 -17.421 -1.666 1.00 0.00 C ATOM 1454 O LYS A 94 -2.860 -17.711 -2.529 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.302 -19.240 -1.276 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.224 -20.319 -1.836 1.00 0.00 C ATOM 1457 CD LYS A 94 -2.379 -20.607 -0.888 1.00 0.00 C ATOM 1458 CE LYS A 94 -1.873 -21.109 0.455 1.00 0.00 C ATOM 1459 NZ LYS A 94 -2.967 -21.250 1.450 1.00 0.00 N ATOM 0 H LYS A 94 0.655 -17.203 -0.225 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.322 -17.825 -2.874 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.730 -19.511 -1.500 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.399 -19.226 -0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.615 -20.000 -2.802 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.655 -21.233 -2.008 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -2.969 -19.702 -0.743 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -3.041 -21.351 -1.332 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.382 -22.072 0.319 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.122 -20.419 0.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.576 -21.595 2.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.420 -20.326 1.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.672 -21.928 1.097 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.341 -16.739 -0.570 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.658 -16.150 -0.380 1.00 0.00 C ATOM 1475 C ALA A 95 -3.746 -14.830 -1.137 1.00 0.00 C ATOM 1476 O ALA A 95 -4.816 -14.414 -1.571 1.00 0.00 O ATOM 1477 CB ALA A 95 -3.947 -15.941 1.100 1.00 0.00 C ATOM 0 H ALA A 95 -1.694 -16.581 0.202 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.409 -16.834 -0.774 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.937 -15.500 1.219 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.913 -16.900 1.616 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.198 -15.273 1.526 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.594 -14.189 -1.306 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.494 -12.971 -2.102 1.00 0.00 C ATOM 1485 C LEU A 96 -2.536 -13.294 -3.594 1.00 0.00 C ATOM 1486 O LEU A 96 -2.438 -12.397 -4.424 1.00 0.00 O ATOM 1487 CB LEU A 96 -1.214 -12.190 -1.775 1.00 0.00 C ATOM 1488 CG LEU A 96 -1.224 -11.426 -0.450 1.00 0.00 C ATOM 1489 CD1 LEU A 96 0.024 -10.559 -0.323 1.00 0.00 C ATOM 1490 CD2 LEU A 96 -2.475 -10.571 -0.336 1.00 0.00 C ATOM 0 H LEU A 96 -1.711 -14.496 -0.899 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.351 -12.347 -1.849 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.377 -12.888 -1.764 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.027 -11.480 -2.581 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.226 -12.152 0.363 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.000 -10.023 0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.911 -11.191 -0.360 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.054 -9.843 -1.144 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.464 -10.035 0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.502 -9.855 -1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.357 -11.209 -0.382 1.00 0.00 H new ATOM 1502 N GLN A 97 -2.678 -14.584 -3.911 1.00 0.00 N ATOM 1503 CA GLN A 97 -2.691 -15.088 -5.290 1.00 0.00 C ATOM 1504 C GLN A 97 -3.490 -14.182 -6.228 1.00 0.00 C ATOM 1505 O GLN A 97 -3.051 -13.878 -7.336 1.00 0.00 O ATOM 1506 CB GLN A 97 -3.288 -16.499 -5.309 1.00 0.00 C ATOM 1507 CG GLN A 97 -3.069 -17.262 -6.606 1.00 0.00 C ATOM 1508 CD GLN A 97 -1.617 -17.645 -6.831 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -0.695 -16.930 -6.433 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -1.401 -18.786 -7.460 1.00 0.00 N ATOM 0 H GLN A 97 -2.789 -15.317 -3.211 1.00 0.00 H new ATOM 0 HA GLN A 97 -1.661 -15.105 -5.647 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -2.857 -17.073 -4.488 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -4.359 -16.429 -5.121 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -3.680 -18.165 -6.598 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -3.412 -16.653 -7.442 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -2.189 -19.352 -7.775 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.446 -19.101 -7.631 1.00 0.00 H new ATOM 1519 N GLY A 98 -4.663 -13.758 -5.777 1.00 0.00 N ATOM 1520 CA GLY A 98 -5.476 -12.854 -6.567 1.00 0.00 C ATOM 1521 C GLY A 98 -5.825 -11.597 -5.799 1.00 0.00 C ATOM 1522 O GLY A 98 -6.766 -10.885 -6.147 1.00 0.00 O ATOM 0 H GLY A 98 -5.066 -14.024 -4.879 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -4.942 -12.587 -7.479 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.392 -13.360 -6.871 1.00 0.00 H new ATOM 1526 N ILE A 99 -5.057 -11.324 -4.752 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.328 -10.196 -3.866 1.00 0.00 C ATOM 1528 C ILE A 99 -4.052 -9.379 -3.661 1.00 0.00 C ATOM 1529 O ILE A 99 -3.979 -8.492 -2.807 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.865 -10.683 -2.494 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -6.905 -11.792 -2.689 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.484 -9.526 -1.718 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -7.395 -12.408 -1.395 1.00 0.00 C ATOM 0 H ILE A 99 -4.236 -11.871 -4.493 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.091 -9.571 -4.331 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.026 -11.080 -1.923 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.758 -11.385 -3.232 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -6.474 -12.575 -3.313 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.855 -9.888 -0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.730 -8.757 -1.549 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.310 -9.105 -2.291 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -8.128 -13.184 -1.616 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -6.553 -12.846 -0.859 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.857 -11.638 -0.777 1.00 0.00 H new ATOM 1545 N SER A 100 -3.043 -9.675 -4.460 1.00 0.00 N ATOM 1546 CA SER A 100 -1.769 -8.997 -4.351 1.00 0.00 C ATOM 1547 C SER A 100 -1.856 -7.585 -4.916 1.00 0.00 C ATOM 1548 O SER A 100 -1.881 -7.388 -6.133 1.00 0.00 O ATOM 1549 CB SER A 100 -0.684 -9.801 -5.071 1.00 0.00 C ATOM 1550 OG SER A 100 -1.095 -10.151 -6.381 1.00 0.00 O ATOM 0 H SER A 100 -3.084 -10.383 -5.193 1.00 0.00 H new ATOM 0 HA SER A 100 -1.506 -8.920 -3.296 1.00 0.00 H new ATOM 0 HB2 SER A 100 0.235 -9.217 -5.118 1.00 0.00 H new ATOM 0 HB3 SER A 100 -0.459 -10.704 -4.503 1.00 0.00 H new ATOM 0 HG SER A 100 -1.458 -9.360 -6.832 1.00 0.00 H new ATOM 1556 N GLY A 101 -1.943 -6.605 -4.020 1.00 0.00 N ATOM 1557 CA GLY A 101 -1.871 -5.215 -4.430 1.00 0.00 C ATOM 1558 C GLY A 101 -0.552 -4.910 -5.111 1.00 0.00 C ATOM 1559 O GLY A 101 -0.443 -3.973 -5.899 1.00 0.00 O ATOM 0 H GLY A 101 -2.062 -6.750 -3.017 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -2.694 -4.991 -5.109 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -1.991 -4.570 -3.560 1.00 0.00 H new ATOM 1563 N ILE A 102 0.454 -5.715 -4.795 1.00 0.00 N ATOM 1564 CA ILE A 102 1.743 -5.622 -5.452 1.00 0.00 C ATOM 1565 C ILE A 102 1.705 -6.441 -6.732 1.00 0.00 C ATOM 1566 O ILE A 102 1.700 -7.671 -6.690 1.00 0.00 O ATOM 1567 CB ILE A 102 2.886 -6.154 -4.560 1.00 0.00 C ATOM 1568 CG1 ILE A 102 2.688 -5.735 -3.099 1.00 0.00 C ATOM 1569 CG2 ILE A 102 4.231 -5.664 -5.077 1.00 0.00 C ATOM 1570 CD1 ILE A 102 2.626 -4.238 -2.890 1.00 0.00 C ATOM 0 H ILE A 102 0.397 -6.443 -4.083 1.00 0.00 H new ATOM 0 HA ILE A 102 1.936 -4.570 -5.662 1.00 0.00 H new ATOM 0 HB ILE A 102 2.869 -7.243 -4.602 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.767 -6.182 -2.726 1.00 0.00 H new ATOM 0 HG13 ILE A 102 3.504 -6.141 -2.502 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.027 -6.047 -4.439 1.00 0.00 H new ATOM 0 HG22 ILE A 102 4.380 -6.020 -6.096 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.250 -4.574 -5.067 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.485 -4.024 -1.831 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.557 -3.784 -3.231 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.792 -3.826 -3.458 1.00 0.00 H new ATOM 1582 N ASN A 103 1.636 -5.763 -7.860 1.00 0.00 N ATOM 1583 CA ASN A 103 1.581 -6.440 -9.145 1.00 0.00 C ATOM 1584 C ASN A 103 2.415 -5.693 -10.171 1.00 0.00 C ATOM 1585 O ASN A 103 1.984 -4.679 -10.721 1.00 0.00 O ATOM 1586 CB ASN A 103 0.128 -6.560 -9.622 1.00 0.00 C ATOM 1587 CG ASN A 103 -0.003 -7.274 -10.958 1.00 0.00 C ATOM 1588 OD1 ASN A 103 0.819 -8.120 -11.312 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -1.046 -6.946 -11.704 1.00 0.00 N ATOM 0 H ASN A 103 1.617 -4.745 -7.916 1.00 0.00 H new ATOM 0 HA ASN A 103 1.992 -7.443 -9.028 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -0.452 -7.097 -8.871 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -0.304 -5.563 -9.705 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -1.190 -7.399 -12.606 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -1.705 -6.240 -11.376 1.00 0.00 H new ATOM 1596 N VAL A 104 3.628 -6.174 -10.395 1.00 0.00 N ATOM 1597 CA VAL A 104 4.508 -5.578 -11.385 1.00 0.00 C ATOM 1598 C VAL A 104 5.333 -6.646 -12.096 1.00 0.00 C ATOM 1599 O VAL A 104 5.448 -6.643 -13.323 1.00 0.00 O ATOM 1600 CB VAL A 104 5.422 -4.489 -10.764 1.00 0.00 C ATOM 1601 CG1 VAL A 104 6.205 -5.027 -9.576 1.00 0.00 C ATOM 1602 CG2 VAL A 104 6.363 -3.907 -11.807 1.00 0.00 C ATOM 0 H VAL A 104 4.024 -6.975 -9.904 1.00 0.00 H new ATOM 0 HA VAL A 104 3.877 -5.086 -12.126 1.00 0.00 H new ATOM 0 HB VAL A 104 4.775 -3.690 -10.402 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.834 -4.237 -9.167 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.511 -5.372 -8.809 1.00 0.00 H new ATOM 0 HG13 VAL A 104 6.831 -5.858 -9.899 1.00 0.00 H new ATOM 0 HG21 VAL A 104 6.992 -3.146 -11.345 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.991 -4.700 -12.213 1.00 0.00 H new ATOM 0 HG23 VAL A 104 5.781 -3.457 -12.611 1.00 0.00 H new ATOM 1612 N SER A 105 5.885 -7.562 -11.327 1.00 0.00 N ATOM 1613 CA SER A 105 6.626 -8.684 -11.885 1.00 0.00 C ATOM 1614 C SER A 105 6.274 -9.965 -11.130 1.00 0.00 C ATOM 1615 O SER A 105 5.531 -9.933 -10.147 1.00 0.00 O ATOM 1616 CB SER A 105 8.133 -8.422 -11.804 1.00 0.00 C ATOM 1617 OG SER A 105 8.435 -7.072 -12.111 1.00 0.00 O ATOM 0 H SER A 105 5.836 -7.555 -10.308 1.00 0.00 H new ATOM 0 HA SER A 105 6.351 -8.801 -12.933 1.00 0.00 H new ATOM 0 HB2 SER A 105 8.493 -8.659 -10.803 1.00 0.00 H new ATOM 0 HB3 SER A 105 8.657 -9.081 -12.496 1.00 0.00 H new ATOM 0 HG SER A 105 9.403 -6.931 -12.050 1.00 0.00 H new ATOM 1623 N ALA A 106 6.786 -11.092 -11.601 1.00 0.00 N ATOM 1624 CA ALA A 106 6.559 -12.364 -10.929 1.00 0.00 C ATOM 1625 C ALA A 106 7.713 -12.702 -9.990 1.00 0.00 C ATOM 1626 O ALA A 106 7.748 -13.776 -9.393 1.00 0.00 O ATOM 1627 CB ALA A 106 6.364 -13.470 -11.953 1.00 0.00 C ATOM 0 H ALA A 106 7.359 -11.153 -12.442 1.00 0.00 H new ATOM 0 HA ALA A 106 5.653 -12.276 -10.329 1.00 0.00 H new ATOM 0 HB1 ALA A 106 6.195 -14.416 -11.439 1.00 0.00 H new ATOM 0 HB2 ALA A 106 5.502 -13.238 -12.579 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.255 -13.550 -12.576 1.00 0.00 H new ATOM 1633 N GLU A 107 8.649 -11.775 -9.853 1.00 0.00 N ATOM 1634 CA GLU A 107 9.834 -12.008 -9.037 1.00 0.00 C ATOM 1635 C GLU A 107 9.752 -11.256 -7.712 1.00 0.00 C ATOM 1636 O GLU A 107 10.588 -11.449 -6.825 1.00 0.00 O ATOM 1637 CB GLU A 107 11.090 -11.587 -9.802 1.00 0.00 C ATOM 1638 CG GLU A 107 11.254 -12.292 -11.139 1.00 0.00 C ATOM 1639 CD GLU A 107 11.226 -13.801 -11.012 1.00 0.00 C ATOM 1640 OE1 GLU A 107 12.099 -14.362 -10.323 1.00 0.00 O ATOM 1641 OE2 GLU A 107 10.339 -14.440 -11.616 1.00 0.00 O ATOM 0 H GLU A 107 8.613 -10.856 -10.294 1.00 0.00 H new ATOM 0 HA GLU A 107 9.887 -13.074 -8.817 1.00 0.00 H new ATOM 0 HB2 GLU A 107 11.059 -10.510 -9.970 1.00 0.00 H new ATOM 0 HB3 GLU A 107 11.966 -11.788 -9.185 1.00 0.00 H new ATOM 0 HG2 GLU A 107 10.459 -11.973 -11.813 1.00 0.00 H new ATOM 0 HG3 GLU A 107 12.197 -11.987 -11.592 1.00 0.00 H new ATOM 1648 N ASP A 108 8.751 -10.396 -7.580 1.00 0.00 N ATOM 1649 CA ASP A 108 8.577 -9.610 -6.364 1.00 0.00 C ATOM 1650 C ASP A 108 7.507 -10.212 -5.455 1.00 0.00 C ATOM 1651 O ASP A 108 7.814 -11.034 -4.595 1.00 0.00 O ATOM 1652 CB ASP A 108 8.266 -8.138 -6.689 1.00 0.00 C ATOM 1653 CG ASP A 108 7.244 -7.966 -7.797 1.00 0.00 C ATOM 1654 OD1 ASP A 108 6.032 -7.948 -7.501 1.00 0.00 O ATOM 1655 OD2 ASP A 108 7.654 -7.855 -8.965 1.00 0.00 O ATOM 0 H ASP A 108 8.048 -10.224 -8.298 1.00 0.00 H new ATOM 0 HA ASP A 108 9.522 -9.638 -5.821 1.00 0.00 H new ATOM 0 HB2 ASP A 108 7.900 -7.645 -5.788 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.189 -7.635 -6.976 1.00 0.00 H new ATOM 1660 N ALA A 109 6.254 -9.830 -5.660 1.00 0.00 N ATOM 1661 CA ALA A 109 5.161 -10.276 -4.804 1.00 0.00 C ATOM 1662 C ALA A 109 4.904 -11.766 -4.955 1.00 0.00 C ATOM 1663 O ALA A 109 4.540 -12.446 -3.997 1.00 0.00 O ATOM 1664 CB ALA A 109 3.896 -9.500 -5.128 1.00 0.00 C ATOM 0 H ALA A 109 5.967 -9.208 -6.416 1.00 0.00 H new ATOM 0 HA ALA A 109 5.451 -10.088 -3.770 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.085 -9.840 -4.484 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.069 -8.437 -4.963 1.00 0.00 H new ATOM 0 HB3 ALA A 109 3.625 -9.666 -6.171 1.00 0.00 H new ATOM 1670 N LYS A 110 5.124 -12.264 -6.161 1.00 0.00 N ATOM 1671 CA LYS A 110 4.798 -13.641 -6.499 1.00 0.00 C ATOM 1672 C LYS A 110 5.743 -14.627 -5.809 1.00 0.00 C ATOM 1673 O LYS A 110 5.442 -15.816 -5.711 1.00 0.00 O ATOM 1674 CB LYS A 110 4.867 -13.817 -8.019 1.00 0.00 C ATOM 1675 CG LYS A 110 4.251 -15.111 -8.531 1.00 0.00 C ATOM 1676 CD LYS A 110 2.750 -15.139 -8.294 1.00 0.00 C ATOM 1677 CE LYS A 110 2.105 -16.349 -8.948 1.00 0.00 C ATOM 1678 NZ LYS A 110 0.629 -16.350 -8.779 1.00 0.00 N ATOM 0 H LYS A 110 5.531 -11.730 -6.929 1.00 0.00 H new ATOM 0 HA LYS A 110 3.789 -13.854 -6.147 1.00 0.00 H new ATOM 0 HB2 LYS A 110 4.361 -12.976 -8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.911 -13.778 -8.330 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.455 -15.217 -9.596 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.716 -15.961 -8.031 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.550 -15.154 -7.223 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.301 -14.228 -8.690 1.00 0.00 H new ATOM 0 HE2 LYS A 110 2.349 -16.360 -10.010 1.00 0.00 H new ATOM 0 HE3 LYS A 110 2.520 -17.259 -8.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 0.218 -17.134 -9.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 0.395 -16.467 -7.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 0.240 -15.449 -9.122 1.00 0.00 H new ATOM 1692 N LYS A 111 6.878 -14.134 -5.325 1.00 0.00 N ATOM 1693 CA LYS A 111 7.881 -15.001 -4.716 1.00 0.00 C ATOM 1694 C LYS A 111 8.335 -14.463 -3.362 1.00 0.00 C ATOM 1695 O LYS A 111 9.382 -14.853 -2.841 1.00 0.00 O ATOM 1696 CB LYS A 111 9.073 -15.166 -5.663 1.00 0.00 C ATOM 1697 CG LYS A 111 8.719 -15.931 -6.928 1.00 0.00 C ATOM 1698 CD LYS A 111 9.876 -15.990 -7.907 1.00 0.00 C ATOM 1699 CE LYS A 111 9.504 -16.804 -9.134 1.00 0.00 C ATOM 1700 NZ LYS A 111 10.581 -16.804 -10.154 1.00 0.00 N ATOM 0 H LYS A 111 7.126 -13.145 -5.342 1.00 0.00 H new ATOM 0 HA LYS A 111 7.429 -15.978 -4.543 1.00 0.00 H new ATOM 0 HB2 LYS A 111 9.455 -14.182 -5.934 1.00 0.00 H new ATOM 0 HB3 LYS A 111 9.876 -15.687 -5.142 1.00 0.00 H new ATOM 0 HG2 LYS A 111 8.417 -16.945 -6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.863 -15.458 -7.409 1.00 0.00 H new ATOM 0 HD2 LYS A 111 10.157 -14.980 -8.206 1.00 0.00 H new ATOM 0 HD3 LYS A 111 10.746 -16.432 -7.422 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.289 -17.830 -8.836 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.591 -16.401 -9.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.329 -16.153 -10.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 11.473 -16.495 -9.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 10.697 -17.764 -10.536 1.00 0.00 H new ATOM 1714 N GLY A 112 7.531 -13.580 -2.785 1.00 0.00 N ATOM 1715 CA GLY A 112 7.851 -13.032 -1.482 1.00 0.00 C ATOM 1716 C GLY A 112 8.559 -11.698 -1.572 1.00 0.00 C ATOM 1717 O GLY A 112 9.625 -11.591 -2.184 1.00 0.00 O ATOM 0 H GLY A 112 6.664 -13.234 -3.196 1.00 0.00 H new ATOM 0 HA2 GLY A 112 6.933 -12.914 -0.906 1.00 0.00 H new ATOM 0 HA3 GLY A 112 8.480 -13.738 -0.939 1.00 0.00 H new ATOM 1721 N ILE A 113 7.973 -10.681 -0.960 1.00 0.00 N ATOM 1722 CA ILE A 113 8.528 -9.336 -1.012 1.00 0.00 C ATOM 1723 C ILE A 113 9.854 -9.252 -0.264 1.00 0.00 C ATOM 1724 O ILE A 113 9.909 -9.357 0.962 1.00 0.00 O ATOM 1725 CB ILE A 113 7.549 -8.287 -0.437 1.00 0.00 C ATOM 1726 CG1 ILE A 113 6.264 -8.240 -1.270 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.206 -6.911 -0.393 1.00 0.00 C ATOM 1728 CD1 ILE A 113 6.482 -7.801 -2.704 1.00 0.00 C ATOM 0 H ILE A 113 7.111 -10.761 -0.420 1.00 0.00 H new ATOM 0 HA ILE A 113 8.698 -9.113 -2.065 1.00 0.00 H new ATOM 0 HB ILE A 113 7.290 -8.579 0.581 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.804 -9.228 -1.268 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.558 -7.559 -0.794 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.503 -6.185 0.014 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.093 -6.951 0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.493 -6.612 -1.401 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.528 -7.792 -3.231 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.913 -6.800 -2.717 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.162 -8.495 -3.197 1.00 0.00 H new ATOM 1740 N THR A 114 10.919 -9.086 -1.026 1.00 0.00 N ATOM 1741 CA THR A 114 12.235 -8.834 -0.475 1.00 0.00 C ATOM 1742 C THR A 114 12.602 -7.378 -0.744 1.00 0.00 C ATOM 1743 O THR A 114 12.162 -6.807 -1.745 1.00 0.00 O ATOM 1744 CB THR A 114 13.279 -9.779 -1.105 1.00 0.00 C ATOM 1745 OG1 THR A 114 12.855 -11.140 -0.948 1.00 0.00 O ATOM 1746 CG2 THR A 114 14.651 -9.598 -0.473 1.00 0.00 C ATOM 0 H THR A 114 10.895 -9.122 -2.045 1.00 0.00 H new ATOM 0 HA THR A 114 12.225 -9.021 0.599 1.00 0.00 H new ATOM 0 HB THR A 114 13.359 -9.532 -2.164 1.00 0.00 H new ATOM 0 HG1 THR A 114 13.519 -11.738 -1.350 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.360 -10.280 -0.942 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.985 -8.571 -0.617 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.591 -9.814 0.594 1.00 0.00 H new ATOM 1754 N MET A 115 13.388 -6.773 0.142 1.00 0.00 N ATOM 1755 CA MET A 115 13.697 -5.351 0.032 1.00 0.00 C ATOM 1756 C MET A 115 14.446 -5.042 -1.262 1.00 0.00 C ATOM 1757 O MET A 115 14.311 -3.952 -1.819 1.00 0.00 O ATOM 1758 CB MET A 115 14.510 -4.875 1.233 1.00 0.00 C ATOM 1759 CG MET A 115 14.558 -3.365 1.350 1.00 0.00 C ATOM 1760 SD MET A 115 12.908 -2.647 1.466 1.00 0.00 S ATOM 1761 CE MET A 115 13.298 -0.904 1.413 1.00 0.00 C ATOM 0 H MET A 115 13.820 -7.241 0.939 1.00 0.00 H new ATOM 0 HA MET A 115 12.749 -4.813 0.015 1.00 0.00 H new ATOM 0 HB2 MET A 115 14.081 -5.292 2.144 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.526 -5.261 1.154 1.00 0.00 H new ATOM 0 HG2 MET A 115 15.137 -3.087 2.230 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.075 -2.950 0.485 1.00 0.00 H new ATOM 0 HE1 MET A 115 12.809 -0.396 2.244 1.00 0.00 H new ATOM 0 HE2 MET A 115 14.377 -0.770 1.490 1.00 0.00 H new ATOM 0 HE3 MET A 115 12.946 -0.481 0.472 1.00 0.00 H new ATOM 1771 N ALA A 116 15.231 -6.007 -1.738 1.00 0.00 N ATOM 1772 CA ALA A 116 15.933 -5.865 -3.008 1.00 0.00 C ATOM 1773 C ALA A 116 14.942 -5.542 -4.122 1.00 0.00 C ATOM 1774 O ALA A 116 15.104 -4.555 -4.848 1.00 0.00 O ATOM 1775 CB ALA A 116 16.710 -7.133 -3.330 1.00 0.00 C ATOM 0 H ALA A 116 15.395 -6.894 -1.262 1.00 0.00 H new ATOM 0 HA ALA A 116 16.643 -5.042 -2.927 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.228 -7.011 -4.281 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.438 -7.323 -2.542 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.021 -7.975 -3.398 1.00 0.00 H new ATOM 1781 N GLN A 117 13.909 -6.376 -4.236 1.00 0.00 N ATOM 1782 CA GLN A 117 12.818 -6.133 -5.167 1.00 0.00 C ATOM 1783 C GLN A 117 12.238 -4.748 -4.939 1.00 0.00 C ATOM 1784 O GLN A 117 12.386 -3.880 -5.775 1.00 0.00 O ATOM 1785 CB GLN A 117 11.700 -7.176 -5.016 1.00 0.00 C ATOM 1786 CG GLN A 117 11.999 -8.544 -5.621 1.00 0.00 C ATOM 1787 CD GLN A 117 12.796 -9.458 -4.708 1.00 0.00 C ATOM 1788 OE1 GLN A 117 13.640 -9.015 -3.933 1.00 0.00 O ATOM 1789 NE2 GLN A 117 12.516 -10.750 -4.786 1.00 0.00 N ATOM 0 H GLN A 117 13.809 -7.231 -3.689 1.00 0.00 H new ATOM 0 HA GLN A 117 13.226 -6.208 -6.175 1.00 0.00 H new ATOM 0 HB2 GLN A 117 11.487 -7.305 -3.955 1.00 0.00 H new ATOM 0 HB3 GLN A 117 10.794 -6.783 -5.478 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.058 -9.031 -5.876 1.00 0.00 H new ATOM 0 HG3 GLN A 117 12.549 -8.407 -6.552 1.00 0.00 H new ATOM 0 HE21 GLN A 117 11.808 -11.080 -5.442 1.00 0.00 H new ATOM 0 HE22 GLN A 117 13.008 -11.415 -4.190 1.00 0.00 H new ATOM 1798 N MET A 118 11.613 -4.563 -3.782 1.00 0.00 N ATOM 1799 CA MET A 118 10.935 -3.317 -3.417 1.00 0.00 C ATOM 1800 C MET A 118 11.713 -2.066 -3.846 1.00 0.00 C ATOM 1801 O MET A 118 11.177 -1.221 -4.558 1.00 0.00 O ATOM 1802 CB MET A 118 10.704 -3.288 -1.904 1.00 0.00 C ATOM 1803 CG MET A 118 9.571 -2.372 -1.470 1.00 0.00 C ATOM 1804 SD MET A 118 7.975 -3.220 -1.345 1.00 0.00 S ATOM 1805 CE MET A 118 7.720 -3.783 -3.027 1.00 0.00 C ATOM 0 H MET A 118 11.560 -5.281 -3.059 1.00 0.00 H new ATOM 0 HA MET A 118 9.985 -3.298 -3.950 1.00 0.00 H new ATOM 0 HB2 MET A 118 10.492 -4.300 -1.560 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.623 -2.970 -1.412 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.818 -1.932 -0.504 1.00 0.00 H new ATOM 0 HG3 MET A 118 9.484 -1.551 -2.181 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.665 -4.011 -3.178 1.00 0.00 H new ATOM 0 HE2 MET A 118 8.026 -3.001 -3.723 1.00 0.00 H new ATOM 0 HE3 MET A 118 8.314 -4.679 -3.205 1.00 0.00 H new ATOM 1815 N GLU A 119 12.974 -1.963 -3.433 1.00 0.00 N ATOM 1816 CA GLU A 119 13.794 -0.790 -3.750 1.00 0.00 C ATOM 1817 C GLU A 119 13.906 -0.554 -5.259 1.00 0.00 C ATOM 1818 O GLU A 119 13.534 0.513 -5.755 1.00 0.00 O ATOM 1819 CB GLU A 119 15.190 -0.935 -3.141 1.00 0.00 C ATOM 1820 CG GLU A 119 15.250 -0.620 -1.654 1.00 0.00 C ATOM 1821 CD GLU A 119 15.063 0.858 -1.361 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.865 1.672 -1.868 1.00 0.00 O ATOM 1823 OE2 GLU A 119 14.142 1.216 -0.599 1.00 0.00 O ATOM 0 H GLU A 119 13.452 -2.674 -2.879 1.00 0.00 H new ATOM 0 HA GLU A 119 13.295 0.077 -3.316 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.541 -1.954 -3.301 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.877 -0.275 -3.670 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.479 -1.190 -1.135 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.211 -0.947 -1.256 1.00 0.00 H new ATOM 1830 N LEU A 120 14.402 -1.550 -5.987 1.00 0.00 N ATOM 1831 CA LEU A 120 14.622 -1.407 -7.428 1.00 0.00 C ATOM 1832 C LEU A 120 13.295 -1.288 -8.175 1.00 0.00 C ATOM 1833 O LEU A 120 13.191 -0.600 -9.187 1.00 0.00 O ATOM 1834 CB LEU A 120 15.418 -2.597 -7.983 1.00 0.00 C ATOM 1835 CG LEU A 120 16.932 -2.577 -7.726 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.250 -2.717 -6.246 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.615 -3.678 -8.523 1.00 0.00 C ATOM 0 H LEU A 120 14.659 -2.461 -5.608 1.00 0.00 H new ATOM 0 HA LEU A 120 15.197 -0.494 -7.581 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.010 -3.512 -7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.254 -2.648 -9.059 1.00 0.00 H new ATOM 0 HG LEU A 120 17.314 -1.611 -8.055 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.330 -2.699 -6.103 1.00 0.00 H new ATOM 0 HD12 LEU A 120 16.797 -1.892 -5.697 1.00 0.00 H new ATOM 0 HD13 LEU A 120 16.851 -3.661 -5.876 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.688 -3.653 -8.332 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.215 -4.646 -8.222 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.432 -3.524 -9.586 1.00 0.00 H new ATOM 1849 N VAL A 121 12.286 -1.947 -7.641 1.00 0.00 N ATOM 1850 CA VAL A 121 10.974 -2.038 -8.261 1.00 0.00 C ATOM 1851 C VAL A 121 10.190 -0.731 -8.105 1.00 0.00 C ATOM 1852 O VAL A 121 9.554 -0.264 -9.052 1.00 0.00 O ATOM 1853 CB VAL A 121 10.201 -3.238 -7.661 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.704 -3.103 -7.826 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.676 -4.537 -8.299 1.00 0.00 C ATOM 0 H VAL A 121 12.353 -2.442 -6.752 1.00 0.00 H new ATOM 0 HA VAL A 121 11.101 -2.202 -9.331 1.00 0.00 H new ATOM 0 HB VAL A 121 10.410 -3.251 -6.591 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.210 -3.970 -7.388 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.363 -2.199 -7.323 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.459 -3.043 -8.886 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.126 -5.375 -7.870 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.500 -4.500 -9.374 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.742 -4.667 -8.110 1.00 0.00 H new ATOM 1865 N MET A 122 10.252 -0.134 -6.920 1.00 0.00 N ATOM 1866 CA MET A 122 9.625 1.166 -6.687 1.00 0.00 C ATOM 1867 C MET A 122 10.268 2.226 -7.569 1.00 0.00 C ATOM 1868 O MET A 122 9.594 3.115 -8.095 1.00 0.00 O ATOM 1869 CB MET A 122 9.748 1.577 -5.215 1.00 0.00 C ATOM 1870 CG MET A 122 8.526 1.267 -4.355 1.00 0.00 C ATOM 1871 SD MET A 122 8.100 -0.487 -4.278 1.00 0.00 S ATOM 1872 CE MET A 122 7.058 -0.675 -5.723 1.00 0.00 C ATOM 0 H MET A 122 10.728 -0.526 -6.107 1.00 0.00 H new ATOM 0 HA MET A 122 8.568 1.080 -6.938 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.614 1.074 -4.784 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.945 2.648 -5.168 1.00 0.00 H new ATOM 0 HG2 MET A 122 8.706 1.630 -3.343 1.00 0.00 H new ATOM 0 HG3 MET A 122 7.672 1.820 -4.745 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.709 -1.706 -5.789 1.00 0.00 H new ATOM 0 HE2 MET A 122 6.201 -0.006 -5.643 1.00 0.00 H new ATOM 0 HE3 MET A 122 7.629 -0.428 -6.618 1.00 0.00 H new ATOM 1882 N LYS A 123 11.577 2.112 -7.736 1.00 0.00 N ATOM 1883 CA LYS A 123 12.335 3.045 -8.555 1.00 0.00 C ATOM 1884 C LYS A 123 12.074 2.787 -10.039 1.00 0.00 C ATOM 1885 O LYS A 123 12.063 3.715 -10.849 1.00 0.00 O ATOM 1886 CB LYS A 123 13.825 2.909 -8.236 1.00 0.00 C ATOM 1887 CG LYS A 123 14.689 3.994 -8.850 1.00 0.00 C ATOM 1888 CD LYS A 123 16.100 3.944 -8.292 1.00 0.00 C ATOM 1889 CE LYS A 123 16.935 5.114 -8.777 1.00 0.00 C ATOM 1890 NZ LYS A 123 18.236 5.191 -8.064 1.00 0.00 N ATOM 0 H LYS A 123 12.140 1.376 -7.311 1.00 0.00 H new ATOM 0 HA LYS A 123 12.016 4.063 -8.330 1.00 0.00 H new ATOM 0 HB2 LYS A 123 13.957 2.922 -7.154 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.174 1.938 -8.588 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.717 3.872 -9.933 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.249 4.971 -8.650 1.00 0.00 H new ATOM 0 HD2 LYS A 123 16.061 3.951 -7.203 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.576 3.009 -8.588 1.00 0.00 H new ATOM 0 HE2 LYS A 123 17.112 5.016 -9.848 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.383 6.042 -8.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 18.780 6.002 -8.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 18.067 5.309 -7.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 18.773 4.315 -8.226 1.00 0.00 H new ATOM 1904 N ALA A 124 11.850 1.523 -10.379 1.00 0.00 N ATOM 1905 CA ALA A 124 11.557 1.125 -11.753 1.00 0.00 C ATOM 1906 C ALA A 124 10.257 1.752 -12.244 1.00 0.00 C ATOM 1907 O ALA A 124 10.142 2.133 -13.408 1.00 0.00 O ATOM 1908 CB ALA A 124 11.478 -0.392 -11.853 1.00 0.00 C ATOM 0 H ALA A 124 11.866 0.749 -9.715 1.00 0.00 H new ATOM 0 HA ALA A 124 12.366 1.484 -12.389 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.259 -0.678 -12.882 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.431 -0.827 -11.550 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.688 -0.759 -11.198 1.00 0.00 H new ATOM 1914 N ALA A 125 9.280 1.862 -11.351 1.00 0.00 N ATOM 1915 CA ALA A 125 7.987 2.434 -11.705 1.00 0.00 C ATOM 1916 C ALA A 125 8.006 3.957 -11.594 1.00 0.00 C ATOM 1917 O ALA A 125 7.078 4.634 -12.039 1.00 0.00 O ATOM 1918 CB ALA A 125 6.895 1.849 -10.826 1.00 0.00 C ATOM 0 H ALA A 125 9.359 1.563 -10.379 1.00 0.00 H new ATOM 0 HA ALA A 125 7.777 2.179 -12.744 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.934 2.285 -11.101 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.856 0.769 -10.964 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.110 2.073 -9.781 1.00 0.00 H new ATOM 1924 N GLY A 126 9.067 4.487 -11.002 1.00 0.00 N ATOM 1925 CA GLY A 126 9.215 5.925 -10.882 1.00 0.00 C ATOM 1926 C GLY A 126 8.319 6.522 -9.815 1.00 0.00 C ATOM 1927 O GLY A 126 7.698 7.567 -10.025 1.00 0.00 O ATOM 0 H GLY A 126 9.832 3.945 -10.601 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.254 6.160 -10.651 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.989 6.390 -11.842 1.00 0.00 H new ATOM 1931 N PHE A 127 8.244 5.858 -8.672 1.00 0.00 N ATOM 1932 CA PHE A 127 7.453 6.353 -7.554 1.00 0.00 C ATOM 1933 C PHE A 127 8.240 7.401 -6.770 1.00 0.00 C ATOM 1934 O PHE A 127 9.460 7.502 -6.910 1.00 0.00 O ATOM 1935 CB PHE A 127 7.056 5.204 -6.624 1.00 0.00 C ATOM 1936 CG PHE A 127 6.128 4.190 -7.241 1.00 0.00 C ATOM 1937 CD1 PHE A 127 5.054 4.590 -8.019 1.00 0.00 C ATOM 1938 CD2 PHE A 127 6.321 2.835 -7.022 1.00 0.00 C ATOM 1939 CE1 PHE A 127 4.191 3.659 -8.567 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.459 1.901 -7.564 1.00 0.00 C ATOM 1941 CZ PHE A 127 4.392 2.314 -8.338 1.00 0.00 C ATOM 0 H PHE A 127 8.721 4.974 -8.493 1.00 0.00 H new ATOM 0 HA PHE A 127 6.548 6.811 -7.954 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.960 4.694 -6.291 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.580 5.620 -5.736 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.889 5.642 -8.200 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.155 2.505 -6.420 1.00 0.00 H new ATOM 0 HE1 PHE A 127 3.360 3.985 -9.174 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.619 0.848 -7.383 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.717 1.586 -8.763 1.00 0.00 H new ATOM 1951 N LYS A 128 7.547 8.174 -5.941 1.00 0.00 N ATOM 1952 CA LYS A 128 8.214 9.151 -5.093 1.00 0.00 C ATOM 1953 C LYS A 128 8.567 8.515 -3.762 1.00 0.00 C ATOM 1954 O LYS A 128 7.721 7.884 -3.124 1.00 0.00 O ATOM 1955 CB LYS A 128 7.335 10.379 -4.824 1.00 0.00 C ATOM 1956 CG LYS A 128 6.982 11.208 -6.048 1.00 0.00 C ATOM 1957 CD LYS A 128 6.338 12.524 -5.629 1.00 0.00 C ATOM 1958 CE LYS A 128 5.808 13.317 -6.814 1.00 0.00 C ATOM 1959 NZ LYS A 128 4.697 12.611 -7.502 1.00 0.00 N ATOM 0 H LYS A 128 6.533 8.143 -5.839 1.00 0.00 H new ATOM 0 HA LYS A 128 9.110 9.477 -5.621 1.00 0.00 H new ATOM 0 HB2 LYS A 128 6.410 10.047 -4.352 1.00 0.00 H new ATOM 0 HB3 LYS A 128 7.846 11.021 -4.106 1.00 0.00 H new ATOM 0 HG2 LYS A 128 7.880 11.405 -6.633 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.300 10.650 -6.689 1.00 0.00 H new ATOM 0 HD2 LYS A 128 5.520 12.321 -4.937 1.00 0.00 H new ATOM 0 HD3 LYS A 128 7.069 13.127 -5.090 1.00 0.00 H new ATOM 0 HE2 LYS A 128 5.462 14.292 -6.472 1.00 0.00 H new ATOM 0 HE3 LYS A 128 6.617 13.496 -7.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 4.210 13.270 -8.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.079 11.814 -8.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 4.023 12.253 -6.796 1.00 0.00 H new ATOM 1973 N GLU A 129 9.812 8.674 -3.351 1.00 0.00 N ATOM 1974 CA GLU A 129 10.260 8.147 -2.078 1.00 0.00 C ATOM 1975 C GLU A 129 9.932 9.121 -0.957 1.00 0.00 C ATOM 1976 O GLU A 129 10.347 10.279 -0.987 1.00 0.00 O ATOM 1977 CB GLU A 129 11.769 7.891 -2.106 1.00 0.00 C ATOM 1978 CG GLU A 129 12.332 7.424 -0.772 1.00 0.00 C ATOM 1979 CD GLU A 129 13.737 7.938 -0.528 1.00 0.00 C ATOM 1980 OE1 GLU A 129 14.691 7.379 -1.108 1.00 0.00 O ATOM 1981 OE2 GLU A 129 13.889 8.913 0.243 1.00 0.00 O ATOM 0 H GLU A 129 10.531 9.165 -3.883 1.00 0.00 H new ATOM 0 HA GLU A 129 9.741 7.205 -1.898 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.988 7.141 -2.866 1.00 0.00 H new ATOM 0 HB3 GLU A 129 12.279 8.807 -2.406 1.00 0.00 H new ATOM 0 HG2 GLU A 129 11.679 7.761 0.033 1.00 0.00 H new ATOM 0 HG3 GLU A 129 12.336 6.334 -0.744 1.00 0.00 H new ATOM 1988 N VAL A 130 9.179 8.651 0.017 1.00 0.00 N ATOM 1989 CA VAL A 130 8.865 9.444 1.189 1.00 0.00 C ATOM 1990 C VAL A 130 9.229 8.661 2.444 1.00 0.00 C ATOM 1991 O VAL A 130 8.358 8.140 3.139 1.00 0.00 O ATOM 1992 CB VAL A 130 7.367 9.827 1.253 1.00 0.00 C ATOM 1993 CG1 VAL A 130 7.143 10.952 2.252 1.00 0.00 C ATOM 1994 CG2 VAL A 130 6.834 10.208 -0.123 1.00 0.00 C ATOM 0 H VAL A 130 8.770 7.716 0.020 1.00 0.00 H new ATOM 0 HA VAL A 130 9.445 10.365 1.125 1.00 0.00 H new ATOM 0 HB VAL A 130 6.812 8.952 1.592 1.00 0.00 H new ATOM 0 HG11 VAL A 130 6.084 11.206 2.282 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.467 10.630 3.242 1.00 0.00 H new ATOM 0 HG13 VAL A 130 7.718 11.827 1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.779 10.472 -0.044 1.00 0.00 H new ATOM 0 HG22 VAL A 130 7.394 11.061 -0.507 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.947 9.364 -0.803 1.00 0.00 H new ATOM 2004 N LYS A 131 10.520 8.521 2.707 1.00 0.00 N ATOM 2005 CA LYS A 131 10.953 7.846 3.919 1.00 0.00 C ATOM 2006 C LYS A 131 10.824 8.786 5.106 1.00 0.00 C ATOM 2007 O LYS A 131 11.417 9.865 5.137 1.00 0.00 O ATOM 2008 CB LYS A 131 12.374 7.268 3.777 1.00 0.00 C ATOM 2009 CG LYS A 131 13.406 8.197 3.148 1.00 0.00 C ATOM 2010 CD LYS A 131 14.106 9.074 4.175 1.00 0.00 C ATOM 2011 CE LYS A 131 15.242 9.867 3.546 1.00 0.00 C ATOM 2012 NZ LYS A 131 14.769 10.750 2.448 1.00 0.00 N ATOM 0 H LYS A 131 11.274 8.859 2.109 1.00 0.00 H new ATOM 0 HA LYS A 131 10.301 6.990 4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 131 12.729 6.978 4.766 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.318 6.359 3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 131 14.149 7.602 2.617 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.916 8.830 2.408 1.00 0.00 H new ATOM 0 HD2 LYS A 131 13.386 9.759 4.622 1.00 0.00 H new ATOM 0 HD3 LYS A 131 14.497 8.452 4.981 1.00 0.00 H new ATOM 0 HE2 LYS A 131 15.729 10.471 4.312 1.00 0.00 H new ATOM 0 HE3 LYS A 131 15.993 9.178 3.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.547 11.368 2.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 14.452 10.168 1.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 13.977 11.333 2.788 1.00 0.00 H new ATOM 2026 N LEU A 132 10.009 8.383 6.064 1.00 0.00 N ATOM 2027 CA LEU A 132 9.697 9.225 7.202 1.00 0.00 C ATOM 2028 C LEU A 132 10.814 9.194 8.228 1.00 0.00 C ATOM 2029 O LEU A 132 10.959 8.228 8.980 1.00 0.00 O ATOM 2030 CB LEU A 132 8.374 8.799 7.848 1.00 0.00 C ATOM 2031 CG LEU A 132 7.109 9.426 7.247 1.00 0.00 C ATOM 2032 CD1 LEU A 132 6.976 9.105 5.769 1.00 0.00 C ATOM 2033 CD2 LEU A 132 5.881 8.947 7.996 1.00 0.00 C ATOM 0 H LEU A 132 9.550 7.472 6.075 1.00 0.00 H new ATOM 0 HA LEU A 132 9.594 10.247 6.838 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.289 7.715 7.777 1.00 0.00 H new ATOM 0 HB3 LEU A 132 8.412 9.047 8.909 1.00 0.00 H new ATOM 0 HG LEU A 132 7.194 10.508 7.348 1.00 0.00 H new ATOM 0 HD11 LEU A 132 6.069 9.565 5.377 1.00 0.00 H new ATOM 0 HD12 LEU A 132 7.841 9.494 5.233 1.00 0.00 H new ATOM 0 HD13 LEU A 132 6.922 8.025 5.635 1.00 0.00 H new ATOM 0 HD21 LEU A 132 4.990 9.399 7.560 1.00 0.00 H new ATOM 0 HD22 LEU A 132 5.810 7.862 7.923 1.00 0.00 H new ATOM 0 HD23 LEU A 132 5.959 9.236 9.044 1.00 0.00 H new ATOM 2045 N GLU A 133 11.621 10.243 8.229 1.00 0.00 N ATOM 2046 CA GLU A 133 12.628 10.421 9.255 1.00 0.00 C ATOM 2047 C GLU A 133 11.936 10.766 10.564 1.00 0.00 C ATOM 2048 O GLU A 133 11.688 11.935 10.861 1.00 0.00 O ATOM 2049 CB GLU A 133 13.615 11.522 8.857 1.00 0.00 C ATOM 2050 CG GLU A 133 14.354 11.229 7.561 1.00 0.00 C ATOM 2051 CD GLU A 133 15.217 12.384 7.105 1.00 0.00 C ATOM 2052 OE1 GLU A 133 14.699 13.273 6.396 1.00 0.00 O ATOM 2053 OE2 GLU A 133 16.420 12.406 7.439 1.00 0.00 O ATOM 0 H GLU A 133 11.596 10.984 7.528 1.00 0.00 H new ATOM 0 HA GLU A 133 13.195 9.498 9.375 1.00 0.00 H new ATOM 0 HB2 GLU A 133 13.076 12.464 8.754 1.00 0.00 H new ATOM 0 HB3 GLU A 133 14.341 11.656 9.659 1.00 0.00 H new ATOM 0 HG2 GLU A 133 14.978 10.346 7.696 1.00 0.00 H new ATOM 0 HG3 GLU A 133 13.630 10.992 6.781 1.00 0.00 H new ATOM 2060 N HIS A 134 11.571 9.730 11.311 1.00 0.00 N ATOM 2061 CA HIS A 134 10.828 9.891 12.556 1.00 0.00 C ATOM 2062 C HIS A 134 11.620 10.733 13.546 1.00 0.00 C ATOM 2063 O HIS A 134 11.051 11.461 14.357 1.00 0.00 O ATOM 2064 CB HIS A 134 10.503 8.523 13.154 1.00 0.00 C ATOM 2065 CG HIS A 134 9.062 8.363 13.525 1.00 0.00 C ATOM 2066 ND1 HIS A 134 8.604 7.363 14.351 1.00 0.00 N ATOM 2067 CD2 HIS A 134 7.969 9.073 13.155 1.00 0.00 C ATOM 2068 CE1 HIS A 134 7.293 7.462 14.473 1.00 0.00 C ATOM 2069 NE2 HIS A 134 6.883 8.492 13.758 1.00 0.00 N ATOM 0 H HIS A 134 11.780 8.760 11.073 1.00 0.00 H new ATOM 0 HA HIS A 134 9.893 10.409 12.340 1.00 0.00 H new ATOM 0 HB2 HIS A 134 10.774 7.748 12.437 1.00 0.00 H new ATOM 0 HB3 HIS A 134 11.118 8.367 14.040 1.00 0.00 H new ATOM 0 HD2 HIS A 134 7.956 9.936 12.506 1.00 0.00 H new ATOM 0 HE1 HIS A 134 6.663 6.810 15.059 1.00 0.00 H new ATOM 0 HE2 HIS A 134 5.916 8.805 13.668 1.00 0.00 H new ATOM 2078 N HIS A 135 12.936 10.631 13.464 1.00 0.00 N ATOM 2079 CA HIS A 135 13.812 11.486 14.243 1.00 0.00 C ATOM 2080 C HIS A 135 14.123 12.726 13.426 1.00 0.00 C ATOM 2081 O HIS A 135 14.673 12.629 12.329 1.00 0.00 O ATOM 2082 CB HIS A 135 15.112 10.766 14.617 1.00 0.00 C ATOM 2083 CG HIS A 135 14.908 9.490 15.375 1.00 0.00 C ATOM 2084 ND1 HIS A 135 14.602 9.448 16.718 1.00 0.00 N ATOM 2085 CD2 HIS A 135 14.970 8.200 14.966 1.00 0.00 C ATOM 2086 CE1 HIS A 135 14.485 8.189 17.101 1.00 0.00 C ATOM 2087 NE2 HIS A 135 14.701 7.413 16.055 1.00 0.00 N ATOM 0 H HIS A 135 13.421 9.963 12.864 1.00 0.00 H new ATOM 0 HA HIS A 135 13.310 11.756 15.172 1.00 0.00 H new ATOM 0 HB2 HIS A 135 15.670 10.550 13.706 1.00 0.00 H new ATOM 0 HB3 HIS A 135 15.727 11.437 15.216 1.00 0.00 H new ATOM 0 HD2 HIS A 135 15.191 7.856 13.966 1.00 0.00 H new ATOM 0 HE1 HIS A 135 14.252 7.852 18.100 1.00 0.00 H new ATOM 0 HE2 HIS A 135 14.672 6.393 16.057 1.00 0.00 H new ATOM 2096 N HIS A 136 13.780 13.886 13.958 1.00 0.00 N ATOM 2097 CA HIS A 136 13.923 15.141 13.224 1.00 0.00 C ATOM 2098 C HIS A 136 15.362 15.647 13.275 1.00 0.00 C ATOM 2099 O HIS A 136 15.599 16.850 13.373 1.00 0.00 O ATOM 2100 CB HIS A 136 12.971 16.197 13.792 1.00 0.00 C ATOM 2101 CG HIS A 136 11.521 15.855 13.624 1.00 0.00 C ATOM 2102 ND1 HIS A 136 10.642 15.753 14.680 1.00 0.00 N ATOM 2103 CD2 HIS A 136 10.796 15.599 12.510 1.00 0.00 C ATOM 2104 CE1 HIS A 136 9.442 15.447 14.226 1.00 0.00 C ATOM 2105 NE2 HIS A 136 9.509 15.348 12.913 1.00 0.00 N ATOM 0 H HIS A 136 13.399 13.990 14.898 1.00 0.00 H new ATOM 0 HA HIS A 136 13.666 14.954 12.181 1.00 0.00 H new ATOM 0 HB2 HIS A 136 13.183 16.331 14.853 1.00 0.00 H new ATOM 0 HB3 HIS A 136 13.169 17.151 13.304 1.00 0.00 H new ATOM 0 HD2 HIS A 136 11.162 15.593 11.494 1.00 0.00 H new ATOM 0 HE1 HIS A 136 8.556 15.302 14.827 1.00 0.00 H new ATOM 0 HE2 HIS A 136 8.729 15.121 12.296 1.00 0.00 H new ATOM 2114 N HIS A 137 16.307 14.717 13.163 1.00 0.00 N ATOM 2115 CA HIS A 137 17.736 15.018 13.238 1.00 0.00 C ATOM 2116 C HIS A 137 18.081 15.598 14.604 1.00 0.00 C ATOM 2117 O HIS A 137 18.259 16.808 14.763 1.00 0.00 O ATOM 2118 CB HIS A 137 18.177 15.969 12.115 1.00 0.00 C ATOM 2119 CG HIS A 137 17.873 15.455 10.738 1.00 0.00 C ATOM 2120 ND1 HIS A 137 17.320 16.237 9.749 1.00 0.00 N ATOM 2121 CD2 HIS A 137 18.037 14.227 10.193 1.00 0.00 C ATOM 2122 CE1 HIS A 137 17.152 15.514 8.660 1.00 0.00 C ATOM 2123 NE2 HIS A 137 17.578 14.287 8.899 1.00 0.00 N ATOM 0 H HIS A 137 16.103 13.728 13.017 1.00 0.00 H new ATOM 0 HA HIS A 137 18.282 14.084 13.104 1.00 0.00 H new ATOM 0 HB2 HIS A 137 17.684 16.932 12.251 1.00 0.00 H new ATOM 0 HB3 HIS A 137 19.249 16.145 12.199 1.00 0.00 H new ATOM 0 HD2 HIS A 137 18.452 13.360 10.685 1.00 0.00 H new ATOM 0 HE1 HIS A 137 16.736 15.866 7.728 1.00 0.00 H new ATOM 0 HE2 HIS A 137 17.568 13.513 8.234 1.00 0.00 H new ATOM 2132 N HIS A 138 18.143 14.723 15.595 1.00 0.00 N ATOM 2133 CA HIS A 138 18.403 15.134 16.965 1.00 0.00 C ATOM 2134 C HIS A 138 19.691 14.509 17.477 1.00 0.00 C ATOM 2135 O HIS A 138 19.803 13.287 17.589 1.00 0.00 O ATOM 2136 CB HIS A 138 17.226 14.754 17.875 1.00 0.00 C ATOM 2137 CG HIS A 138 17.457 15.054 19.329 1.00 0.00 C ATOM 2138 ND1 HIS A 138 17.737 16.316 19.805 1.00 0.00 N ATOM 2139 CD2 HIS A 138 17.460 14.240 20.412 1.00 0.00 C ATOM 2140 CE1 HIS A 138 17.904 16.267 21.112 1.00 0.00 C ATOM 2141 NE2 HIS A 138 17.739 15.019 21.509 1.00 0.00 N ATOM 0 H HIS A 138 18.016 13.718 15.475 1.00 0.00 H new ATOM 0 HA HIS A 138 18.516 16.218 16.980 1.00 0.00 H new ATOM 0 HB2 HIS A 138 16.335 15.287 17.542 1.00 0.00 H new ATOM 0 HB3 HIS A 138 17.022 13.689 17.762 1.00 0.00 H new ATOM 0 HD2 HIS A 138 17.277 13.176 20.413 1.00 0.00 H new ATOM 0 HE1 HIS A 138 18.137 17.107 21.750 1.00 0.00 H new ATOM 0 HE2 HIS A 138 17.807 14.688 22.471 1.00 0.00 H new ATOM 2150 N HIS A 139 20.658 15.354 17.777 1.00 0.00 N ATOM 2151 CA HIS A 139 21.924 14.912 18.328 1.00 0.00 C ATOM 2152 C HIS A 139 22.569 16.056 19.087 1.00 0.00 C ATOM 2153 O HIS A 139 22.770 17.122 18.473 1.00 0.00 O ATOM 2154 CB HIS A 139 22.863 14.416 17.225 1.00 0.00 C ATOM 2155 CG HIS A 139 24.147 13.856 17.753 1.00 0.00 C ATOM 2156 ND1 HIS A 139 25.372 14.454 17.555 1.00 0.00 N ATOM 2157 CD2 HIS A 139 24.388 12.742 18.483 1.00 0.00 C ATOM 2158 CE1 HIS A 139 26.309 13.733 18.142 1.00 0.00 C ATOM 2159 NE2 HIS A 139 25.738 12.691 18.711 1.00 0.00 N ATOM 2160 OXT HIS A 139 22.874 15.882 20.277 1.00 0.00 O ATOM 0 H HIS A 139 20.589 16.363 17.646 1.00 0.00 H new ATOM 0 HA HIS A 139 21.737 14.080 19.007 1.00 0.00 H new ATOM 0 HB2 HIS A 139 22.353 13.651 16.640 1.00 0.00 H new ATOM 0 HB3 HIS A 139 23.085 15.240 16.547 1.00 0.00 H new ATOM 0 HD2 HIS A 139 23.653 12.027 18.822 1.00 0.00 H new ATOM 0 HE1 HIS A 139 27.365 13.959 18.154 1.00 0.00 H new ATOM 0 HE2 HIS A 139 26.223 11.964 19.237 1.00 0.00 H new TER 2169 HIS A 139