USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1090 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 117 GLN : amide:sc= -0.569 X(o=-0.57,f=-0.38) USER MOD Set 2.1: A 74 THR OG1 : rot -100:sc= -2.55! USER MOD Set 2.2: A 81 GLN :FLIP amide:sc= -0.101 F(o=-3.9!,f=-2.7) USER MOD Set 3.1: A 72 LYS NZ :NH3+ 136:sc= -0.267 (180deg=-3.89!) USER MOD Set 3.2: A 83 ASN : amide:sc= -0.54 K(o=-0.81,f=-13!) USER MOD Set 4.1: A 38 LYS NZ :NH3+ 168:sc= 1.06 (180deg=0.798) USER MOD Set 4.2: A 40 GLN : amide:sc= 0.518 K(o=1.6,f=0.82) USER MOD Set 5.1: A 33 GLN : amide:sc= -1.41! X(o=-1.5!,f=-1.5) USER MOD Set 5.2: A 35 SER OG : rot -155:sc= 0 USER MOD Set 5.3: A 118 MET CE :methyl 178:sc= -0.11 (180deg=-0.0615) USER MOD Set 5.4: A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 1 MET CE :methyl 157:sc= 0 (180deg=0) USER MOD Set 6.2: A 25 TYR OH : rot 150:sc= 0 USER MOD Set 7.1: A 9 LYS NZ :NH3+ -138:sc= 0.915 (180deg=-0.211) USER MOD Set 7.2: A 22 THR OG1 : rot 140:sc= 0.506 USER MOD Single : A 1 MET N :NH3+ 175:sc= -0.129 (180deg=-0.171) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= -0.264 USER MOD Single : A 8 LYS NZ :NH3+ -155:sc= 0.932 (180deg=0.485) USER MOD Single : A 11 SER OG : rot 180:sc= -0.463 USER MOD Single : A 13 ASN :FLIP amide:sc= -0.0589 F(o=-1.3,f=-0.059) USER MOD Single : A 15 ASN :FLIP amide:sc= -0.0145 F(o=-1.1,f=-0.014) USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.329 USER MOD Single : A 23 TYR OH : rot 30:sc= -0.346 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= -0.215 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -24:sc= 0.115 USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.0756 USER MOD Single : A 49 LYS NZ :NH3+ -171:sc= 1.16 (180deg=0.887) USER MOD Single : A 54 LYS NZ :NH3+ 159:sc= 1.27 (180deg=1.16) USER MOD Single : A 55 THR OG1 : rot 73:sc= 1.23 USER MOD Single : A 60 SER OG : rot -46:sc= 0.448 USER MOD Single : A 62 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0679) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -172:sc= -0.0115 (180deg=-0.105) USER MOD Single : A 65 ASN :FLIP amide:sc= -0.222 F(o=-1.8!,f=-0.22) USER MOD Single : A 75 TYR OH : rot 180:sc= -0.602 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 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 85 THR OG1 : rot 158:sc= 1.14 USER MOD Single : A 88 MET CE :methyl 165:sc= 0 (180deg=-0.0213) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -125:sc= -0.645 (180deg=-3.78!) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.0372 X(o=-0.037,f=-0.2) USER MOD Single : A 105 SER OG : rot 180:sc= -0.0799 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl 158:sc= -0.0153 (180deg=-0.154) USER MOD Single : A 123 LYS NZ :NH3+ 159:sc= 1.64 (180deg=0.0251) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ -114:sc= 0.68 (180deg=-0.0222) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) 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=-0.0036) USER MOD Single : A 137 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 138 HIS : no HE2:sc= 0.572 K(o=0.57,f=-2.6!) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.355 2.508 7.651 1.00 0.00 N ATOM 2 CA MET A 1 21.519 3.724 7.800 1.00 0.00 C ATOM 3 C MET A 1 20.454 3.537 8.881 1.00 0.00 C ATOM 4 O MET A 1 20.216 4.439 9.685 1.00 0.00 O ATOM 5 CB MET A 1 20.870 4.106 6.460 1.00 0.00 C ATOM 6 CG MET A 1 20.051 2.998 5.813 1.00 0.00 C ATOM 7 SD MET A 1 19.395 3.477 4.202 1.00 0.00 S ATOM 8 CE MET A 1 18.546 1.972 3.723 1.00 0.00 C ATOM 0 H1 MET A 1 23.012 2.634 6.855 1.00 0.00 H new ATOM 0 H2 MET A 1 22.896 2.350 8.525 1.00 0.00 H new ATOM 0 H3 MET A 1 21.744 1.687 7.469 1.00 0.00 H new ATOM 0 HA MET A 1 22.172 4.539 8.112 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.226 4.971 6.617 1.00 0.00 H new ATOM 0 HB3 MET A 1 21.653 4.413 5.767 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.673 2.110 5.699 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.226 2.728 6.472 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.774 2.207 2.990 1.00 0.00 H new ATOM 0 HE2 MET A 1 19.261 1.275 3.286 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.087 1.518 4.601 1.00 0.00 H new ATOM 20 N GLY A 2 19.831 2.366 8.919 1.00 0.00 N ATOM 21 CA GLY A 2 18.782 2.119 9.890 1.00 0.00 C ATOM 22 C GLY A 2 19.169 1.051 10.889 1.00 0.00 C ATOM 23 O GLY A 2 20.299 0.553 10.865 1.00 0.00 O ATOM 0 H GLY A 2 20.033 1.584 8.296 1.00 0.00 H new ATOM 0 HA2 GLY A 2 18.554 3.044 10.419 1.00 0.00 H new ATOM 0 HA3 GLY A 2 17.873 1.816 9.371 1.00 0.00 H new ATOM 27 N ASP A 3 18.242 0.685 11.767 1.00 0.00 N ATOM 28 CA ASP A 3 18.521 -0.326 12.777 1.00 0.00 C ATOM 29 C ASP A 3 17.249 -1.010 13.270 1.00 0.00 C ATOM 30 O ASP A 3 17.169 -2.238 13.292 1.00 0.00 O ATOM 31 CB ASP A 3 19.268 0.287 13.962 1.00 0.00 C ATOM 32 CG ASP A 3 19.717 -0.765 14.952 1.00 0.00 C ATOM 33 OD1 ASP A 3 20.591 -1.585 14.595 1.00 0.00 O ATOM 34 OD2 ASP A 3 19.193 -0.787 16.086 1.00 0.00 O ATOM 0 H ASP A 3 17.298 1.070 11.799 1.00 0.00 H new ATOM 0 HA ASP A 3 19.148 -1.082 12.304 1.00 0.00 H new ATOM 0 HB2 ASP A 3 20.136 0.837 13.599 1.00 0.00 H new ATOM 0 HB3 ASP A 3 18.622 1.007 14.465 1.00 0.00 H new ATOM 39 N LYS A 4 16.253 -0.224 13.652 1.00 0.00 N ATOM 40 CA LYS A 4 15.046 -0.776 14.253 1.00 0.00 C ATOM 41 C LYS A 4 13.800 -0.124 13.675 1.00 0.00 C ATOM 42 O LYS A 4 13.533 1.052 13.929 1.00 0.00 O ATOM 43 CB LYS A 4 15.069 -0.595 15.773 1.00 0.00 C ATOM 44 CG LYS A 4 13.863 -1.201 16.472 1.00 0.00 C ATOM 45 CD LYS A 4 13.927 -1.004 17.978 1.00 0.00 C ATOM 46 CE LYS A 4 12.736 -1.646 18.670 1.00 0.00 C ATOM 47 NZ LYS A 4 12.817 -1.518 20.147 1.00 0.00 N ATOM 0 H LYS A 4 16.255 0.792 13.558 1.00 0.00 H new ATOM 0 HA LYS A 4 15.018 -1.841 14.023 1.00 0.00 H new ATOM 0 HB2 LYS A 4 15.976 -1.049 16.172 1.00 0.00 H new ATOM 0 HB3 LYS A 4 15.117 0.469 16.004 1.00 0.00 H new ATOM 0 HG2 LYS A 4 12.951 -0.746 16.084 1.00 0.00 H new ATOM 0 HG3 LYS A 4 13.809 -2.266 16.246 1.00 0.00 H new ATOM 0 HD2 LYS A 4 14.851 -1.435 18.364 1.00 0.00 H new ATOM 0 HD3 LYS A 4 13.952 0.061 18.207 1.00 0.00 H new ATOM 0 HE2 LYS A 4 11.816 -1.181 18.315 1.00 0.00 H new ATOM 0 HE3 LYS A 4 12.684 -2.701 18.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 11.986 -1.969 20.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 13.682 -1.984 20.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 12.840 -0.511 20.407 1.00 0.00 H new ATOM 61 N GLU A 5 13.047 -0.908 12.907 1.00 0.00 N ATOM 62 CA GLU A 5 11.806 -0.454 12.283 1.00 0.00 C ATOM 63 C GLU A 5 12.029 0.809 11.459 1.00 0.00 C ATOM 64 O GLU A 5 11.747 1.923 11.905 1.00 0.00 O ATOM 65 CB GLU A 5 10.707 -0.220 13.326 1.00 0.00 C ATOM 66 CG GLU A 5 10.276 -1.481 14.057 1.00 0.00 C ATOM 67 CD GLU A 5 9.030 -1.270 14.894 1.00 0.00 C ATOM 68 OE1 GLU A 5 7.916 -1.389 14.341 1.00 0.00 O ATOM 69 OE2 GLU A 5 9.154 -0.991 16.103 1.00 0.00 O ATOM 0 H GLU A 5 13.281 -1.879 12.699 1.00 0.00 H new ATOM 0 HA GLU A 5 11.476 -1.247 11.612 1.00 0.00 H new ATOM 0 HB2 GLU A 5 11.061 0.509 14.055 1.00 0.00 H new ATOM 0 HB3 GLU A 5 9.839 0.218 12.833 1.00 0.00 H new ATOM 0 HG2 GLU A 5 10.092 -2.273 13.331 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.088 -1.820 14.700 1.00 0.00 H new ATOM 76 N GLU A 6 12.536 0.628 10.254 1.00 0.00 N ATOM 77 CA GLU A 6 12.816 1.748 9.379 1.00 0.00 C ATOM 78 C GLU A 6 11.665 1.928 8.404 1.00 0.00 C ATOM 79 O GLU A 6 11.290 0.996 7.694 1.00 0.00 O ATOM 80 CB GLU A 6 14.125 1.528 8.622 1.00 0.00 C ATOM 81 CG GLU A 6 15.308 1.215 9.525 1.00 0.00 C ATOM 82 CD GLU A 6 15.493 2.239 10.629 1.00 0.00 C ATOM 83 OE1 GLU A 6 15.309 3.443 10.369 1.00 0.00 O ATOM 84 OE2 GLU A 6 15.841 1.842 11.762 1.00 0.00 O ATOM 0 H GLU A 6 12.762 -0.285 9.860 1.00 0.00 H new ATOM 0 HA GLU A 6 12.923 2.650 9.981 1.00 0.00 H new ATOM 0 HB2 GLU A 6 13.992 0.709 7.915 1.00 0.00 H new ATOM 0 HB3 GLU A 6 14.351 2.420 8.038 1.00 0.00 H new ATOM 0 HG2 GLU A 6 15.169 0.230 9.970 1.00 0.00 H new ATOM 0 HG3 GLU A 6 16.216 1.168 8.923 1.00 0.00 H new ATOM 91 N SER A 7 11.094 3.116 8.385 1.00 0.00 N ATOM 92 CA SER A 7 9.912 3.369 7.586 1.00 0.00 C ATOM 93 C SER A 7 10.277 3.988 6.240 1.00 0.00 C ATOM 94 O SER A 7 10.860 5.071 6.180 1.00 0.00 O ATOM 95 CB SER A 7 8.964 4.288 8.359 1.00 0.00 C ATOM 96 OG SER A 7 8.748 3.789 9.670 1.00 0.00 O ATOM 0 H SER A 7 11.429 3.921 8.914 1.00 0.00 H new ATOM 0 HA SER A 7 9.415 2.420 7.387 1.00 0.00 H new ATOM 0 HB2 SER A 7 9.383 5.293 8.410 1.00 0.00 H new ATOM 0 HB3 SER A 7 8.013 4.366 7.832 1.00 0.00 H new ATOM 0 HG SER A 7 8.141 4.388 10.152 1.00 0.00 H new ATOM 102 N LYS A 8 9.949 3.289 5.166 1.00 0.00 N ATOM 103 CA LYS A 8 10.147 3.815 3.828 1.00 0.00 C ATOM 104 C LYS A 8 8.790 4.043 3.184 1.00 0.00 C ATOM 105 O LYS A 8 7.997 3.117 3.030 1.00 0.00 O ATOM 106 CB LYS A 8 10.992 2.854 2.987 1.00 0.00 C ATOM 107 CG LYS A 8 11.441 3.433 1.653 1.00 0.00 C ATOM 108 CD LYS A 8 12.315 2.450 0.893 1.00 0.00 C ATOM 109 CE LYS A 8 12.798 3.026 -0.430 1.00 0.00 C ATOM 110 NZ LYS A 8 13.567 2.024 -1.217 1.00 0.00 N ATOM 0 H LYS A 8 9.543 2.354 5.196 1.00 0.00 H new ATOM 0 HA LYS A 8 10.685 4.761 3.886 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.872 2.563 3.560 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.417 1.946 2.803 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.568 3.687 1.052 1.00 0.00 H new ATOM 0 HG3 LYS A 8 11.992 4.358 1.822 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.174 2.179 1.506 1.00 0.00 H new ATOM 0 HD3 LYS A 8 11.754 1.534 0.707 1.00 0.00 H new ATOM 0 HE2 LYS A 8 11.942 3.368 -1.012 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.424 3.898 -0.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.218 2.515 -1.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.112 1.419 -0.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.909 1.437 -1.769 1.00 0.00 H new ATOM 124 N LYS A 9 8.527 5.285 2.839 1.00 0.00 N ATOM 125 CA LYS A 9 7.228 5.688 2.340 1.00 0.00 C ATOM 126 C LYS A 9 7.351 6.148 0.898 1.00 0.00 C ATOM 127 O LYS A 9 8.381 6.689 0.502 1.00 0.00 O ATOM 128 CB LYS A 9 6.698 6.821 3.223 1.00 0.00 C ATOM 129 CG LYS A 9 5.260 7.238 2.968 1.00 0.00 C ATOM 130 CD LYS A 9 4.927 8.484 3.776 1.00 0.00 C ATOM 131 CE LYS A 9 3.439 8.784 3.793 1.00 0.00 C ATOM 132 NZ LYS A 9 2.672 7.751 4.538 1.00 0.00 N ATOM 0 H LYS A 9 9.206 6.044 2.896 1.00 0.00 H new ATOM 0 HA LYS A 9 6.534 4.848 2.371 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.789 6.517 4.266 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.339 7.692 3.088 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.113 7.433 1.906 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.584 6.427 3.240 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.280 8.355 4.799 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.462 9.337 3.359 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.271 9.760 4.249 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.069 8.843 2.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.799 7.526 4.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 3.250 6.891 4.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.430 8.112 5.483 1.00 0.00 H new ATOM 146 N PHE A 10 6.324 5.897 0.112 1.00 0.00 N ATOM 147 CA PHE A 10 6.246 6.435 -1.232 1.00 0.00 C ATOM 148 C PHE A 10 4.790 6.715 -1.555 1.00 0.00 C ATOM 149 O PHE A 10 3.901 6.113 -0.959 1.00 0.00 O ATOM 150 CB PHE A 10 6.862 5.468 -2.262 1.00 0.00 C ATOM 151 CG PHE A 10 5.954 4.354 -2.714 1.00 0.00 C ATOM 152 CD1 PHE A 10 5.048 4.561 -3.746 1.00 0.00 C ATOM 153 CD2 PHE A 10 6.010 3.106 -2.120 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.215 3.547 -4.172 1.00 0.00 C ATOM 155 CE2 PHE A 10 5.179 2.086 -2.546 1.00 0.00 C ATOM 156 CZ PHE A 10 4.281 2.309 -3.573 1.00 0.00 C ATOM 0 H PHE A 10 5.527 5.320 0.382 1.00 0.00 H new ATOM 0 HA PHE A 10 6.821 7.360 -1.284 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.171 6.041 -3.136 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.763 5.030 -1.833 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.995 5.529 -4.222 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.709 2.927 -1.316 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.513 3.724 -4.973 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.232 1.115 -2.076 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.632 1.513 -3.905 1.00 0.00 H new ATOM 166 N SER A 11 4.538 7.623 -2.477 1.00 0.00 N ATOM 167 CA SER A 11 3.177 7.925 -2.871 1.00 0.00 C ATOM 168 C SER A 11 3.127 8.322 -4.336 1.00 0.00 C ATOM 169 O SER A 11 3.810 9.250 -4.767 1.00 0.00 O ATOM 170 CB SER A 11 2.587 9.028 -1.983 1.00 0.00 C ATOM 171 OG SER A 11 1.258 9.341 -2.361 1.00 0.00 O ATOM 0 H SER A 11 5.254 8.162 -2.965 1.00 0.00 H new ATOM 0 HA SER A 11 2.571 7.029 -2.739 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.604 8.707 -0.942 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.206 9.922 -2.051 1.00 0.00 H new ATOM 0 HG SER A 11 0.909 10.045 -1.776 1.00 0.00 H new ATOM 177 N ALA A 12 2.334 7.589 -5.098 1.00 0.00 N ATOM 178 CA ALA A 12 2.167 7.858 -6.513 1.00 0.00 C ATOM 179 C ALA A 12 0.701 8.107 -6.830 1.00 0.00 C ATOM 180 O ALA A 12 -0.150 7.243 -6.603 1.00 0.00 O ATOM 181 CB ALA A 12 2.704 6.698 -7.341 1.00 0.00 C ATOM 0 H ALA A 12 1.792 6.796 -4.755 1.00 0.00 H new ATOM 0 HA ALA A 12 2.734 8.753 -6.769 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.571 6.915 -8.401 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.764 6.560 -7.129 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.161 5.788 -7.087 1.00 0.00 H new ATOM 187 N ASN A 13 0.404 9.295 -7.331 1.00 0.00 N ATOM 188 CA ASN A 13 -0.955 9.637 -7.718 1.00 0.00 C ATOM 189 C ASN A 13 -1.263 9.038 -9.081 1.00 0.00 C ATOM 190 O ASN A 13 -0.940 9.626 -10.117 1.00 0.00 O ATOM 191 CB ASN A 13 -1.151 11.158 -7.753 1.00 0.00 C ATOM 192 CG ASN A 13 -1.006 11.803 -6.388 1.00 0.00 C ATOM 193 OD1 ASN A 13 -2.120 11.975 -5.695 1.00 0.00 O flip ATOM 194 ND2 ASN A 13 0.094 12.168 -5.969 1.00 0.00 N flip ATOM 0 H ASN A 13 1.086 10.039 -7.479 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.641 9.226 -6.977 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.424 11.597 -8.436 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.140 11.383 -8.152 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.930 12.017 -6.533 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.168 12.621 -5.058 1.00 0.00 H new ATOM 201 N LEU A 14 -1.862 7.854 -9.079 1.00 0.00 N ATOM 202 CA LEU A 14 -2.160 7.148 -10.317 1.00 0.00 C ATOM 203 C LEU A 14 -3.442 7.689 -10.934 1.00 0.00 C ATOM 204 O LEU A 14 -4.479 7.022 -10.918 1.00 0.00 O ATOM 205 CB LEU A 14 -2.292 5.640 -10.071 1.00 0.00 C ATOM 206 CG LEU A 14 -1.106 4.974 -9.362 1.00 0.00 C ATOM 207 CD1 LEU A 14 -1.358 3.484 -9.207 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.192 5.212 -10.121 1.00 0.00 C ATOM 0 H LEU A 14 -2.151 7.363 -8.233 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.333 7.311 -11.008 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.190 5.465 -9.479 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -2.441 5.146 -11.031 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.007 5.423 -8.374 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.509 3.022 -8.702 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -2.261 3.327 -8.616 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.485 3.032 -10.191 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.015 4.728 -9.595 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.108 4.795 -11.125 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.383 6.283 -10.188 1.00 0.00 H new ATOM 220 N ASN A 15 -3.360 8.926 -11.425 1.00 0.00 N ATOM 221 CA ASN A 15 -4.477 9.633 -12.060 1.00 0.00 C ATOM 222 C ASN A 15 -5.532 10.040 -11.035 1.00 0.00 C ATOM 223 O ASN A 15 -5.877 11.215 -10.908 1.00 0.00 O ATOM 224 CB ASN A 15 -5.112 8.794 -13.175 1.00 0.00 C ATOM 225 CG ASN A 15 -6.148 9.566 -13.973 1.00 0.00 C ATOM 226 OD1 ASN A 15 -5.927 10.861 -14.146 1.00 0.00 O flip ATOM 227 ND2 ASN A 15 -7.132 8.995 -14.445 1.00 0.00 N flip ATOM 0 H ASN A 15 -2.501 9.476 -11.393 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.069 10.539 -12.508 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.331 8.441 -13.848 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.580 7.912 -12.738 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.266 7.996 -14.289 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.813 9.521 -14.992 1.00 0.00 H new ATOM 234 N GLY A 16 -6.015 9.064 -10.300 1.00 0.00 N ATOM 235 CA GLY A 16 -7.036 9.306 -9.303 1.00 0.00 C ATOM 236 C GLY A 16 -6.720 8.632 -7.985 1.00 0.00 C ATOM 237 O GLY A 16 -6.939 9.205 -6.919 1.00 0.00 O ATOM 0 H GLY A 16 -5.717 8.091 -10.374 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.139 10.379 -9.144 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.995 8.945 -9.673 1.00 0.00 H new ATOM 241 N THR A 17 -6.198 7.416 -8.051 1.00 0.00 N ATOM 242 CA THR A 17 -5.861 6.675 -6.849 1.00 0.00 C ATOM 243 C THR A 17 -4.517 7.114 -6.288 1.00 0.00 C ATOM 244 O THR A 17 -3.467 6.882 -6.896 1.00 0.00 O ATOM 245 CB THR A 17 -5.838 5.163 -7.122 1.00 0.00 C ATOM 246 OG1 THR A 17 -5.224 4.906 -8.391 1.00 0.00 O ATOM 247 CG2 THR A 17 -7.244 4.592 -7.101 1.00 0.00 C ATOM 0 H THR A 17 -6.000 6.924 -8.922 1.00 0.00 H new ATOM 0 HA THR A 17 -6.634 6.889 -6.111 1.00 0.00 H new ATOM 0 HB THR A 17 -5.258 4.678 -6.337 1.00 0.00 H new ATOM 0 HG1 THR A 17 -5.211 3.941 -8.559 1.00 0.00 H new ATOM 0 HG21 THR A 17 -7.204 3.520 -7.297 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.693 4.766 -6.123 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.846 5.079 -7.868 1.00 0.00 H new ATOM 255 N GLU A 18 -4.558 7.770 -5.140 1.00 0.00 N ATOM 256 CA GLU A 18 -3.351 8.206 -4.464 1.00 0.00 C ATOM 257 C GLU A 18 -2.816 7.071 -3.609 1.00 0.00 C ATOM 258 O GLU A 18 -3.268 6.866 -2.484 1.00 0.00 O ATOM 259 CB GLU A 18 -3.645 9.420 -3.585 1.00 0.00 C ATOM 260 CG GLU A 18 -4.607 10.402 -4.224 1.00 0.00 C ATOM 261 CD GLU A 18 -4.855 11.617 -3.362 1.00 0.00 C ATOM 262 OE1 GLU A 18 -3.991 12.519 -3.329 1.00 0.00 O ATOM 263 OE2 GLU A 18 -5.919 11.678 -2.720 1.00 0.00 O ATOM 0 H GLU A 18 -5.422 8.013 -4.655 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.606 8.487 -5.209 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.060 9.081 -2.636 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.710 9.932 -3.360 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.209 10.720 -5.188 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.555 9.901 -4.420 1.00 0.00 H new ATOM 270 N ILE A 19 -1.891 6.306 -4.156 1.00 0.00 N ATOM 271 CA ILE A 19 -1.338 5.176 -3.436 1.00 0.00 C ATOM 272 C ILE A 19 -0.074 5.584 -2.695 1.00 0.00 C ATOM 273 O ILE A 19 0.986 5.765 -3.299 1.00 0.00 O ATOM 274 CB ILE A 19 -1.035 3.989 -4.378 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.322 3.532 -5.071 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.403 2.838 -3.606 1.00 0.00 C ATOM 277 CD1 ILE A 19 -2.146 2.311 -5.947 1.00 0.00 C ATOM 0 H ILE A 19 -1.509 6.445 -5.091 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.089 4.851 -2.716 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.324 4.316 -5.137 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.075 3.318 -4.313 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.706 4.351 -5.679 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.198 2.012 -4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.529 3.173 -3.151 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.088 2.503 -2.827 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.101 2.049 -6.403 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -1.418 2.526 -6.729 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.792 1.477 -5.341 1.00 0.00 H new ATOM 289 N ALA A 20 -0.203 5.772 -1.391 1.00 0.00 N ATOM 290 CA ALA A 20 0.942 6.065 -0.552 1.00 0.00 C ATOM 291 C ALA A 20 1.213 4.893 0.374 1.00 0.00 C ATOM 292 O ALA A 20 0.511 4.679 1.360 1.00 0.00 O ATOM 293 CB ALA A 20 0.736 7.352 0.238 1.00 0.00 C ATOM 0 H ALA A 20 -1.092 5.726 -0.893 1.00 0.00 H new ATOM 0 HA ALA A 20 1.811 6.216 -1.192 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.613 7.543 0.857 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.591 8.183 -0.452 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.143 7.251 0.875 1.00 0.00 H new ATOM 299 N ILE A 21 2.225 4.121 0.028 1.00 0.00 N ATOM 300 CA ILE A 21 2.586 2.949 0.796 1.00 0.00 C ATOM 301 C ILE A 21 3.737 3.268 1.736 1.00 0.00 C ATOM 302 O ILE A 21 4.761 3.809 1.320 1.00 0.00 O ATOM 303 CB ILE A 21 2.977 1.774 -0.122 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.787 1.361 -0.992 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.480 0.597 0.698 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.078 0.193 -1.913 1.00 0.00 C ATOM 0 H ILE A 21 2.815 4.288 -0.787 1.00 0.00 H new ATOM 0 HA ILE A 21 1.713 2.654 1.378 1.00 0.00 H new ATOM 0 HB ILE A 21 3.786 2.100 -0.776 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.949 1.101 -0.345 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.474 2.215 -1.592 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.751 -0.222 0.031 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.355 0.901 1.273 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.696 0.266 1.379 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.188 -0.041 -2.497 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.895 0.455 -2.586 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.361 -0.676 -1.320 1.00 0.00 H new ATOM 318 N THR A 22 3.548 2.954 3.002 1.00 0.00 N ATOM 319 CA THR A 22 4.576 3.148 4.001 1.00 0.00 C ATOM 320 C THR A 22 5.018 1.793 4.541 1.00 0.00 C ATOM 321 O THR A 22 4.396 1.241 5.448 1.00 0.00 O ATOM 322 CB THR A 22 4.056 4.021 5.158 1.00 0.00 C ATOM 323 OG1 THR A 22 3.262 5.095 4.629 1.00 0.00 O ATOM 324 CG2 THR A 22 5.210 4.589 5.974 1.00 0.00 C ATOM 0 H THR A 22 2.680 2.559 3.365 1.00 0.00 H new ATOM 0 HA THR A 22 5.422 3.657 3.538 1.00 0.00 H new ATOM 0 HB THR A 22 3.447 3.399 5.814 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.480 5.237 5.202 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.816 5.202 6.785 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.798 3.771 6.390 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.843 5.201 5.332 1.00 0.00 H new ATOM 332 N TYR A 23 6.065 1.234 3.964 1.00 0.00 N ATOM 333 CA TYR A 23 6.499 -0.088 4.362 1.00 0.00 C ATOM 334 C TYR A 23 7.704 -0.021 5.285 1.00 0.00 C ATOM 335 O TYR A 23 8.788 0.435 4.913 1.00 0.00 O ATOM 336 CB TYR A 23 6.745 -1.003 3.150 1.00 0.00 C ATOM 337 CG TYR A 23 7.671 -0.470 2.072 1.00 0.00 C ATOM 338 CD1 TYR A 23 7.294 0.589 1.252 1.00 0.00 C ATOM 339 CD2 TYR A 23 8.912 -1.053 1.857 1.00 0.00 C ATOM 340 CE1 TYR A 23 8.129 1.051 0.252 1.00 0.00 C ATOM 341 CE2 TYR A 23 9.750 -0.600 0.857 1.00 0.00 C ATOM 342 CZ TYR A 23 9.356 0.452 0.059 1.00 0.00 C ATOM 343 OH TYR A 23 10.188 0.898 -0.944 1.00 0.00 O ATOM 0 H TYR A 23 6.623 1.669 3.229 1.00 0.00 H new ATOM 0 HA TYR A 23 5.685 -0.540 4.929 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.152 -1.947 3.513 1.00 0.00 H new ATOM 0 HB3 TYR A 23 5.782 -1.227 2.691 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.332 1.058 1.399 1.00 0.00 H new ATOM 0 HD2 TYR A 23 9.228 -1.875 2.482 1.00 0.00 H new ATOM 0 HE1 TYR A 23 7.822 1.876 -0.374 1.00 0.00 H new ATOM 0 HE2 TYR A 23 10.710 -1.069 0.701 1.00 0.00 H new ATOM 0 HH TYR A 23 10.034 1.854 -1.096 1.00 0.00 H new ATOM 353 N VAL A 24 7.475 -0.450 6.513 1.00 0.00 N ATOM 354 CA VAL A 24 8.498 -0.489 7.535 1.00 0.00 C ATOM 355 C VAL A 24 9.277 -1.789 7.438 1.00 0.00 C ATOM 356 O VAL A 24 8.708 -2.881 7.547 1.00 0.00 O ATOM 357 CB VAL A 24 7.884 -0.362 8.945 1.00 0.00 C ATOM 358 CG1 VAL A 24 8.961 -0.401 10.016 1.00 0.00 C ATOM 359 CG2 VAL A 24 7.065 0.913 9.059 1.00 0.00 C ATOM 0 H VAL A 24 6.564 -0.784 6.829 1.00 0.00 H new ATOM 0 HA VAL A 24 9.168 0.356 7.373 1.00 0.00 H new ATOM 0 HB VAL A 24 7.222 -1.214 9.101 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.500 -0.310 10.999 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.501 -1.346 9.955 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.656 0.424 9.863 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.640 0.984 10.060 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.706 1.775 8.874 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.260 0.895 8.324 1.00 0.00 H new ATOM 369 N TYR A 25 10.569 -1.672 7.222 1.00 0.00 N ATOM 370 CA TYR A 25 11.421 -2.835 7.093 1.00 0.00 C ATOM 371 C TYR A 25 12.380 -2.922 8.269 1.00 0.00 C ATOM 372 O TYR A 25 12.678 -1.919 8.924 1.00 0.00 O ATOM 373 CB TYR A 25 12.192 -2.796 5.766 1.00 0.00 C ATOM 374 CG TYR A 25 13.083 -1.584 5.592 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.564 -0.373 5.156 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.444 -1.654 5.864 1.00 0.00 C ATOM 377 CE1 TYR A 25 13.373 0.734 4.993 1.00 0.00 C ATOM 378 CE2 TYR A 25 15.260 -0.551 5.703 1.00 0.00 C ATOM 379 CZ TYR A 25 14.718 0.640 5.269 1.00 0.00 C ATOM 380 OH TYR A 25 15.524 1.743 5.110 1.00 0.00 O ATOM 0 H TYR A 25 11.055 -0.780 7.132 1.00 0.00 H new ATOM 0 HA TYR A 25 10.793 -3.726 7.095 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.804 -3.695 5.689 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.477 -2.826 4.944 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.509 -0.295 4.940 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.870 -2.585 6.207 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.953 1.668 4.651 1.00 0.00 H new ATOM 0 HE2 TYR A 25 16.316 -0.621 5.916 1.00 0.00 H new ATOM 0 HH TYR A 25 16.267 1.700 5.748 1.00 0.00 H new ATOM 390 N LYS A 26 12.843 -4.124 8.543 1.00 0.00 N ATOM 391 CA LYS A 26 13.799 -4.349 9.610 1.00 0.00 C ATOM 392 C LYS A 26 15.034 -5.021 9.031 1.00 0.00 C ATOM 393 O LYS A 26 15.060 -6.235 8.828 1.00 0.00 O ATOM 394 CB LYS A 26 13.175 -5.209 10.715 1.00 0.00 C ATOM 395 CG LYS A 26 13.964 -5.215 12.018 1.00 0.00 C ATOM 396 CD LYS A 26 13.271 -6.048 13.089 1.00 0.00 C ATOM 397 CE LYS A 26 11.844 -5.572 13.341 1.00 0.00 C ATOM 398 NZ LYS A 26 11.164 -6.370 14.396 1.00 0.00 N ATOM 0 H LYS A 26 12.571 -4.967 8.038 1.00 0.00 H new ATOM 0 HA LYS A 26 14.085 -3.396 10.055 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.166 -4.848 10.915 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.082 -6.233 10.354 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.963 -5.612 11.837 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.087 -4.192 12.374 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.257 -7.094 12.783 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.841 -5.995 14.016 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.859 -4.522 13.635 1.00 0.00 H new ATOM 0 HE3 LYS A 26 11.273 -5.635 12.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.198 -6.011 14.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.125 -7.368 14.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.693 -6.289 15.288 1.00 0.00 H new ATOM 412 N GLY A 27 16.038 -4.215 8.721 1.00 0.00 N ATOM 413 CA GLY A 27 17.216 -4.731 8.062 1.00 0.00 C ATOM 414 C GLY A 27 16.983 -4.888 6.575 1.00 0.00 C ATOM 415 O GLY A 27 16.741 -3.907 5.873 1.00 0.00 O ATOM 0 H GLY A 27 16.057 -3.214 8.914 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.056 -4.058 8.233 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.486 -5.694 8.495 1.00 0.00 H new ATOM 419 N ASP A 28 17.033 -6.122 6.098 1.00 0.00 N ATOM 420 CA ASP A 28 16.795 -6.405 4.686 1.00 0.00 C ATOM 421 C ASP A 28 15.365 -6.871 4.457 1.00 0.00 C ATOM 422 O ASP A 28 14.892 -6.924 3.320 1.00 0.00 O ATOM 423 CB ASP A 28 17.766 -7.474 4.177 1.00 0.00 C ATOM 424 CG ASP A 28 19.184 -6.963 4.049 1.00 0.00 C ATOM 425 OD1 ASP A 28 19.955 -7.062 5.029 1.00 0.00 O ATOM 426 OD2 ASP A 28 19.541 -6.468 2.960 1.00 0.00 O ATOM 0 H ASP A 28 17.236 -6.945 6.665 1.00 0.00 H new ATOM 0 HA ASP A 28 16.958 -5.480 4.133 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.751 -8.326 4.857 1.00 0.00 H new ATOM 0 HB3 ASP A 28 17.426 -7.835 3.207 1.00 0.00 H new ATOM 431 N LYS A 29 14.678 -7.198 5.544 1.00 0.00 N ATOM 432 CA LYS A 29 13.342 -7.771 5.459 1.00 0.00 C ATOM 433 C LYS A 29 12.274 -6.704 5.653 1.00 0.00 C ATOM 434 O LYS A 29 12.255 -6.013 6.672 1.00 0.00 O ATOM 435 CB LYS A 29 13.165 -8.861 6.520 1.00 0.00 C ATOM 436 CG LYS A 29 11.911 -9.702 6.330 1.00 0.00 C ATOM 437 CD LYS A 29 11.835 -10.829 7.346 1.00 0.00 C ATOM 438 CE LYS A 29 13.012 -11.781 7.210 1.00 0.00 C ATOM 439 NZ LYS A 29 12.929 -12.908 8.171 1.00 0.00 N ATOM 0 H LYS A 29 15.025 -7.076 6.495 1.00 0.00 H new ATOM 0 HA LYS A 29 13.229 -8.204 4.465 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.036 -9.516 6.505 1.00 0.00 H new ATOM 0 HB3 LYS A 29 13.134 -8.395 7.505 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.029 -9.068 6.422 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.900 -10.118 5.323 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.817 -10.412 8.353 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.903 -11.379 7.212 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.046 -12.173 6.194 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.941 -11.234 7.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 13.751 -13.533 8.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 12.923 -12.536 9.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 12.055 -13.446 8.001 1.00 0.00 H new ATOM 453 N VAL A 30 11.392 -6.569 4.675 1.00 0.00 N ATOM 454 CA VAL A 30 10.243 -5.689 4.812 1.00 0.00 C ATOM 455 C VAL A 30 9.167 -6.409 5.610 1.00 0.00 C ATOM 456 O VAL A 30 8.784 -7.526 5.266 1.00 0.00 O ATOM 457 CB VAL A 30 9.674 -5.264 3.442 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.528 -4.282 3.625 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.765 -4.663 2.567 1.00 0.00 C ATOM 0 H VAL A 30 11.450 -7.056 3.781 1.00 0.00 H new ATOM 0 HA VAL A 30 10.565 -4.784 5.327 1.00 0.00 H new ATOM 0 HB VAL A 30 9.289 -6.152 2.939 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.138 -3.992 2.649 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.736 -4.752 4.208 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.888 -3.397 4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.341 -4.371 1.606 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.185 -3.786 3.060 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.551 -5.401 2.407 1.00 0.00 H new ATOM 469 N LEU A 31 8.691 -5.789 6.677 1.00 0.00 N ATOM 470 CA LEU A 31 7.783 -6.471 7.583 1.00 0.00 C ATOM 471 C LEU A 31 6.369 -5.916 7.516 1.00 0.00 C ATOM 472 O LEU A 31 5.453 -6.631 7.135 1.00 0.00 O ATOM 473 CB LEU A 31 8.342 -6.445 9.004 1.00 0.00 C ATOM 474 CG LEU A 31 9.585 -7.319 9.187 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.176 -7.155 10.573 1.00 0.00 C ATOM 476 CD2 LEU A 31 9.240 -8.778 8.931 1.00 0.00 C ATOM 0 H LEU A 31 8.914 -4.828 6.935 1.00 0.00 H new ATOM 0 HA LEU A 31 7.708 -7.510 7.262 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.588 -5.417 9.270 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.569 -6.777 9.696 1.00 0.00 H new ATOM 0 HG LEU A 31 10.334 -6.996 8.464 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.057 -7.789 10.670 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.459 -6.114 10.727 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.437 -7.444 11.320 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.131 -9.391 9.064 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.471 -9.099 9.634 1.00 0.00 H new ATOM 0 HD23 LEU A 31 8.870 -8.891 7.912 1.00 0.00 H new ATOM 488 N LYS A 32 6.164 -4.654 7.846 1.00 0.00 N ATOM 489 CA LYS A 32 4.809 -4.120 7.814 1.00 0.00 C ATOM 490 C LYS A 32 4.668 -3.085 6.713 1.00 0.00 C ATOM 491 O LYS A 32 5.299 -2.032 6.759 1.00 0.00 O ATOM 492 CB LYS A 32 4.405 -3.498 9.149 1.00 0.00 C ATOM 493 CG LYS A 32 2.897 -3.350 9.292 1.00 0.00 C ATOM 494 CD LYS A 32 2.505 -2.177 10.177 1.00 0.00 C ATOM 495 CE LYS A 32 2.802 -0.845 9.502 1.00 0.00 C ATOM 496 NZ LYS A 32 2.060 0.278 10.137 1.00 0.00 N ATOM 0 H LYS A 32 6.889 -3.996 8.131 1.00 0.00 H new ATOM 0 HA LYS A 32 4.143 -4.960 7.616 1.00 0.00 H new ATOM 0 HB2 LYS A 32 4.785 -4.115 9.963 1.00 0.00 H new ATOM 0 HB3 LYS A 32 4.874 -2.519 9.246 1.00 0.00 H new ATOM 0 HG2 LYS A 32 2.453 -3.220 8.305 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.484 -4.269 9.708 1.00 0.00 H new ATOM 0 HD2 LYS A 32 1.443 -2.237 10.413 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.046 -2.236 11.122 1.00 0.00 H new ATOM 0 HE2 LYS A 32 3.872 -0.645 9.549 1.00 0.00 H new ATOM 0 HE3 LYS A 32 2.535 -0.905 8.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.290 1.167 9.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.037 0.100 10.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.333 0.353 11.138 1.00 0.00 H new ATOM 510 N GLN A 33 3.824 -3.375 5.744 1.00 0.00 N ATOM 511 CA GLN A 33 3.628 -2.491 4.611 1.00 0.00 C ATOM 512 C GLN A 33 2.222 -1.905 4.623 1.00 0.00 C ATOM 513 O GLN A 33 1.268 -2.560 4.206 1.00 0.00 O ATOM 514 CB GLN A 33 3.861 -3.260 3.308 1.00 0.00 C ATOM 515 CG GLN A 33 3.757 -2.399 2.065 1.00 0.00 C ATOM 516 CD GLN A 33 3.924 -3.193 0.786 1.00 0.00 C ATOM 517 OE1 GLN A 33 5.035 -3.391 0.308 1.00 0.00 O ATOM 518 NE2 GLN A 33 2.816 -3.633 0.214 1.00 0.00 N ATOM 0 H GLN A 33 3.258 -4.223 5.718 1.00 0.00 H new ATOM 0 HA GLN A 33 4.344 -1.672 4.681 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.849 -3.719 3.339 1.00 0.00 H new ATOM 0 HB3 GLN A 33 3.135 -4.070 3.240 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.788 -1.900 2.054 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.517 -1.618 2.105 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.911 -3.446 0.645 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.867 -4.159 -0.658 1.00 0.00 H new ATOM 527 N SER A 34 2.081 -0.684 5.110 1.00 0.00 N ATOM 528 CA SER A 34 0.785 -0.033 5.104 1.00 0.00 C ATOM 529 C SER A 34 0.552 0.661 3.766 1.00 0.00 C ATOM 530 O SER A 34 1.119 1.715 3.479 1.00 0.00 O ATOM 531 CB SER A 34 0.648 0.938 6.281 1.00 0.00 C ATOM 532 OG SER A 34 1.802 1.741 6.435 1.00 0.00 O ATOM 0 H SER A 34 2.839 -0.130 5.510 1.00 0.00 H new ATOM 0 HA SER A 34 0.013 -0.792 5.228 1.00 0.00 H new ATOM 0 HB2 SER A 34 -0.222 1.577 6.126 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.471 0.376 7.198 1.00 0.00 H new ATOM 0 HG SER A 34 1.679 2.349 7.194 1.00 0.00 H new ATOM 538 N SER A 35 -0.269 0.035 2.942 1.00 0.00 N ATOM 539 CA SER A 35 -0.572 0.537 1.620 1.00 0.00 C ATOM 540 C SER A 35 -1.892 1.294 1.652 1.00 0.00 C ATOM 541 O SER A 35 -2.965 0.697 1.607 1.00 0.00 O ATOM 542 CB SER A 35 -0.644 -0.634 0.640 1.00 0.00 C ATOM 543 OG SER A 35 0.479 -1.483 0.805 1.00 0.00 O ATOM 0 H SER A 35 -0.744 -0.837 3.174 1.00 0.00 H new ATOM 0 HA SER A 35 0.211 1.221 1.293 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.562 -1.198 0.804 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.678 -0.259 -0.383 1.00 0.00 H new ATOM 0 HG SER A 35 0.649 -1.967 -0.030 1.00 0.00 H new ATOM 549 N GLU A 36 -1.807 2.606 1.769 1.00 0.00 N ATOM 550 CA GLU A 36 -2.987 3.437 1.895 1.00 0.00 C ATOM 551 C GLU A 36 -3.354 4.059 0.552 1.00 0.00 C ATOM 552 O GLU A 36 -2.645 4.931 0.039 1.00 0.00 O ATOM 553 CB GLU A 36 -2.737 4.515 2.946 1.00 0.00 C ATOM 554 CG GLU A 36 -2.478 3.951 4.334 1.00 0.00 C ATOM 555 CD GLU A 36 -1.911 4.976 5.298 1.00 0.00 C ATOM 556 OE1 GLU A 36 -0.678 5.184 5.296 1.00 0.00 O ATOM 557 OE2 GLU A 36 -2.689 5.559 6.078 1.00 0.00 O ATOM 0 H GLU A 36 -0.926 3.121 1.779 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.828 2.821 2.213 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.882 5.119 2.641 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.599 5.180 2.987 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -3.410 3.557 4.739 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.785 3.113 4.255 1.00 0.00 H new ATOM 564 N THR A 37 -4.447 3.585 -0.021 1.00 0.00 N ATOM 565 CA THR A 37 -4.919 4.079 -1.304 1.00 0.00 C ATOM 566 C THR A 37 -6.049 5.086 -1.101 1.00 0.00 C ATOM 567 O THR A 37 -7.127 4.736 -0.625 1.00 0.00 O ATOM 568 CB THR A 37 -5.409 2.917 -2.190 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.401 1.901 -2.263 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.741 3.400 -3.594 1.00 0.00 C ATOM 0 H THR A 37 -5.029 2.853 0.386 1.00 0.00 H new ATOM 0 HA THR A 37 -4.086 4.573 -1.805 1.00 0.00 H new ATOM 0 HB THR A 37 -6.314 2.509 -1.740 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.719 1.165 -2.826 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.084 2.559 -4.197 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.526 4.154 -3.543 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.851 3.834 -4.050 1.00 0.00 H new ATOM 578 N LYS A 38 -5.798 6.333 -1.456 1.00 0.00 N ATOM 579 CA LYS A 38 -6.773 7.395 -1.261 1.00 0.00 C ATOM 580 C LYS A 38 -7.468 7.729 -2.575 1.00 0.00 C ATOM 581 O LYS A 38 -6.838 8.190 -3.524 1.00 0.00 O ATOM 582 CB LYS A 38 -6.079 8.624 -0.663 1.00 0.00 C ATOM 583 CG LYS A 38 -6.978 9.835 -0.470 1.00 0.00 C ATOM 584 CD LYS A 38 -6.352 10.824 0.504 1.00 0.00 C ATOM 585 CE LYS A 38 -7.052 12.173 0.488 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.617 13.016 -0.655 1.00 0.00 N ATOM 0 H LYS A 38 -4.923 6.638 -1.883 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.540 7.060 -0.563 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.652 8.349 0.301 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.249 8.905 -1.311 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.150 10.322 -1.430 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.951 9.515 -0.096 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.389 10.410 1.512 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.300 10.960 0.254 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.130 12.021 0.436 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -6.849 12.697 1.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.255 13.832 -0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.647 13.352 -0.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.644 12.455 -1.530 1.00 0.00 H new ATOM 600 N ILE A 39 -8.766 7.464 -2.632 1.00 0.00 N ATOM 601 CA ILE A 39 -9.540 7.701 -3.841 1.00 0.00 C ATOM 602 C ILE A 39 -10.584 8.782 -3.599 1.00 0.00 C ATOM 603 O ILE A 39 -11.332 8.723 -2.625 1.00 0.00 O ATOM 604 CB ILE A 39 -10.268 6.421 -4.330 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.334 5.206 -4.338 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.845 6.639 -5.721 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.323 4.430 -3.036 1.00 0.00 C ATOM 0 H ILE A 39 -9.305 7.084 -1.854 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.832 8.016 -4.608 1.00 0.00 H new ATOM 0 HB ILE A 39 -11.078 6.218 -3.630 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -9.631 4.537 -5.146 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.320 5.541 -4.558 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.353 5.732 -6.051 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.557 7.464 -5.694 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.040 6.877 -6.416 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.639 3.586 -3.121 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -8.996 5.082 -2.226 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.327 4.063 -2.823 1.00 0.00 H new ATOM 619 N GLN A 40 -10.632 9.776 -4.471 1.00 0.00 N ATOM 620 CA GLN A 40 -11.678 10.784 -4.397 1.00 0.00 C ATOM 621 C GLN A 40 -12.942 10.252 -5.062 1.00 0.00 C ATOM 622 O GLN A 40 -12.871 9.359 -5.910 1.00 0.00 O ATOM 623 CB GLN A 40 -11.250 12.096 -5.064 1.00 0.00 C ATOM 624 CG GLN A 40 -10.294 12.946 -4.235 1.00 0.00 C ATOM 625 CD GLN A 40 -8.877 12.402 -4.189 1.00 0.00 C ATOM 626 OE1 GLN A 40 -8.059 12.711 -5.054 1.00 0.00 O ATOM 627 NE2 GLN A 40 -8.566 11.615 -3.170 1.00 0.00 N ATOM 0 H GLN A 40 -9.966 9.907 -5.232 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.871 10.996 -3.345 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.776 11.866 -6.018 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -12.141 12.684 -5.284 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -10.273 13.956 -4.644 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -10.678 13.022 -3.218 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -9.272 11.381 -2.472 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -7.620 11.243 -3.083 1.00 0.00 H new ATOM 636 N PHE A 41 -14.093 10.794 -4.684 1.00 0.00 N ATOM 637 CA PHE A 41 -15.370 10.333 -5.230 1.00 0.00 C ATOM 638 C PHE A 41 -15.434 10.528 -6.743 1.00 0.00 C ATOM 639 O PHE A 41 -16.071 9.746 -7.449 1.00 0.00 O ATOM 640 CB PHE A 41 -16.544 11.045 -4.554 1.00 0.00 C ATOM 641 CG PHE A 41 -16.869 10.518 -3.181 1.00 0.00 C ATOM 642 CD1 PHE A 41 -16.144 9.471 -2.629 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.908 11.066 -2.446 1.00 0.00 C ATOM 644 CE1 PHE A 41 -16.449 8.985 -1.373 1.00 0.00 C ATOM 645 CE2 PHE A 41 -18.218 10.582 -1.189 1.00 0.00 C ATOM 646 CZ PHE A 41 -17.487 9.540 -0.652 1.00 0.00 C ATOM 0 H PHE A 41 -14.172 11.551 -4.004 1.00 0.00 H new ATOM 0 HA PHE A 41 -15.445 9.265 -5.023 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -16.317 12.109 -4.480 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -17.426 10.951 -5.187 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -15.332 9.031 -3.189 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.483 11.881 -2.860 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.876 8.171 -0.955 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -19.031 11.018 -0.627 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.727 9.160 0.330 1.00 0.00 H new ATOM 656 N ALA A 42 -14.750 11.552 -7.237 1.00 0.00 N ATOM 657 CA ALA A 42 -14.720 11.838 -8.666 1.00 0.00 C ATOM 658 C ALA A 42 -13.940 10.769 -9.428 1.00 0.00 C ATOM 659 O ALA A 42 -14.199 10.518 -10.605 1.00 0.00 O ATOM 660 CB ALA A 42 -14.112 13.208 -8.914 1.00 0.00 C ATOM 0 H ALA A 42 -14.207 12.200 -6.667 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.746 11.832 -9.033 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -14.095 13.410 -9.985 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.710 13.968 -8.411 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -13.094 13.230 -8.524 1.00 0.00 H new ATOM 666 N SER A 43 -12.991 10.139 -8.746 1.00 0.00 N ATOM 667 CA SER A 43 -12.144 9.130 -9.365 1.00 0.00 C ATOM 668 C SER A 43 -12.851 7.776 -9.404 1.00 0.00 C ATOM 669 O SER A 43 -12.739 7.032 -10.379 1.00 0.00 O ATOM 670 CB SER A 43 -10.833 9.014 -8.589 1.00 0.00 C ATOM 671 OG SER A 43 -10.278 10.295 -8.338 1.00 0.00 O ATOM 0 H SER A 43 -12.789 10.311 -7.761 1.00 0.00 H new ATOM 0 HA SER A 43 -11.933 9.434 -10.390 1.00 0.00 H new ATOM 0 HB2 SER A 43 -11.009 8.498 -7.645 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.123 8.410 -9.155 1.00 0.00 H new ATOM 0 HG SER A 43 -9.440 10.197 -7.839 1.00 0.00 H new ATOM 677 N ILE A 44 -13.575 7.458 -8.338 1.00 0.00 N ATOM 678 CA ILE A 44 -14.283 6.187 -8.254 1.00 0.00 C ATOM 679 C ILE A 44 -15.608 6.246 -9.019 1.00 0.00 C ATOM 680 O ILE A 44 -16.038 5.256 -9.612 1.00 0.00 O ATOM 681 CB ILE A 44 -14.526 5.764 -6.782 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.317 4.452 -6.716 1.00 0.00 C ATOM 683 CG2 ILE A 44 -15.240 6.864 -6.008 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.557 3.951 -5.307 1.00 0.00 C ATOM 0 H ILE A 44 -13.687 8.060 -7.522 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.648 5.432 -8.718 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.555 5.600 -6.315 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.278 4.593 -7.210 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.780 3.687 -7.277 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.398 6.541 -4.979 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.631 7.768 -6.015 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -16.203 7.071 -6.475 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -16.122 3.020 -5.343 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.600 3.776 -4.815 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -16.122 4.696 -4.747 1.00 0.00 H new ATOM 696 N GLY A 45 -16.232 7.418 -9.030 1.00 0.00 N ATOM 697 CA GLY A 45 -17.497 7.579 -9.720 1.00 0.00 C ATOM 698 C GLY A 45 -18.682 7.337 -8.806 1.00 0.00 C ATOM 699 O GLY A 45 -19.809 7.153 -9.268 1.00 0.00 O ATOM 0 H GLY A 45 -15.884 8.260 -8.573 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.558 8.586 -10.133 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.541 6.887 -10.561 1.00 0.00 H new ATOM 703 N ALA A 46 -18.424 7.346 -7.506 1.00 0.00 N ATOM 704 CA ALA A 46 -19.462 7.097 -6.517 1.00 0.00 C ATOM 705 C ALA A 46 -20.176 8.390 -6.152 1.00 0.00 C ATOM 706 O ALA A 46 -19.536 9.402 -5.873 1.00 0.00 O ATOM 707 CB ALA A 46 -18.868 6.449 -5.275 1.00 0.00 C ATOM 0 H ALA A 46 -17.501 7.524 -7.111 1.00 0.00 H new ATOM 0 HA ALA A 46 -20.192 6.413 -6.950 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.658 6.269 -4.545 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.402 5.502 -5.546 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -18.118 7.111 -4.842 1.00 0.00 H new ATOM 713 N THR A 47 -21.499 8.355 -6.160 1.00 0.00 N ATOM 714 CA THR A 47 -22.290 9.532 -5.839 1.00 0.00 C ATOM 715 C THR A 47 -22.549 9.612 -4.330 1.00 0.00 C ATOM 716 O THR A 47 -22.958 10.649 -3.806 1.00 0.00 O ATOM 717 CB THR A 47 -23.627 9.528 -6.623 1.00 0.00 C ATOM 718 OG1 THR A 47 -24.314 10.775 -6.457 1.00 0.00 O ATOM 719 CG2 THR A 47 -24.527 8.387 -6.172 1.00 0.00 C ATOM 0 H THR A 47 -22.047 7.525 -6.385 1.00 0.00 H new ATOM 0 HA THR A 47 -21.724 10.414 -6.138 1.00 0.00 H new ATOM 0 HB THR A 47 -23.388 9.387 -7.677 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.029 11.197 -5.620 1.00 0.00 H new ATOM 0 HG21 THR A 47 -25.457 8.411 -6.740 1.00 0.00 H new ATOM 0 HG22 THR A 47 -24.022 7.436 -6.342 1.00 0.00 H new ATOM 0 HG23 THR A 47 -24.748 8.496 -5.110 1.00 0.00 H new ATOM 727 N THR A 48 -22.297 8.508 -3.638 1.00 0.00 N ATOM 728 CA THR A 48 -22.452 8.444 -2.193 1.00 0.00 C ATOM 729 C THR A 48 -21.325 7.618 -1.590 1.00 0.00 C ATOM 730 O THR A 48 -20.670 6.851 -2.298 1.00 0.00 O ATOM 731 CB THR A 48 -23.798 7.802 -1.793 1.00 0.00 C ATOM 732 OG1 THR A 48 -23.956 6.548 -2.472 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.971 8.716 -2.113 1.00 0.00 C ATOM 0 H THR A 48 -21.981 7.636 -4.062 1.00 0.00 H new ATOM 0 HA THR A 48 -22.424 9.466 -1.815 1.00 0.00 H new ATOM 0 HB THR A 48 -23.787 7.639 -0.715 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.810 6.142 -2.215 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.901 8.231 -1.818 1.00 0.00 H new ATOM 0 HG22 THR A 48 -24.861 9.653 -1.567 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.992 8.920 -3.184 1.00 0.00 H new ATOM 741 N LYS A 49 -21.102 7.762 -0.290 1.00 0.00 N ATOM 742 CA LYS A 49 -20.125 6.930 0.398 1.00 0.00 C ATOM 743 C LYS A 49 -20.724 5.547 0.631 1.00 0.00 C ATOM 744 O LYS A 49 -20.011 4.566 0.844 1.00 0.00 O ATOM 745 CB LYS A 49 -19.686 7.576 1.719 1.00 0.00 C ATOM 746 CG LYS A 49 -20.801 7.731 2.741 1.00 0.00 C ATOM 747 CD LYS A 49 -20.352 8.563 3.931 1.00 0.00 C ATOM 748 CE LYS A 49 -21.421 8.625 5.010 1.00 0.00 C ATOM 749 NZ LYS A 49 -22.738 9.066 4.477 1.00 0.00 N ATOM 0 H LYS A 49 -21.579 8.440 0.304 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.234 6.832 -0.222 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -18.889 6.975 2.157 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -19.264 8.559 1.507 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.664 8.202 2.271 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -21.122 6.747 3.083 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -19.439 8.138 4.348 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -20.111 9.573 3.599 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -21.528 7.642 5.469 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -21.102 9.310 5.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -23.392 9.240 5.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -22.615 9.942 3.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -23.129 8.325 3.861 1.00 0.00 H new ATOM 763 N GLU A 50 -22.048 5.491 0.568 1.00 0.00 N ATOM 764 CA GLU A 50 -22.788 4.243 0.641 1.00 0.00 C ATOM 765 C GLU A 50 -22.490 3.382 -0.584 1.00 0.00 C ATOM 766 O GLU A 50 -22.185 2.193 -0.462 1.00 0.00 O ATOM 767 CB GLU A 50 -24.296 4.523 0.731 1.00 0.00 C ATOM 768 CG GLU A 50 -24.748 5.201 2.025 1.00 0.00 C ATOM 769 CD GLU A 50 -24.154 6.586 2.236 1.00 0.00 C ATOM 770 OE1 GLU A 50 -23.931 7.308 1.239 1.00 0.00 O ATOM 771 OE2 GLU A 50 -23.887 6.949 3.403 1.00 0.00 O ATOM 0 H GLU A 50 -22.639 6.315 0.464 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.476 3.705 1.536 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.585 5.151 -0.112 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.833 3.580 0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -25.835 5.279 2.022 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -24.477 4.568 2.869 1.00 0.00 H new ATOM 778 N ASP A 51 -22.574 3.988 -1.768 1.00 0.00 N ATOM 779 CA ASP A 51 -22.229 3.293 -3.006 1.00 0.00 C ATOM 780 C ASP A 51 -20.723 3.108 -3.113 1.00 0.00 C ATOM 781 O ASP A 51 -20.248 2.196 -3.790 1.00 0.00 O ATOM 782 CB ASP A 51 -22.756 4.039 -4.235 1.00 0.00 C ATOM 783 CG ASP A 51 -24.012 3.405 -4.803 1.00 0.00 C ATOM 784 OD1 ASP A 51 -25.100 3.607 -4.224 1.00 0.00 O ATOM 785 OD2 ASP A 51 -23.919 2.692 -5.823 1.00 0.00 O ATOM 0 H ASP A 51 -22.876 4.954 -1.895 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.706 2.313 -2.976 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -22.965 5.074 -3.966 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.983 4.059 -5.003 1.00 0.00 H new ATOM 790 N ALA A 52 -19.972 3.978 -2.445 1.00 0.00 N ATOM 791 CA ALA A 52 -18.526 3.832 -2.373 1.00 0.00 C ATOM 792 C ALA A 52 -18.172 2.531 -1.667 1.00 0.00 C ATOM 793 O ALA A 52 -17.361 1.752 -2.161 1.00 0.00 O ATOM 794 CB ALA A 52 -17.896 5.020 -1.661 1.00 0.00 C ATOM 0 H ALA A 52 -20.341 4.789 -1.948 1.00 0.00 H new ATOM 0 HA ALA A 52 -18.127 3.802 -3.387 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.815 4.888 -1.620 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -18.129 5.935 -2.205 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -18.292 5.089 -0.648 1.00 0.00 H new ATOM 800 N ALA A 53 -18.800 2.293 -0.518 1.00 0.00 N ATOM 801 CA ALA A 53 -18.631 1.038 0.204 1.00 0.00 C ATOM 802 C ALA A 53 -19.074 -0.129 -0.666 1.00 0.00 C ATOM 803 O ALA A 53 -18.362 -1.116 -0.815 1.00 0.00 O ATOM 804 CB ALA A 53 -19.426 1.060 1.499 1.00 0.00 C ATOM 0 H ALA A 53 -19.431 2.955 -0.068 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.576 0.915 0.448 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.289 0.116 2.026 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.077 1.880 2.127 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.483 1.200 1.274 1.00 0.00 H new ATOM 810 N LYS A 54 -20.249 0.024 -1.259 1.00 0.00 N ATOM 811 CA LYS A 54 -20.813 -0.962 -2.177 1.00 0.00 C ATOM 812 C LYS A 54 -19.818 -1.349 -3.279 1.00 0.00 C ATOM 813 O LYS A 54 -19.826 -2.478 -3.773 1.00 0.00 O ATOM 814 CB LYS A 54 -22.094 -0.371 -2.774 1.00 0.00 C ATOM 815 CG LYS A 54 -22.595 -1.033 -4.044 1.00 0.00 C ATOM 816 CD LYS A 54 -23.775 -0.256 -4.598 1.00 0.00 C ATOM 817 CE LYS A 54 -24.041 -0.573 -6.057 1.00 0.00 C ATOM 818 NZ LYS A 54 -25.023 0.379 -6.639 1.00 0.00 N ATOM 0 H LYS A 54 -20.844 0.840 -1.118 1.00 0.00 H new ATOM 0 HA LYS A 54 -21.038 -1.879 -1.633 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.882 -0.426 -2.023 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -21.923 0.686 -2.980 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -21.795 -1.074 -4.784 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -22.890 -2.062 -3.837 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.665 -0.484 -4.011 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -23.587 0.812 -4.489 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -23.108 -0.527 -6.619 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -24.418 -1.591 -6.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -24.929 0.385 -7.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -25.987 0.085 -6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -24.841 1.334 -6.270 1.00 0.00 H new ATOM 832 N THR A 55 -18.957 -0.415 -3.648 1.00 0.00 N ATOM 833 CA THR A 55 -17.974 -0.657 -4.689 1.00 0.00 C ATOM 834 C THR A 55 -16.647 -1.166 -4.110 1.00 0.00 C ATOM 835 O THR A 55 -16.042 -2.092 -4.654 1.00 0.00 O ATOM 836 CB THR A 55 -17.725 0.625 -5.509 1.00 0.00 C ATOM 837 OG1 THR A 55 -18.976 1.147 -5.978 1.00 0.00 O ATOM 838 CG2 THR A 55 -16.815 0.351 -6.697 1.00 0.00 C ATOM 0 H THR A 55 -18.920 0.519 -3.241 1.00 0.00 H new ATOM 0 HA THR A 55 -18.379 -1.430 -5.342 1.00 0.00 H new ATOM 0 HB THR A 55 -17.236 1.353 -4.862 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.464 1.548 -5.229 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.658 1.274 -7.256 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.856 -0.025 -6.341 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.278 -0.392 -7.346 1.00 0.00 H new ATOM 846 N LEU A 56 -16.216 -0.583 -2.994 1.00 0.00 N ATOM 847 CA LEU A 56 -14.888 -0.860 -2.445 1.00 0.00 C ATOM 848 C LEU A 56 -14.852 -2.107 -1.564 1.00 0.00 C ATOM 849 O LEU A 56 -13.890 -2.870 -1.628 1.00 0.00 O ATOM 850 CB LEU A 56 -14.379 0.346 -1.652 1.00 0.00 C ATOM 851 CG LEU A 56 -14.130 1.610 -2.477 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.664 2.747 -1.584 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.106 1.341 -3.570 1.00 0.00 C ATOM 0 H LEU A 56 -16.765 0.084 -2.452 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.235 -1.050 -3.297 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -15.102 0.578 -0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.450 0.068 -1.154 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.069 1.903 -2.947 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.492 3.637 -2.189 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.428 2.958 -0.836 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.737 2.462 -1.086 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.942 2.251 -4.147 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.166 1.023 -3.118 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.475 0.556 -4.229 1.00 0.00 H new ATOM 865 N GLU A 57 -15.894 -2.320 -0.757 1.00 0.00 N ATOM 866 CA GLU A 57 -15.912 -3.430 0.208 1.00 0.00 C ATOM 867 C GLU A 57 -15.528 -4.774 -0.426 1.00 0.00 C ATOM 868 O GLU A 57 -14.628 -5.445 0.073 1.00 0.00 O ATOM 869 CB GLU A 57 -17.274 -3.554 0.900 1.00 0.00 C ATOM 870 CG GLU A 57 -17.582 -2.407 1.842 1.00 0.00 C ATOM 871 CD GLU A 57 -18.840 -2.638 2.649 1.00 0.00 C ATOM 872 OE1 GLU A 57 -19.943 -2.629 2.059 1.00 0.00 O ATOM 873 OE2 GLU A 57 -18.737 -2.832 3.881 1.00 0.00 O ATOM 0 H GLU A 57 -16.735 -1.743 -0.750 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.156 -3.186 0.954 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.054 -3.609 0.141 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.305 -4.490 1.458 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.741 -2.263 2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -17.688 -1.488 1.266 1.00 0.00 H new ATOM 880 N PRO A 58 -16.186 -5.195 -1.532 1.00 0.00 N ATOM 881 CA PRO A 58 -15.873 -6.473 -2.192 1.00 0.00 C ATOM 882 C PRO A 58 -14.432 -6.544 -2.713 1.00 0.00 C ATOM 883 O PRO A 58 -13.928 -7.626 -3.019 1.00 0.00 O ATOM 884 CB PRO A 58 -16.869 -6.546 -3.355 1.00 0.00 C ATOM 885 CG PRO A 58 -17.359 -5.154 -3.549 1.00 0.00 C ATOM 886 CD PRO A 58 -17.291 -4.490 -2.204 1.00 0.00 C ATOM 0 HA PRO A 58 -15.956 -7.305 -1.493 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -16.390 -6.923 -4.259 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -17.692 -7.223 -3.125 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -16.744 -4.623 -4.276 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.379 -5.151 -3.932 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.092 -3.422 -2.293 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.227 -4.595 -1.656 1.00 0.00 H new ATOM 894 N LEU A 59 -13.776 -5.393 -2.813 1.00 0.00 N ATOM 895 CA LEU A 59 -12.381 -5.338 -3.237 1.00 0.00 C ATOM 896 C LEU A 59 -11.455 -5.443 -2.030 1.00 0.00 C ATOM 897 O LEU A 59 -10.495 -6.210 -2.039 1.00 0.00 O ATOM 898 CB LEU A 59 -12.090 -4.048 -4.013 1.00 0.00 C ATOM 899 CG LEU A 59 -12.396 -4.090 -5.516 1.00 0.00 C ATOM 900 CD1 LEU A 59 -13.865 -4.391 -5.773 1.00 0.00 C ATOM 901 CD2 LEU A 59 -12.000 -2.775 -6.166 1.00 0.00 C ATOM 0 H LEU A 59 -14.189 -4.484 -2.606 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.198 -6.184 -3.900 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.668 -3.239 -3.566 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -11.037 -3.797 -3.882 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.810 -4.895 -5.960 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -14.049 -4.414 -6.847 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -14.119 -5.359 -5.341 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -14.481 -3.616 -5.316 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -12.221 -2.815 -7.233 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -12.561 -1.960 -5.709 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.933 -2.605 -6.023 1.00 0.00 H new ATOM 913 N SER A 60 -11.754 -4.679 -0.990 1.00 0.00 N ATOM 914 CA SER A 60 -10.976 -4.732 0.240 1.00 0.00 C ATOM 915 C SER A 60 -11.116 -6.110 0.892 1.00 0.00 C ATOM 916 O SER A 60 -10.179 -6.628 1.502 1.00 0.00 O ATOM 917 CB SER A 60 -11.456 -3.644 1.198 1.00 0.00 C ATOM 918 OG SER A 60 -11.690 -2.429 0.508 1.00 0.00 O ATOM 0 H SER A 60 -12.529 -4.016 -0.972 1.00 0.00 H new ATOM 0 HA SER A 60 -9.925 -4.563 0.007 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.372 -3.968 1.693 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.711 -3.486 1.978 1.00 0.00 H new ATOM 0 HG SER A 60 -10.938 -2.243 -0.092 1.00 0.00 H new ATOM 924 N ALA A 61 -12.291 -6.713 0.718 1.00 0.00 N ATOM 925 CA ALA A 61 -12.592 -8.020 1.294 1.00 0.00 C ATOM 926 C ALA A 61 -11.799 -9.138 0.622 1.00 0.00 C ATOM 927 O ALA A 61 -11.876 -10.294 1.035 1.00 0.00 O ATOM 928 CB ALA A 61 -14.081 -8.310 1.197 1.00 0.00 C ATOM 0 H ALA A 61 -13.056 -6.311 0.177 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.296 -7.988 2.342 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.290 -9.288 1.630 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.637 -7.546 1.740 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.385 -8.304 0.150 1.00 0.00 H new ATOM 934 N LYS A 62 -11.047 -8.797 -0.420 1.00 0.00 N ATOM 935 CA LYS A 62 -10.164 -9.760 -1.062 1.00 0.00 C ATOM 936 C LYS A 62 -8.968 -10.037 -0.156 1.00 0.00 C ATOM 937 O LYS A 62 -8.391 -11.122 -0.185 1.00 0.00 O ATOM 938 CB LYS A 62 -9.714 -9.247 -2.434 1.00 0.00 C ATOM 939 CG LYS A 62 -10.860 -9.125 -3.433 1.00 0.00 C ATOM 940 CD LYS A 62 -10.467 -8.324 -4.666 1.00 0.00 C ATOM 941 CE LYS A 62 -9.468 -9.058 -5.549 1.00 0.00 C ATOM 942 NZ LYS A 62 -10.067 -10.247 -6.216 1.00 0.00 N ATOM 0 H LYS A 62 -11.032 -7.865 -0.835 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.704 -10.693 -1.222 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.240 -8.273 -2.313 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.959 -9.921 -2.837 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.182 -10.121 -3.737 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.712 -8.648 -2.949 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.361 -8.097 -5.247 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.039 -7.371 -4.354 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -9.086 -8.374 -6.307 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -8.617 -9.374 -4.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -9.387 -10.643 -6.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -10.301 -10.965 -5.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -10.933 -9.964 -6.718 1.00 0.00 H new ATOM 956 N TYR A 63 -8.616 -9.047 0.664 1.00 0.00 N ATOM 957 CA TYR A 63 -7.610 -9.234 1.703 1.00 0.00 C ATOM 958 C TYR A 63 -8.218 -10.013 2.856 1.00 0.00 C ATOM 959 O TYR A 63 -7.560 -10.851 3.473 1.00 0.00 O ATOM 960 CB TYR A 63 -7.091 -7.888 2.216 1.00 0.00 C ATOM 961 CG TYR A 63 -6.263 -7.122 1.211 1.00 0.00 C ATOM 962 CD1 TYR A 63 -4.907 -7.386 1.064 1.00 0.00 C ATOM 963 CD2 TYR A 63 -6.830 -6.133 0.418 1.00 0.00 C ATOM 964 CE1 TYR A 63 -4.140 -6.691 0.152 1.00 0.00 C ATOM 965 CE2 TYR A 63 -6.068 -5.432 -0.498 1.00 0.00 C ATOM 966 CZ TYR A 63 -4.724 -5.714 -0.625 1.00 0.00 C ATOM 967 OH TYR A 63 -3.960 -5.017 -1.533 1.00 0.00 O ATOM 0 H TYR A 63 -9.014 -8.109 0.627 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.772 -9.786 1.277 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.940 -7.273 2.515 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.491 -8.059 3.110 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -4.445 -8.148 1.674 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -7.882 -5.908 0.518 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -3.088 -6.911 0.048 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.523 -4.668 -1.111 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.522 -4.365 -2.001 1.00 0.00 H new ATOM 977 N LYS A 64 -9.483 -9.707 3.130 1.00 0.00 N ATOM 978 CA LYS A 64 -10.279 -10.397 4.139 1.00 0.00 C ATOM 979 C LYS A 64 -9.618 -10.324 5.514 1.00 0.00 C ATOM 980 O LYS A 64 -9.833 -9.376 6.266 1.00 0.00 O ATOM 981 CB LYS A 64 -10.509 -11.855 3.723 1.00 0.00 C ATOM 982 CG LYS A 64 -11.735 -12.491 4.353 1.00 0.00 C ATOM 983 CD LYS A 64 -11.879 -13.941 3.925 1.00 0.00 C ATOM 984 CE LYS A 64 -13.213 -14.530 4.355 1.00 0.00 C ATOM 985 NZ LYS A 64 -13.451 -14.378 5.815 1.00 0.00 N ATOM 0 H LYS A 64 -9.990 -8.963 2.651 1.00 0.00 H new ATOM 0 HA LYS A 64 -11.244 -9.896 4.212 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.605 -11.902 2.638 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -9.630 -12.441 3.991 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.660 -12.435 5.439 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -12.626 -11.933 4.065 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.784 -14.011 2.841 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -11.068 -14.528 4.355 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.018 -14.042 3.805 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.243 -15.587 4.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -14.303 -14.910 6.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.632 -14.746 6.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -13.585 -13.372 6.042 1.00 0.00 H new ATOM 999 N ASN A 65 -8.820 -11.333 5.824 1.00 0.00 N ATOM 1000 CA ASN A 65 -8.051 -11.378 7.056 1.00 0.00 C ATOM 1001 C ASN A 65 -7.109 -12.571 6.982 1.00 0.00 C ATOM 1002 O ASN A 65 -6.865 -13.260 7.969 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.972 -11.484 8.278 1.00 0.00 C ATOM 1004 CG ASN A 65 -8.265 -11.141 9.581 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -7.283 -10.252 9.513 1.00 0.00 O flip ATOM 1006 ND2 ASN A 65 -8.613 -11.658 10.642 1.00 0.00 N flip ATOM 0 H ASN A 65 -8.687 -12.148 5.225 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.479 -10.457 7.168 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -9.823 -10.816 8.145 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -9.369 -12.497 8.341 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.373 -12.338 10.653 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -8.141 -11.407 11.511 1.00 0.00 H new ATOM 1013 N ILE A 66 -6.590 -12.794 5.775 1.00 0.00 N ATOM 1014 CA ILE A 66 -5.663 -13.898 5.490 1.00 0.00 C ATOM 1015 C ILE A 66 -4.514 -13.938 6.499 1.00 0.00 C ATOM 1016 O ILE A 66 -4.070 -15.004 6.930 1.00 0.00 O ATOM 1017 CB ILE A 66 -5.062 -13.745 4.074 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -6.165 -13.437 3.062 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -4.301 -15.002 3.672 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -5.662 -13.214 1.654 1.00 0.00 C ATOM 0 H ILE A 66 -6.799 -12.214 4.962 1.00 0.00 H new ATOM 0 HA ILE A 66 -6.235 -14.823 5.560 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.358 -12.913 4.086 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -6.879 -14.261 3.056 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.706 -12.549 3.389 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.887 -14.872 2.672 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.492 -15.179 4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.980 -15.855 3.676 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -6.505 -13.001 0.996 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.971 -12.371 1.644 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -5.147 -14.109 1.306 1.00 0.00 H new ATOM 1032 N ALA A 67 -4.065 -12.759 6.872 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.944 -12.579 7.778 1.00 0.00 C ATOM 1034 C ALA A 67 -3.146 -11.275 8.523 1.00 0.00 C ATOM 1035 O ALA A 67 -4.282 -10.886 8.780 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.640 -12.547 6.993 1.00 0.00 C ATOM 0 H ALA A 67 -4.474 -11.882 6.550 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.891 -13.407 8.485 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.805 -12.412 7.680 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.517 -13.486 6.453 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.663 -11.720 6.283 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.060 -10.581 8.833 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.174 -9.253 9.403 1.00 0.00 C ATOM 1044 C GLY A 68 -2.550 -8.215 8.357 1.00 0.00 C ATOM 1045 O GLY A 68 -2.174 -7.051 8.468 1.00 0.00 O ATOM 0 H GLY A 68 -1.104 -10.912 8.701 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.925 -9.261 10.193 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.227 -8.975 9.866 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.289 -8.648 7.339 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.739 -7.764 6.276 1.00 0.00 C ATOM 1051 C VAL A 69 -5.044 -7.085 6.665 1.00 0.00 C ATOM 1052 O VAL A 69 -6.115 -7.690 6.628 1.00 0.00 O ATOM 1053 CB VAL A 69 -3.901 -8.500 4.920 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.558 -8.616 4.218 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.504 -9.878 5.111 1.00 0.00 C ATOM 0 H VAL A 69 -3.590 -9.617 7.231 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.964 -7.009 6.142 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.580 -7.913 4.301 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.688 -9.135 3.268 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.156 -7.620 4.036 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.866 -9.177 4.846 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.605 -10.368 4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -3.855 -10.473 5.753 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.486 -9.784 5.574 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.928 -5.829 7.060 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.077 -5.053 7.499 1.00 0.00 C ATOM 1067 C GLU A 70 -6.656 -4.260 6.342 1.00 0.00 C ATOM 1068 O GLU A 70 -5.913 -3.725 5.517 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.671 -4.069 8.594 1.00 0.00 C ATOM 1070 CG GLU A 70 -4.957 -4.695 9.778 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.636 -3.669 10.843 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -3.629 -2.941 10.696 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -5.400 -3.566 11.822 1.00 0.00 O ATOM 0 H GLU A 70 -4.044 -5.321 7.086 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.821 -5.752 7.882 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -5.024 -3.308 8.158 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.564 -3.559 8.954 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.580 -5.481 10.205 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.036 -5.168 9.439 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.973 -4.183 6.284 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.640 -3.323 5.325 1.00 0.00 C ATOM 1082 C GLU A 71 -9.450 -2.254 6.055 1.00 0.00 C ATOM 1083 O GLU A 71 -10.597 -2.466 6.440 1.00 0.00 O ATOM 1084 CB GLU A 71 -9.519 -4.141 4.362 1.00 0.00 C ATOM 1085 CG GLU A 71 -9.985 -5.492 4.904 1.00 0.00 C ATOM 1086 CD GLU A 71 -10.944 -5.378 6.072 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -12.171 -5.295 5.834 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -10.482 -5.375 7.232 1.00 0.00 O ATOM 0 H GLU A 71 -8.603 -4.707 6.891 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.884 -2.823 4.720 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.396 -3.548 4.102 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.963 -4.309 3.440 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -10.468 -6.049 4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -9.114 -6.070 5.214 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.837 -1.100 6.253 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.475 -0.027 6.992 1.00 0.00 C ATOM 1097 C LYS A 72 -10.043 0.998 6.021 1.00 0.00 C ATOM 1098 O LYS A 72 -9.334 1.874 5.527 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.460 0.630 7.936 1.00 0.00 C ATOM 1100 CG LYS A 72 -9.059 1.677 8.865 1.00 0.00 C ATOM 1101 CD LYS A 72 -7.985 2.494 9.584 1.00 0.00 C ATOM 1102 CE LYS A 72 -7.207 1.687 10.626 1.00 0.00 C ATOM 1103 NZ LYS A 72 -6.304 0.671 10.019 1.00 0.00 N ATOM 0 H LYS A 72 -7.900 -0.883 5.913 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.292 -0.433 7.589 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.986 -0.145 8.538 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.675 1.096 7.340 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.698 2.347 8.290 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -9.693 1.185 9.602 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.287 2.892 8.847 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.454 3.348 10.072 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.618 2.369 11.239 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -7.912 1.188 11.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -5.383 0.693 10.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -6.726 -0.274 10.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.172 0.883 9.009 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.328 0.869 5.743 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.995 1.753 4.804 1.00 0.00 C ATOM 1119 C LEU A 73 -12.487 3.006 5.511 1.00 0.00 C ATOM 1120 O LEU A 73 -13.406 2.957 6.329 1.00 0.00 O ATOM 1121 CB LEU A 73 -13.155 1.021 4.127 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.733 -0.090 3.162 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.931 -0.917 2.731 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -12.037 0.509 1.949 1.00 0.00 C ATOM 0 H LEU A 73 -11.932 0.158 6.156 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.282 2.055 4.037 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.795 0.591 4.898 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.757 1.748 3.582 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.036 -0.749 3.679 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.605 -1.700 2.046 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.394 -1.371 3.607 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.655 -0.275 2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.741 -0.289 1.269 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.719 1.188 1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.152 1.058 2.271 1.00 0.00 H new ATOM 1136 N THR A 74 -11.860 4.129 5.204 1.00 0.00 N ATOM 1137 CA THR A 74 -12.231 5.394 5.812 1.00 0.00 C ATOM 1138 C THR A 74 -13.076 6.219 4.851 1.00 0.00 C ATOM 1139 O THR A 74 -12.584 6.715 3.832 1.00 0.00 O ATOM 1140 CB THR A 74 -10.988 6.194 6.257 1.00 0.00 C ATOM 1141 OG1 THR A 74 -10.007 6.218 5.212 1.00 0.00 O ATOM 1142 CG2 THR A 74 -10.377 5.593 7.514 1.00 0.00 C ATOM 0 H THR A 74 -11.091 4.190 4.537 1.00 0.00 H new ATOM 0 HA THR A 74 -12.821 5.174 6.701 1.00 0.00 H new ATOM 0 HB THR A 74 -11.307 7.213 6.474 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.314 5.551 5.398 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.503 6.174 7.807 1.00 0.00 H new ATOM 0 HG22 THR A 74 -11.111 5.610 8.319 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.079 4.563 7.317 1.00 0.00 H new ATOM 1150 N TYR A 75 -14.354 6.342 5.169 1.00 0.00 N ATOM 1151 CA TYR A 75 -15.296 7.024 4.299 1.00 0.00 C ATOM 1152 C TYR A 75 -15.446 8.485 4.689 1.00 0.00 C ATOM 1153 O TYR A 75 -16.061 8.809 5.704 1.00 0.00 O ATOM 1154 CB TYR A 75 -16.665 6.342 4.347 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.628 4.877 3.989 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -16.637 4.465 2.664 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.581 3.904 4.979 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -16.602 3.125 2.335 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.546 2.562 4.659 1.00 0.00 C ATOM 1160 CZ TYR A 75 -16.556 2.179 3.337 1.00 0.00 C ATOM 1161 OH TYR A 75 -16.518 0.844 3.015 1.00 0.00 O ATOM 0 H TYR A 75 -14.764 5.976 6.028 1.00 0.00 H new ATOM 0 HA TYR A 75 -14.902 6.971 3.284 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -17.080 6.451 5.349 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -17.341 6.856 3.664 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -16.672 5.205 1.878 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.572 4.203 6.017 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -16.611 2.819 1.299 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.511 1.817 5.441 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.487 0.310 3.836 1.00 0.00 H new ATOM 1171 N THR A 76 -14.861 9.358 3.893 1.00 0.00 N ATOM 1172 CA THR A 76 -15.062 10.782 4.041 1.00 0.00 C ATOM 1173 C THR A 76 -15.880 11.284 2.856 1.00 0.00 C ATOM 1174 O THR A 76 -15.760 10.757 1.753 1.00 0.00 O ATOM 1175 CB THR A 76 -13.714 11.532 4.119 1.00 0.00 C ATOM 1176 OG1 THR A 76 -12.898 10.943 5.140 1.00 0.00 O ATOM 1177 CG2 THR A 76 -13.918 13.011 4.426 1.00 0.00 C ATOM 0 H THR A 76 -14.236 9.100 3.129 1.00 0.00 H new ATOM 0 HA THR A 76 -15.596 10.973 4.972 1.00 0.00 H new ATOM 0 HB THR A 76 -13.223 11.449 3.150 1.00 0.00 H new ATOM 0 HG1 THR A 76 -12.042 11.417 5.189 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.950 13.510 4.474 1.00 0.00 H new ATOM 0 HG22 THR A 76 -14.522 13.466 3.641 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.428 13.117 5.383 1.00 0.00 H new ATOM 1185 N ASP A 77 -16.713 12.290 3.083 1.00 0.00 N ATOM 1186 CA ASP A 77 -17.610 12.801 2.046 1.00 0.00 C ATOM 1187 C ASP A 77 -16.836 13.449 0.897 1.00 0.00 C ATOM 1188 O ASP A 77 -17.409 13.813 -0.126 1.00 0.00 O ATOM 1189 CB ASP A 77 -18.590 13.810 2.646 1.00 0.00 C ATOM 1190 CG ASP A 77 -19.437 13.216 3.755 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -18.973 13.197 4.913 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -20.577 12.786 3.478 1.00 0.00 O ATOM 0 H ASP A 77 -16.789 12.773 3.978 1.00 0.00 H new ATOM 0 HA ASP A 77 -18.162 11.953 1.642 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -18.034 14.662 3.036 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -19.243 14.188 1.859 1.00 0.00 H new ATOM 1197 N THR A 78 -15.531 13.599 1.076 1.00 0.00 N ATOM 1198 CA THR A 78 -14.679 14.160 0.040 1.00 0.00 C ATOM 1199 C THR A 78 -13.859 13.063 -0.645 1.00 0.00 C ATOM 1200 O THR A 78 -13.542 13.156 -1.832 1.00 0.00 O ATOM 1201 CB THR A 78 -13.729 15.216 0.636 1.00 0.00 C ATOM 1202 OG1 THR A 78 -14.463 16.094 1.500 1.00 0.00 O ATOM 1203 CG2 THR A 78 -13.055 16.028 -0.462 1.00 0.00 C ATOM 0 H THR A 78 -15.040 13.339 1.931 1.00 0.00 H new ATOM 0 HA THR A 78 -15.323 14.634 -0.701 1.00 0.00 H new ATOM 0 HB THR A 78 -12.957 14.698 1.205 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.856 16.763 1.879 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.390 16.766 -0.013 1.00 0.00 H new ATOM 0 HG22 THR A 78 -12.478 15.363 -1.104 1.00 0.00 H new ATOM 0 HG23 THR A 78 -13.814 16.537 -1.056 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.539 12.011 0.102 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.666 10.958 -0.399 1.00 0.00 C ATOM 1213 C TYR A 79 -12.807 9.691 0.436 1.00 0.00 C ATOM 1214 O TYR A 79 -13.115 9.749 1.626 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.203 11.423 -0.387 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.664 11.748 0.995 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -10.055 10.769 1.775 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -10.761 13.032 1.518 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -9.562 11.061 3.032 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -10.270 13.331 2.776 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.671 12.342 3.528 1.00 0.00 C ATOM 1222 OH TYR A 79 -9.176 12.636 4.780 1.00 0.00 O ATOM 0 H TYR A 79 -13.871 11.866 1.055 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.964 10.737 -1.424 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.583 10.645 -0.833 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.109 12.307 -1.018 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -9.966 9.764 1.391 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -11.228 13.810 0.932 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -9.093 10.289 3.623 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -10.355 14.334 3.168 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.332 13.583 4.979 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.566 8.556 -0.191 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.568 7.283 0.503 1.00 0.00 C ATOM 1234 C ALA A 80 -11.163 6.699 0.487 1.00 0.00 C ATOM 1235 O ALA A 80 -10.605 6.436 -0.579 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.560 6.324 -0.139 1.00 0.00 C ATOM 0 H ALA A 80 -12.365 8.490 -1.189 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.878 7.437 1.537 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.547 5.374 0.396 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.561 6.752 -0.094 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.284 6.158 -1.180 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.577 6.525 1.659 1.00 0.00 N ATOM 1243 CA GLN A 81 -9.216 6.022 1.746 1.00 0.00 C ATOM 1244 C GLN A 81 -9.211 4.569 2.193 1.00 0.00 C ATOM 1245 O GLN A 81 -9.706 4.235 3.274 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.383 6.857 2.722 1.00 0.00 C ATOM 1247 CG GLN A 81 -6.885 6.618 2.602 1.00 0.00 C ATOM 1248 CD GLN A 81 -6.099 7.150 3.787 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -6.672 7.043 4.977 1.00 0.00 O flip ATOM 1250 NE2 GLN A 81 -4.973 7.618 3.637 1.00 0.00 N flip ATOM 0 H GLN A 81 -11.018 6.723 2.557 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.773 6.095 0.753 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.589 7.914 2.551 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -8.698 6.632 3.741 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.701 5.548 2.503 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -6.520 7.090 1.690 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -4.568 7.683 2.703 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.443 7.942 4.446 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.664 3.712 1.352 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.481 2.318 1.691 1.00 0.00 C ATOM 1261 C GLU A 82 -7.144 2.149 2.407 1.00 0.00 C ATOM 1262 O GLU A 82 -6.097 2.008 1.774 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.544 1.449 0.429 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.492 -0.047 0.704 1.00 0.00 C ATOM 1265 CD GLU A 82 -8.556 -0.881 -0.561 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -7.551 -0.923 -1.304 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -9.608 -1.510 -0.811 1.00 0.00 O ATOM 0 H GLU A 82 -8.336 3.963 0.419 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.282 1.994 2.356 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.463 1.677 -0.111 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.715 1.717 -0.226 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.573 -0.281 1.242 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.321 -0.321 1.356 1.00 0.00 H new ATOM 1274 N ASN A 83 -7.187 2.235 3.729 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.996 2.070 4.553 1.00 0.00 C ATOM 1276 C ASN A 83 -5.712 0.588 4.738 1.00 0.00 C ATOM 1277 O ASN A 83 -6.404 -0.099 5.488 1.00 0.00 O ATOM 1278 CB ASN A 83 -6.193 2.768 5.909 1.00 0.00 C ATOM 1279 CG ASN A 83 -5.113 2.435 6.929 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -5.228 1.468 7.682 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -4.074 3.247 6.987 1.00 0.00 N ATOM 0 H ASN A 83 -8.040 2.419 4.258 1.00 0.00 H new ATOM 0 HA ASN A 83 -5.140 2.530 4.059 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.214 3.847 5.753 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -7.164 2.486 6.316 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.335 3.082 7.671 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.010 4.039 6.348 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.719 0.087 4.025 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.429 -1.340 4.045 1.00 0.00 C ATOM 1290 C VAL A 84 -3.143 -1.622 4.805 1.00 0.00 C ATOM 1291 O VAL A 84 -2.138 -0.953 4.607 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.311 -1.918 2.615 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.059 -3.419 2.651 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.558 -1.609 1.803 1.00 0.00 C ATOM 0 H VAL A 84 -4.103 0.640 3.429 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.264 -1.826 4.551 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.458 -1.441 2.132 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.980 -3.799 1.633 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.131 -3.619 3.186 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.885 -3.915 3.160 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.452 -2.025 0.801 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.428 -2.051 2.289 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.690 -0.529 1.735 1.00 0.00 H new ATOM 1304 N THR A 85 -3.175 -2.603 5.683 1.00 0.00 N ATOM 1305 CA THR A 85 -1.969 -3.040 6.360 1.00 0.00 C ATOM 1306 C THR A 85 -1.558 -4.412 5.849 1.00 0.00 C ATOM 1307 O THR A 85 -2.220 -5.399 6.128 1.00 0.00 O ATOM 1308 CB THR A 85 -2.153 -3.113 7.889 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.613 -1.856 8.403 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.846 -3.486 8.571 1.00 0.00 C ATOM 0 H THR A 85 -4.019 -3.112 5.945 1.00 0.00 H new ATOM 0 HA THR A 85 -1.195 -2.303 6.145 1.00 0.00 H new ATOM 0 HB THR A 85 -2.898 -3.881 8.098 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.057 -1.998 9.265 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.998 -3.532 9.649 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.512 -4.459 8.210 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.089 -2.735 8.343 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.489 -4.468 5.076 1.00 0.00 N ATOM 1319 CA ILE A 86 0.034 -5.737 4.604 1.00 0.00 C ATOM 1320 C ILE A 86 1.220 -6.154 5.464 1.00 0.00 C ATOM 1321 O ILE A 86 2.330 -5.647 5.302 1.00 0.00 O ATOM 1322 CB ILE A 86 0.457 -5.671 3.118 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.722 -5.206 2.255 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.962 -7.031 2.648 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.390 -5.070 0.784 1.00 0.00 C ATOM 0 H ILE A 86 0.034 -3.650 4.762 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.762 -6.477 4.686 1.00 0.00 H new ATOM 0 HB ILE A 86 1.269 -4.951 3.015 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.543 -5.913 2.368 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.076 -4.245 2.628 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.256 -6.968 1.600 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.822 -7.327 3.249 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.170 -7.771 2.759 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.274 -4.737 0.241 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.410 -4.340 0.657 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.066 -6.035 0.394 1.00 0.00 H new ATOM 1337 N ASP A 87 0.964 -7.044 6.408 1.00 0.00 N ATOM 1338 CA ASP A 87 1.994 -7.489 7.335 1.00 0.00 C ATOM 1339 C ASP A 87 2.663 -8.758 6.805 1.00 0.00 C ATOM 1340 O ASP A 87 2.055 -9.829 6.763 1.00 0.00 O ATOM 1341 CB ASP A 87 1.378 -7.722 8.715 1.00 0.00 C ATOM 1342 CG ASP A 87 2.401 -7.734 9.830 1.00 0.00 C ATOM 1343 OD1 ASP A 87 3.534 -7.260 9.616 1.00 0.00 O ATOM 1344 OD2 ASP A 87 2.064 -8.209 10.935 1.00 0.00 O ATOM 0 H ASP A 87 0.051 -7.474 6.554 1.00 0.00 H new ATOM 0 HA ASP A 87 2.760 -6.719 7.427 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.643 -6.942 8.914 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.843 -8.672 8.711 1.00 0.00 H new ATOM 1349 N MET A 88 3.925 -8.621 6.418 1.00 0.00 N ATOM 1350 CA MET A 88 4.646 -9.644 5.656 1.00 0.00 C ATOM 1351 C MET A 88 5.166 -10.774 6.542 1.00 0.00 C ATOM 1352 O MET A 88 5.899 -11.647 6.072 1.00 0.00 O ATOM 1353 CB MET A 88 5.844 -9.014 4.938 1.00 0.00 C ATOM 1354 CG MET A 88 5.510 -7.813 4.068 1.00 0.00 C ATOM 1355 SD MET A 88 4.662 -8.250 2.540 1.00 0.00 S ATOM 1356 CE MET A 88 4.651 -6.658 1.716 1.00 0.00 C ATOM 0 H MET A 88 4.484 -7.793 6.623 1.00 0.00 H new ATOM 0 HA MET A 88 3.935 -10.061 4.943 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.578 -8.710 5.685 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.317 -9.774 4.316 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.886 -7.124 4.637 1.00 0.00 H new ATOM 0 HG3 MET A 88 6.431 -7.283 3.825 1.00 0.00 H new ATOM 0 HE1 MET A 88 4.409 -6.795 0.662 1.00 0.00 H new ATOM 0 HE2 MET A 88 3.904 -6.014 2.179 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.634 -6.195 1.805 1.00 0.00 H new ATOM 1366 N GLU A 89 4.797 -10.774 7.810 1.00 0.00 N ATOM 1367 CA GLU A 89 5.338 -11.755 8.740 1.00 0.00 C ATOM 1368 C GLU A 89 4.339 -12.877 9.005 1.00 0.00 C ATOM 1369 O GLU A 89 4.615 -13.802 9.771 1.00 0.00 O ATOM 1370 CB GLU A 89 5.787 -11.073 10.040 1.00 0.00 C ATOM 1371 CG GLU A 89 4.729 -10.199 10.698 1.00 0.00 C ATOM 1372 CD GLU A 89 3.924 -10.935 11.748 1.00 0.00 C ATOM 1373 OE1 GLU A 89 4.371 -10.985 12.915 1.00 0.00 O ATOM 1374 OE2 GLU A 89 2.848 -11.471 11.419 1.00 0.00 O ATOM 0 H GLU A 89 4.133 -10.116 8.218 1.00 0.00 H new ATOM 0 HA GLU A 89 6.216 -12.212 8.283 1.00 0.00 H new ATOM 0 HB2 GLU A 89 6.097 -11.841 10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.664 -10.461 9.829 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.212 -9.336 11.157 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.054 -9.816 9.932 1.00 0.00 H new ATOM 1381 N LYS A 90 3.187 -12.799 8.348 1.00 0.00 N ATOM 1382 CA LYS A 90 2.148 -13.811 8.502 1.00 0.00 C ATOM 1383 C LYS A 90 1.424 -14.051 7.173 1.00 0.00 C ATOM 1384 O LYS A 90 0.483 -14.841 7.102 1.00 0.00 O ATOM 1385 CB LYS A 90 1.154 -13.348 9.573 1.00 0.00 C ATOM 1386 CG LYS A 90 0.186 -14.415 10.060 1.00 0.00 C ATOM 1387 CD LYS A 90 -0.778 -13.837 11.084 1.00 0.00 C ATOM 1388 CE LYS A 90 -1.668 -14.905 11.693 1.00 0.00 C ATOM 1389 NZ LYS A 90 -2.562 -14.339 12.737 1.00 0.00 N ATOM 0 H LYS A 90 2.949 -12.045 7.703 1.00 0.00 H new ATOM 0 HA LYS A 90 2.606 -14.751 8.809 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.715 -12.971 10.428 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.579 -12.512 9.175 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.372 -14.820 9.216 1.00 0.00 H new ATOM 0 HG3 LYS A 90 0.741 -15.243 10.502 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.214 -13.342 11.874 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.398 -13.076 10.610 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -2.269 -15.369 10.911 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.050 -15.690 12.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.156 -15.095 13.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.988 -13.918 13.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.168 -13.607 12.315 1.00 0.00 H new ATOM 1403 N VAL A 91 1.878 -13.379 6.119 1.00 0.00 N ATOM 1404 CA VAL A 91 1.192 -13.423 4.827 1.00 0.00 C ATOM 1405 C VAL A 91 1.261 -14.787 4.163 1.00 0.00 C ATOM 1406 O VAL A 91 2.221 -15.540 4.330 1.00 0.00 O ATOM 1407 CB VAL A 91 1.745 -12.392 3.818 1.00 0.00 C ATOM 1408 CG1 VAL A 91 1.117 -11.027 4.030 1.00 0.00 C ATOM 1409 CG2 VAL A 91 3.261 -12.308 3.905 1.00 0.00 C ATOM 0 H VAL A 91 2.716 -12.798 6.132 1.00 0.00 H new ATOM 0 HA VAL A 91 0.157 -13.185 5.073 1.00 0.00 H new ATOM 0 HB VAL A 91 1.480 -12.731 2.816 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.525 -10.322 3.306 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.037 -11.099 3.898 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.336 -10.678 5.039 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.627 -11.576 3.185 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.551 -12.005 4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.693 -13.283 3.681 1.00 0.00 H new ATOM 1419 N ASP A 92 0.217 -15.083 3.412 1.00 0.00 N ATOM 1420 CA ASP A 92 0.212 -16.212 2.506 1.00 0.00 C ATOM 1421 C ASP A 92 0.088 -15.693 1.084 1.00 0.00 C ATOM 1422 O ASP A 92 -0.984 -15.250 0.663 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.937 -17.173 2.822 1.00 0.00 C ATOM 1424 CG ASP A 92 -1.108 -18.230 1.748 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -0.211 -19.081 1.590 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -2.145 -18.218 1.055 1.00 0.00 O ATOM 0 H ASP A 92 -0.651 -14.547 3.414 1.00 0.00 H new ATOM 0 HA ASP A 92 1.143 -16.767 2.623 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.751 -17.657 3.780 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.864 -16.608 2.925 1.00 0.00 H new ATOM 1431 N PHE A 93 1.195 -15.713 0.355 1.00 0.00 N ATOM 1432 CA PHE A 93 1.227 -15.167 -0.996 1.00 0.00 C ATOM 1433 C PHE A 93 0.349 -15.987 -1.940 1.00 0.00 C ATOM 1434 O PHE A 93 -0.065 -15.503 -2.992 1.00 0.00 O ATOM 1435 CB PHE A 93 2.662 -15.111 -1.525 1.00 0.00 C ATOM 1436 CG PHE A 93 3.535 -14.122 -0.804 1.00 0.00 C ATOM 1437 CD1 PHE A 93 3.497 -12.776 -1.136 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.395 -14.535 0.202 1.00 0.00 C ATOM 1439 CE1 PHE A 93 4.300 -11.862 -0.480 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.200 -13.625 0.862 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.152 -12.287 0.520 1.00 0.00 C ATOM 0 H PHE A 93 2.082 -16.101 0.675 1.00 0.00 H new ATOM 0 HA PHE A 93 0.831 -14.152 -0.954 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.108 -16.102 -1.444 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.639 -14.857 -2.585 1.00 0.00 H new ATOM 0 HD1 PHE A 93 2.832 -12.438 -1.917 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.437 -15.580 0.473 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.261 -10.817 -0.749 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.866 -13.960 1.644 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.780 -11.575 1.034 1.00 0.00 H new ATOM 1451 N LYS A 94 0.055 -17.222 -1.540 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.794 -18.111 -2.323 1.00 0.00 C ATOM 1453 C LYS A 94 -2.192 -17.514 -2.488 1.00 0.00 C ATOM 1454 O LYS A 94 -2.830 -17.672 -3.526 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.887 -19.481 -1.646 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.700 -20.498 -2.429 1.00 0.00 C ATOM 1457 CD LYS A 94 -1.943 -21.776 -1.636 1.00 0.00 C ATOM 1458 CE LYS A 94 -2.903 -21.557 -0.472 1.00 0.00 C ATOM 1459 NZ LYS A 94 -2.230 -21.008 0.737 1.00 0.00 N ATOM 0 H LYS A 94 0.397 -17.631 -0.670 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.349 -18.231 -3.311 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.120 -19.871 -1.497 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.331 -19.358 -0.658 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.658 -20.058 -2.708 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.179 -20.741 -3.355 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -2.347 -22.542 -2.299 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.993 -22.152 -1.256 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.694 -20.874 -0.783 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.380 -22.503 -0.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.421 -21.626 1.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.204 -20.960 0.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.594 -20.054 0.934 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.667 -16.834 -1.455 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.953 -16.159 -1.523 1.00 0.00 C ATOM 1475 C ALA A 95 -3.787 -14.724 -2.011 1.00 0.00 C ATOM 1476 O ALA A 95 -4.701 -14.144 -2.595 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.637 -16.185 -0.166 1.00 0.00 C ATOM 0 H ALA A 95 -2.183 -16.736 -0.563 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.581 -16.690 -2.239 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.598 -15.676 -0.233 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.795 -17.219 0.142 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.009 -15.679 0.568 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.601 -14.165 -1.788 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.315 -12.784 -2.169 1.00 0.00 C ATOM 1485 C LEU A 96 -2.329 -12.637 -3.692 1.00 0.00 C ATOM 1486 O LEU A 96 -2.716 -11.591 -4.220 1.00 0.00 O ATOM 1487 CB LEU A 96 -0.961 -12.348 -1.584 1.00 0.00 C ATOM 1488 CG LEU A 96 -0.785 -10.840 -1.340 1.00 0.00 C ATOM 1489 CD1 LEU A 96 0.405 -10.590 -0.428 1.00 0.00 C ATOM 1490 CD2 LEU A 96 -0.597 -10.083 -2.647 1.00 0.00 C ATOM 0 H LEU A 96 -1.820 -14.648 -1.344 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.090 -12.135 -1.762 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.812 -12.869 -0.638 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.172 -12.681 -2.259 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.693 -10.474 -0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.518 -9.518 -0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.242 -11.089 0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.309 -10.983 -0.893 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.476 -9.020 -2.438 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.290 -10.456 -3.159 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -1.471 -10.230 -3.282 1.00 0.00 H new ATOM 1502 N GLN A 97 -1.927 -13.693 -4.397 1.00 0.00 N ATOM 1503 CA GLN A 97 -1.951 -13.689 -5.860 1.00 0.00 C ATOM 1504 C GLN A 97 -3.388 -13.613 -6.374 1.00 0.00 C ATOM 1505 O GLN A 97 -3.640 -13.146 -7.483 1.00 0.00 O ATOM 1506 CB GLN A 97 -1.251 -14.929 -6.424 1.00 0.00 C ATOM 1507 CG GLN A 97 -1.908 -16.239 -6.023 1.00 0.00 C ATOM 1508 CD GLN A 97 -1.220 -17.453 -6.617 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -0.015 -17.440 -6.872 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -1.981 -18.514 -6.838 1.00 0.00 N ATOM 0 H GLN A 97 -1.582 -14.559 -3.982 1.00 0.00 H new ATOM 0 HA GLN A 97 -1.411 -12.806 -6.202 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -1.232 -14.861 -7.512 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -0.215 -14.935 -6.087 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.906 -16.322 -4.936 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -2.951 -16.228 -6.340 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -2.975 -18.484 -6.613 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -1.573 -19.361 -7.233 1.00 0.00 H new ATOM 1519 N GLY A 98 -4.329 -14.061 -5.549 1.00 0.00 N ATOM 1520 CA GLY A 98 -5.730 -13.974 -5.905 1.00 0.00 C ATOM 1521 C GLY A 98 -6.265 -12.573 -5.704 1.00 0.00 C ATOM 1522 O GLY A 98 -7.295 -12.201 -6.264 1.00 0.00 O ATOM 0 H GLY A 98 -4.144 -14.483 -4.639 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.861 -14.269 -6.946 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.305 -14.675 -5.300 1.00 0.00 H new ATOM 1526 N ILE A 99 -5.552 -11.793 -4.901 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.929 -10.414 -4.639 1.00 0.00 C ATOM 1528 C ILE A 99 -5.360 -9.506 -5.713 1.00 0.00 C ATOM 1529 O ILE A 99 -6.064 -9.070 -6.623 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.417 -9.934 -3.263 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -5.783 -10.939 -2.169 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -5.988 -8.559 -2.937 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -5.157 -10.621 -0.829 1.00 0.00 C ATOM 0 H ILE A 99 -4.706 -12.096 -4.419 1.00 0.00 H new ATOM 0 HA ILE A 99 -7.018 -10.369 -4.642 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.330 -9.859 -3.307 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.867 -10.966 -2.058 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.470 -11.935 -2.481 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.619 -8.233 -1.965 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.678 -7.846 -3.701 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.076 -8.614 -2.912 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -5.458 -11.373 -0.099 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.071 -10.622 -0.925 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.490 -9.638 -0.496 1.00 0.00 H new ATOM 1545 N SER A 100 -4.071 -9.249 -5.604 1.00 0.00 N ATOM 1546 CA SER A 100 -3.373 -8.396 -6.546 1.00 0.00 C ATOM 1547 C SER A 100 -2.266 -9.183 -7.221 1.00 0.00 C ATOM 1548 O SER A 100 -1.958 -8.975 -8.395 1.00 0.00 O ATOM 1549 CB SER A 100 -2.777 -7.183 -5.817 1.00 0.00 C ATOM 1550 OG SER A 100 -2.240 -6.241 -6.733 1.00 0.00 O ATOM 0 H SER A 100 -3.480 -9.624 -4.862 1.00 0.00 H new ATOM 0 HA SER A 100 -4.078 -8.044 -7.299 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.548 -6.706 -5.212 1.00 0.00 H new ATOM 0 HB3 SER A 100 -1.995 -7.515 -5.134 1.00 0.00 H new ATOM 0 HG SER A 100 -1.869 -5.480 -6.240 1.00 0.00 H new ATOM 1556 N GLY A 101 -1.677 -10.105 -6.462 1.00 0.00 N ATOM 1557 CA GLY A 101 -0.489 -10.808 -6.918 1.00 0.00 C ATOM 1558 C GLY A 101 0.703 -9.880 -7.076 1.00 0.00 C ATOM 1559 O GLY A 101 1.764 -10.300 -7.532 1.00 0.00 O ATOM 0 H GLY A 101 -2.003 -10.378 -5.535 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.241 -11.597 -6.208 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -0.699 -11.292 -7.872 1.00 0.00 H new ATOM 1563 N ILE A 102 0.520 -8.623 -6.665 1.00 0.00 N ATOM 1564 CA ILE A 102 1.506 -7.572 -6.877 1.00 0.00 C ATOM 1565 C ILE A 102 1.777 -7.420 -8.370 1.00 0.00 C ATOM 1566 O ILE A 102 2.726 -7.986 -8.915 1.00 0.00 O ATOM 1567 CB ILE A 102 2.811 -7.838 -6.091 1.00 0.00 C ATOM 1568 CG1 ILE A 102 2.478 -7.966 -4.601 1.00 0.00 C ATOM 1569 CG2 ILE A 102 3.826 -6.721 -6.324 1.00 0.00 C ATOM 1570 CD1 ILE A 102 3.664 -8.303 -3.727 1.00 0.00 C ATOM 0 H ILE A 102 -0.318 -8.310 -6.176 1.00 0.00 H new ATOM 0 HA ILE A 102 1.100 -6.636 -6.494 1.00 0.00 H new ATOM 0 HB ILE A 102 3.260 -8.766 -6.444 1.00 0.00 H new ATOM 0 HG12 ILE A 102 2.042 -7.029 -4.256 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.718 -8.737 -4.475 1.00 0.00 H new ATOM 0 HG21 ILE A 102 4.735 -6.932 -5.760 1.00 0.00 H new ATOM 0 HG22 ILE A 102 4.063 -6.661 -7.386 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.405 -5.772 -5.992 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.342 -8.375 -2.688 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.089 -9.256 -4.042 1.00 0.00 H new ATOM 0 HD13 ILE A 102 4.418 -7.521 -3.819 1.00 0.00 H new ATOM 1582 N ASN A 103 0.919 -6.642 -9.023 1.00 0.00 N ATOM 1583 CA ASN A 103 0.892 -6.559 -10.483 1.00 0.00 C ATOM 1584 C ASN A 103 2.014 -5.672 -11.022 1.00 0.00 C ATOM 1585 O ASN A 103 1.899 -5.055 -12.078 1.00 0.00 O ATOM 1586 CB ASN A 103 -0.480 -6.048 -10.942 1.00 0.00 C ATOM 1587 CG ASN A 103 -0.798 -6.417 -12.381 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -0.556 -5.647 -13.308 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -1.348 -7.608 -12.576 1.00 0.00 N ATOM 0 H ASN A 103 0.226 -6.054 -8.560 1.00 0.00 H new ATOM 0 HA ASN A 103 1.057 -7.558 -10.887 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -1.251 -6.456 -10.289 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -0.513 -4.964 -10.835 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -1.585 -7.912 -13.520 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -1.534 -8.220 -11.782 1.00 0.00 H new ATOM 1596 N VAL A 104 3.102 -5.634 -10.287 1.00 0.00 N ATOM 1597 CA VAL A 104 4.322 -4.992 -10.744 1.00 0.00 C ATOM 1598 C VAL A 104 5.281 -6.077 -11.210 1.00 0.00 C ATOM 1599 O VAL A 104 5.997 -5.923 -12.197 1.00 0.00 O ATOM 1600 CB VAL A 104 4.986 -4.153 -9.628 1.00 0.00 C ATOM 1601 CG1 VAL A 104 6.214 -3.424 -10.155 1.00 0.00 C ATOM 1602 CG2 VAL A 104 3.992 -3.165 -9.031 1.00 0.00 C ATOM 0 H VAL A 104 3.170 -6.045 -9.356 1.00 0.00 H new ATOM 0 HA VAL A 104 4.077 -4.309 -11.558 1.00 0.00 H new ATOM 0 HB VAL A 104 5.307 -4.834 -8.840 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.664 -2.841 -9.351 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.938 -4.150 -10.525 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.921 -2.758 -10.967 1.00 0.00 H new ATOM 0 HG21 VAL A 104 4.481 -2.585 -8.248 1.00 0.00 H new ATOM 0 HG22 VAL A 104 3.635 -2.492 -9.811 1.00 0.00 H new ATOM 0 HG23 VAL A 104 3.148 -3.709 -8.607 1.00 0.00 H new ATOM 1612 N SER A 105 5.245 -7.194 -10.490 1.00 0.00 N ATOM 1613 CA SER A 105 6.039 -8.366 -10.809 1.00 0.00 C ATOM 1614 C SER A 105 5.674 -9.500 -9.858 1.00 0.00 C ATOM 1615 O SER A 105 5.999 -9.450 -8.670 1.00 0.00 O ATOM 1616 CB SER A 105 7.538 -8.052 -10.723 1.00 0.00 C ATOM 1617 OG SER A 105 7.869 -7.444 -9.485 1.00 0.00 O ATOM 0 H SER A 105 4.658 -7.308 -9.663 1.00 0.00 H new ATOM 0 HA SER A 105 5.822 -8.671 -11.833 1.00 0.00 H new ATOM 0 HB2 SER A 105 8.111 -8.971 -10.844 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.820 -7.390 -11.542 1.00 0.00 H new ATOM 0 HG SER A 105 8.831 -7.257 -9.459 1.00 0.00 H new ATOM 1623 N ALA A 106 4.982 -10.510 -10.377 1.00 0.00 N ATOM 1624 CA ALA A 106 4.569 -11.654 -9.571 1.00 0.00 C ATOM 1625 C ALA A 106 5.791 -12.408 -9.066 1.00 0.00 C ATOM 1626 O ALA A 106 5.748 -13.069 -8.026 1.00 0.00 O ATOM 1627 CB ALA A 106 3.668 -12.577 -10.379 1.00 0.00 C ATOM 0 H ALA A 106 4.695 -10.559 -11.355 1.00 0.00 H new ATOM 0 HA ALA A 106 4.005 -11.291 -8.712 1.00 0.00 H new ATOM 0 HB1 ALA A 106 3.369 -13.425 -9.763 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.781 -12.031 -10.699 1.00 0.00 H new ATOM 0 HB3 ALA A 106 4.208 -12.937 -11.255 1.00 0.00 H new ATOM 1633 N GLU A 107 6.878 -12.288 -9.819 1.00 0.00 N ATOM 1634 CA GLU A 107 8.165 -12.863 -9.451 1.00 0.00 C ATOM 1635 C GLU A 107 8.568 -12.448 -8.035 1.00 0.00 C ATOM 1636 O GLU A 107 9.095 -13.250 -7.269 1.00 0.00 O ATOM 1637 CB GLU A 107 9.227 -12.390 -10.450 1.00 0.00 C ATOM 1638 CG GLU A 107 10.626 -12.920 -10.182 1.00 0.00 C ATOM 1639 CD GLU A 107 10.738 -14.413 -10.394 1.00 0.00 C ATOM 1640 OE1 GLU A 107 10.742 -14.849 -11.562 1.00 0.00 O ATOM 1641 OE2 GLU A 107 10.830 -15.157 -9.399 1.00 0.00 O ATOM 0 H GLU A 107 6.891 -11.786 -10.707 1.00 0.00 H new ATOM 0 HA GLU A 107 8.084 -13.950 -9.475 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.924 -12.691 -11.453 1.00 0.00 H new ATOM 0 HB3 GLU A 107 9.257 -11.300 -10.440 1.00 0.00 H new ATOM 0 HG2 GLU A 107 11.334 -12.411 -10.836 1.00 0.00 H new ATOM 0 HG3 GLU A 107 10.910 -12.681 -9.157 1.00 0.00 H new ATOM 1648 N ASP A 108 8.280 -11.199 -7.690 1.00 0.00 N ATOM 1649 CA ASP A 108 8.743 -10.620 -6.437 1.00 0.00 C ATOM 1650 C ASP A 108 8.031 -11.256 -5.250 1.00 0.00 C ATOM 1651 O ASP A 108 8.660 -11.631 -4.256 1.00 0.00 O ATOM 1652 CB ASP A 108 8.502 -9.111 -6.444 1.00 0.00 C ATOM 1653 CG ASP A 108 9.557 -8.365 -5.668 1.00 0.00 C ATOM 1654 OD1 ASP A 108 10.653 -8.157 -6.224 1.00 0.00 O ATOM 1655 OD2 ASP A 108 9.309 -8.003 -4.502 1.00 0.00 O ATOM 0 H ASP A 108 7.725 -10.565 -8.265 1.00 0.00 H new ATOM 0 HA ASP A 108 9.811 -10.815 -6.340 1.00 0.00 H new ATOM 0 HB2 ASP A 108 8.487 -8.751 -7.473 1.00 0.00 H new ATOM 0 HB3 ASP A 108 7.521 -8.899 -6.018 1.00 0.00 H new ATOM 1660 N ALA A 109 6.718 -11.406 -5.377 1.00 0.00 N ATOM 1661 CA ALA A 109 5.895 -11.954 -4.306 1.00 0.00 C ATOM 1662 C ALA A 109 6.236 -13.415 -4.029 1.00 0.00 C ATOM 1663 O ALA A 109 6.192 -13.864 -2.885 1.00 0.00 O ATOM 1664 CB ALA A 109 4.421 -11.815 -4.659 1.00 0.00 C ATOM 0 H ALA A 109 6.198 -11.154 -6.217 1.00 0.00 H new ATOM 0 HA ALA A 109 6.103 -11.387 -3.399 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.813 -12.227 -3.853 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.177 -10.761 -4.795 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.215 -12.357 -5.582 1.00 0.00 H new ATOM 1670 N LYS A 110 6.596 -14.144 -5.077 1.00 0.00 N ATOM 1671 CA LYS A 110 6.869 -15.573 -4.958 1.00 0.00 C ATOM 1672 C LYS A 110 8.247 -15.840 -4.351 1.00 0.00 C ATOM 1673 O LYS A 110 8.537 -16.955 -3.919 1.00 0.00 O ATOM 1674 CB LYS A 110 6.753 -16.250 -6.325 1.00 0.00 C ATOM 1675 CG LYS A 110 5.339 -16.238 -6.888 1.00 0.00 C ATOM 1676 CD LYS A 110 5.281 -16.849 -8.279 1.00 0.00 C ATOM 1677 CE LYS A 110 6.063 -16.018 -9.285 1.00 0.00 C ATOM 1678 NZ LYS A 110 6.037 -16.617 -10.643 1.00 0.00 N ATOM 0 H LYS A 110 6.706 -13.771 -6.020 1.00 0.00 H new ATOM 0 HA LYS A 110 6.124 -15.995 -4.283 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.420 -15.750 -7.027 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.094 -17.282 -6.241 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.677 -16.790 -6.221 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.971 -15.213 -6.926 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.684 -17.861 -8.250 1.00 0.00 H new ATOM 0 HD3 LYS A 110 4.242 -16.928 -8.600 1.00 0.00 H new ATOM 0 HE2 LYS A 110 5.647 -15.011 -9.325 1.00 0.00 H new ATOM 0 HE3 LYS A 110 7.096 -15.923 -8.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 6.582 -16.019 -11.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 6.458 -17.568 -10.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 5.053 -16.685 -10.974 1.00 0.00 H new ATOM 1692 N LYS A 111 9.092 -14.818 -4.316 1.00 0.00 N ATOM 1693 CA LYS A 111 10.426 -14.952 -3.740 1.00 0.00 C ATOM 1694 C LYS A 111 10.444 -14.491 -2.287 1.00 0.00 C ATOM 1695 O LYS A 111 11.218 -14.996 -1.470 1.00 0.00 O ATOM 1696 CB LYS A 111 11.448 -14.144 -4.542 1.00 0.00 C ATOM 1697 CG LYS A 111 11.649 -14.639 -5.966 1.00 0.00 C ATOM 1698 CD LYS A 111 12.677 -13.798 -6.709 1.00 0.00 C ATOM 1699 CE LYS A 111 12.244 -12.344 -6.814 1.00 0.00 C ATOM 1700 NZ LYS A 111 13.245 -11.519 -7.542 1.00 0.00 N ATOM 0 H LYS A 111 8.879 -13.889 -4.678 1.00 0.00 H new ATOM 0 HA LYS A 111 10.694 -16.008 -3.779 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.129 -13.102 -4.572 1.00 0.00 H new ATOM 0 HB3 LYS A 111 12.405 -14.169 -4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 111 11.973 -15.680 -5.948 1.00 0.00 H new ATOM 0 HG3 LYS A 111 10.699 -14.610 -6.500 1.00 0.00 H new ATOM 0 HD2 LYS A 111 13.636 -13.856 -6.194 1.00 0.00 H new ATOM 0 HD3 LYS A 111 12.827 -14.206 -7.708 1.00 0.00 H new ATOM 0 HE2 LYS A 111 11.284 -12.287 -7.327 1.00 0.00 H new ATOM 0 HE3 LYS A 111 12.095 -11.936 -5.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 12.913 -10.535 -7.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.154 -11.552 -7.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 13.368 -11.892 -8.505 1.00 0.00 H new ATOM 1714 N GLY A 112 9.590 -13.530 -1.969 1.00 0.00 N ATOM 1715 CA GLY A 112 9.586 -12.945 -0.645 1.00 0.00 C ATOM 1716 C GLY A 112 10.123 -11.533 -0.679 1.00 0.00 C ATOM 1717 O GLY A 112 11.263 -11.310 -1.083 1.00 0.00 O ATOM 0 H GLY A 112 8.896 -13.143 -2.609 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.571 -12.943 -0.247 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.191 -13.553 0.028 1.00 0.00 H new ATOM 1721 N ILE A 113 9.302 -10.583 -0.259 1.00 0.00 N ATOM 1722 CA ILE A 113 9.612 -9.165 -0.410 1.00 0.00 C ATOM 1723 C ILE A 113 10.814 -8.741 0.439 1.00 0.00 C ATOM 1724 O ILE A 113 10.795 -8.846 1.667 1.00 0.00 O ATOM 1725 CB ILE A 113 8.396 -8.289 -0.040 1.00 0.00 C ATOM 1726 CG1 ILE A 113 7.133 -8.772 -0.772 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.682 -6.831 -0.366 1.00 0.00 C ATOM 1728 CD1 ILE A 113 7.252 -8.779 -2.285 1.00 0.00 C ATOM 0 H ILE A 113 8.407 -10.769 0.194 1.00 0.00 H new ATOM 0 HA ILE A 113 9.864 -9.016 -1.460 1.00 0.00 H new ATOM 0 HB ILE A 113 8.218 -8.378 1.032 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.894 -9.780 -0.433 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.296 -8.134 -0.488 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.817 -6.223 -0.101 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.550 -6.495 0.201 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.884 -6.729 -1.432 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.318 -9.133 -2.722 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.458 -7.769 -2.638 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.065 -9.441 -2.583 1.00 0.00 H new ATOM 1740 N THR A 114 11.855 -8.259 -0.229 1.00 0.00 N ATOM 1741 CA THR A 114 13.045 -7.761 0.448 1.00 0.00 C ATOM 1742 C THR A 114 13.310 -6.307 0.059 1.00 0.00 C ATOM 1743 O THR A 114 12.646 -5.768 -0.830 1.00 0.00 O ATOM 1744 CB THR A 114 14.284 -8.612 0.100 1.00 0.00 C ATOM 1745 OG1 THR A 114 14.448 -8.682 -1.324 1.00 0.00 O ATOM 1746 CG2 THR A 114 14.162 -10.018 0.673 1.00 0.00 C ATOM 0 H THR A 114 11.898 -8.203 -1.247 1.00 0.00 H new ATOM 0 HA THR A 114 12.864 -7.827 1.521 1.00 0.00 H new ATOM 0 HB THR A 114 15.158 -8.134 0.544 1.00 0.00 H new ATOM 0 HG1 THR A 114 15.237 -9.223 -1.536 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.049 -10.595 0.412 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.071 -9.962 1.758 1.00 0.00 H new ATOM 0 HG23 THR A 114 13.278 -10.504 0.259 1.00 0.00 H new ATOM 1754 N MET A 115 14.274 -5.672 0.722 1.00 0.00 N ATOM 1755 CA MET A 115 14.639 -4.296 0.398 1.00 0.00 C ATOM 1756 C MET A 115 15.307 -4.221 -0.971 1.00 0.00 C ATOM 1757 O MET A 115 15.030 -3.308 -1.747 1.00 0.00 O ATOM 1758 CB MET A 115 15.548 -3.700 1.480 1.00 0.00 C ATOM 1759 CG MET A 115 16.183 -2.362 1.104 1.00 0.00 C ATOM 1760 SD MET A 115 15.007 -1.153 0.443 1.00 0.00 S ATOM 1761 CE MET A 115 13.797 -1.069 1.754 1.00 0.00 C ATOM 0 H MET A 115 14.813 -6.086 1.482 1.00 0.00 H new ATOM 0 HA MET A 115 13.724 -3.705 0.363 1.00 0.00 H new ATOM 0 HB2 MET A 115 14.968 -3.569 2.393 1.00 0.00 H new ATOM 0 HB3 MET A 115 16.340 -4.414 1.705 1.00 0.00 H new ATOM 0 HG2 MET A 115 16.667 -1.940 1.985 1.00 0.00 H new ATOM 0 HG3 MET A 115 16.964 -2.537 0.364 1.00 0.00 H new ATOM 0 HE1 MET A 115 13.252 -0.127 1.687 1.00 0.00 H new ATOM 0 HE2 MET A 115 13.098 -1.900 1.658 1.00 0.00 H new ATOM 0 HE3 MET A 115 14.301 -1.128 2.719 1.00 0.00 H new ATOM 1771 N ALA A 116 16.173 -5.186 -1.270 1.00 0.00 N ATOM 1772 CA ALA A 116 16.817 -5.256 -2.580 1.00 0.00 C ATOM 1773 C ALA A 116 15.769 -5.221 -3.687 1.00 0.00 C ATOM 1774 O ALA A 116 15.901 -4.483 -4.668 1.00 0.00 O ATOM 1775 CB ALA A 116 17.661 -6.517 -2.689 1.00 0.00 C ATOM 0 H ALA A 116 16.445 -5.928 -0.626 1.00 0.00 H new ATOM 0 HA ALA A 116 17.471 -4.391 -2.693 1.00 0.00 H new ATOM 0 HB1 ALA A 116 18.134 -6.555 -3.670 1.00 0.00 H new ATOM 0 HB2 ALA A 116 18.429 -6.509 -1.916 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.025 -7.393 -2.559 1.00 0.00 H new ATOM 1781 N GLN A 117 14.719 -6.010 -3.502 1.00 0.00 N ATOM 1782 CA GLN A 117 13.598 -6.030 -4.427 1.00 0.00 C ATOM 1783 C GLN A 117 12.896 -4.684 -4.453 1.00 0.00 C ATOM 1784 O GLN A 117 12.908 -4.011 -5.467 1.00 0.00 O ATOM 1785 CB GLN A 117 12.629 -7.145 -4.045 1.00 0.00 C ATOM 1786 CG GLN A 117 13.125 -8.512 -4.472 1.00 0.00 C ATOM 1787 CD GLN A 117 12.500 -9.651 -3.693 1.00 0.00 C ATOM 1788 OE1 GLN A 117 13.153 -10.661 -3.430 1.00 0.00 O ATOM 1789 NE2 GLN A 117 11.231 -9.524 -3.353 1.00 0.00 N ATOM 0 H GLN A 117 14.622 -6.649 -2.713 1.00 0.00 H new ATOM 0 HA GLN A 117 13.975 -6.226 -5.431 1.00 0.00 H new ATOM 0 HB2 GLN A 117 12.477 -7.137 -2.966 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.659 -6.953 -4.504 1.00 0.00 H new ATOM 0 HG2 GLN A 117 12.917 -8.650 -5.533 1.00 0.00 H new ATOM 0 HG3 GLN A 117 14.208 -8.551 -4.352 1.00 0.00 H new ATOM 0 HE21 GLN A 117 10.723 -8.672 -3.588 1.00 0.00 H new ATOM 0 HE22 GLN A 117 10.759 -10.278 -2.855 1.00 0.00 H new ATOM 1798 N MET A 118 12.325 -4.282 -3.324 1.00 0.00 N ATOM 1799 CA MET A 118 11.602 -3.010 -3.216 1.00 0.00 C ATOM 1800 C MET A 118 12.392 -1.818 -3.767 1.00 0.00 C ATOM 1801 O MET A 118 11.802 -0.842 -4.223 1.00 0.00 O ATOM 1802 CB MET A 118 11.211 -2.753 -1.762 1.00 0.00 C ATOM 1803 CG MET A 118 9.937 -3.470 -1.360 1.00 0.00 C ATOM 1804 SD MET A 118 8.492 -2.788 -2.191 1.00 0.00 S ATOM 1805 CE MET A 118 7.273 -4.060 -1.877 1.00 0.00 C ATOM 0 H MET A 118 12.347 -4.822 -2.459 1.00 0.00 H new ATOM 0 HA MET A 118 10.708 -3.104 -3.832 1.00 0.00 H new ATOM 0 HB2 MET A 118 12.024 -3.073 -1.110 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.083 -1.681 -1.609 1.00 0.00 H new ATOM 0 HG2 MET A 118 10.026 -4.530 -1.598 1.00 0.00 H new ATOM 0 HG3 MET A 118 9.804 -3.396 -0.281 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.315 -3.759 -2.302 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.596 -4.995 -2.335 1.00 0.00 H new ATOM 0 HE3 MET A 118 7.164 -4.202 -0.802 1.00 0.00 H new ATOM 1815 N GLU A 119 13.714 -1.890 -3.722 1.00 0.00 N ATOM 1816 CA GLU A 119 14.550 -0.847 -4.300 1.00 0.00 C ATOM 1817 C GLU A 119 14.445 -0.832 -5.826 1.00 0.00 C ATOM 1818 O GLU A 119 13.974 0.141 -6.416 1.00 0.00 O ATOM 1819 CB GLU A 119 16.009 -1.031 -3.878 1.00 0.00 C ATOM 1820 CG GLU A 119 16.424 -0.124 -2.733 1.00 0.00 C ATOM 1821 CD GLU A 119 16.430 1.336 -3.135 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.346 1.957 -3.165 1.00 0.00 O ATOM 1823 OE2 GLU A 119 17.518 1.869 -3.431 1.00 0.00 O ATOM 0 H GLU A 119 14.231 -2.658 -3.292 1.00 0.00 H new ATOM 0 HA GLU A 119 14.190 0.110 -3.924 1.00 0.00 H new ATOM 0 HB2 GLU A 119 16.167 -2.069 -3.585 1.00 0.00 H new ATOM 0 HB3 GLU A 119 16.654 -0.840 -4.735 1.00 0.00 H new ATOM 0 HG2 GLU A 119 15.743 -0.266 -1.894 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.418 -0.408 -2.388 1.00 0.00 H new ATOM 1830 N LEU A 120 14.866 -1.924 -6.456 1.00 0.00 N ATOM 1831 CA LEU A 120 14.904 -2.010 -7.920 1.00 0.00 C ATOM 1832 C LEU A 120 13.499 -2.053 -8.512 1.00 0.00 C ATOM 1833 O LEU A 120 13.262 -1.572 -9.618 1.00 0.00 O ATOM 1834 CB LEU A 120 15.679 -3.257 -8.367 1.00 0.00 C ATOM 1835 CG LEU A 120 17.208 -3.140 -8.353 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.739 -2.950 -6.940 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.834 -4.369 -8.992 1.00 0.00 C ATOM 0 H LEU A 120 15.187 -2.766 -5.978 1.00 0.00 H new ATOM 0 HA LEU A 120 15.410 -1.116 -8.284 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.392 -4.089 -7.723 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.363 -3.513 -9.378 1.00 0.00 H new ATOM 0 HG LEU A 120 17.482 -2.258 -8.932 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.826 -2.871 -6.967 1.00 0.00 H new ATOM 0 HD12 LEU A 120 17.319 -2.039 -6.513 1.00 0.00 H new ATOM 0 HD13 LEU A 120 17.453 -3.804 -6.326 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.920 -4.274 -8.976 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.539 -5.259 -8.435 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.492 -4.457 -10.023 1.00 0.00 H new ATOM 1849 N VAL A 121 12.583 -2.613 -7.749 1.00 0.00 N ATOM 1850 CA VAL A 121 11.220 -2.871 -8.191 1.00 0.00 C ATOM 1851 C VAL A 121 10.356 -1.607 -8.144 1.00 0.00 C ATOM 1852 O VAL A 121 9.622 -1.316 -9.089 1.00 0.00 O ATOM 1853 CB VAL A 121 10.609 -4.009 -7.333 1.00 0.00 C ATOM 1854 CG1 VAL A 121 9.097 -4.047 -7.390 1.00 0.00 C ATOM 1855 CG2 VAL A 121 11.167 -5.350 -7.775 1.00 0.00 C ATOM 0 H VAL A 121 12.763 -2.908 -6.789 1.00 0.00 H new ATOM 0 HA VAL A 121 11.246 -3.187 -9.234 1.00 0.00 H new ATOM 0 HB VAL A 121 10.887 -3.804 -6.299 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.730 -4.865 -6.770 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.695 -3.103 -7.022 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.775 -4.201 -8.420 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.732 -6.143 -7.167 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.920 -5.519 -8.823 1.00 0.00 H new ATOM 0 HG23 VAL A 121 12.250 -5.351 -7.653 1.00 0.00 H new ATOM 1865 N MET A 122 10.464 -0.834 -7.070 1.00 0.00 N ATOM 1866 CA MET A 122 9.701 0.409 -6.965 1.00 0.00 C ATOM 1867 C MET A 122 10.259 1.463 -7.911 1.00 0.00 C ATOM 1868 O MET A 122 9.515 2.289 -8.449 1.00 0.00 O ATOM 1869 CB MET A 122 9.686 0.925 -5.527 1.00 0.00 C ATOM 1870 CG MET A 122 8.372 0.652 -4.814 1.00 0.00 C ATOM 1871 SD MET A 122 7.803 -1.041 -5.048 1.00 0.00 S ATOM 1872 CE MET A 122 6.196 -0.975 -4.263 1.00 0.00 C ATOM 0 H MET A 122 11.062 -1.039 -6.270 1.00 0.00 H new ATOM 0 HA MET A 122 8.672 0.198 -7.255 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.499 0.459 -4.971 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.876 1.998 -5.530 1.00 0.00 H new ATOM 0 HG2 MET A 122 8.492 0.848 -3.749 1.00 0.00 H new ATOM 0 HG3 MET A 122 7.612 1.342 -5.181 1.00 0.00 H new ATOM 0 HE1 MET A 122 5.719 -1.953 -4.328 1.00 0.00 H new ATOM 0 HE2 MET A 122 6.314 -0.697 -3.216 1.00 0.00 H new ATOM 0 HE3 MET A 122 5.575 -0.235 -4.767 1.00 0.00 H new ATOM 1882 N LYS A 123 11.567 1.423 -8.126 1.00 0.00 N ATOM 1883 CA LYS A 123 12.202 2.300 -9.100 1.00 0.00 C ATOM 1884 C LYS A 123 11.888 1.831 -10.520 1.00 0.00 C ATOM 1885 O LYS A 123 11.949 2.609 -11.470 1.00 0.00 O ATOM 1886 CB LYS A 123 13.715 2.355 -8.870 1.00 0.00 C ATOM 1887 CG LYS A 123 14.118 3.172 -7.650 1.00 0.00 C ATOM 1888 CD LYS A 123 15.620 3.115 -7.422 1.00 0.00 C ATOM 1889 CE LYS A 123 16.091 4.158 -6.417 1.00 0.00 C ATOM 1890 NZ LYS A 123 15.491 3.975 -5.067 1.00 0.00 N ATOM 0 H LYS A 123 12.207 0.795 -7.641 1.00 0.00 H new ATOM 0 HA LYS A 123 11.803 3.306 -8.973 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.094 1.339 -8.758 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.193 2.778 -9.754 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.807 4.208 -7.784 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.599 2.795 -6.769 1.00 0.00 H new ATOM 0 HD2 LYS A 123 15.894 2.122 -7.067 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.135 3.268 -8.370 1.00 0.00 H new ATOM 0 HE2 LYS A 123 17.177 4.112 -6.336 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.841 5.152 -6.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.082 4.452 -4.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 14.535 4.385 -5.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.436 2.960 -4.846 1.00 0.00 H new ATOM 1904 N ALA A 124 11.544 0.554 -10.652 1.00 0.00 N ATOM 1905 CA ALA A 124 11.133 -0.005 -11.936 1.00 0.00 C ATOM 1906 C ALA A 124 9.736 0.474 -12.301 1.00 0.00 C ATOM 1907 O ALA A 124 9.457 0.783 -13.458 1.00 0.00 O ATOM 1908 CB ALA A 124 11.178 -1.527 -11.896 1.00 0.00 C ATOM 0 H ALA A 124 11.542 -0.116 -9.883 1.00 0.00 H new ATOM 0 HA ALA A 124 11.829 0.341 -12.700 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.868 -1.926 -12.862 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.194 -1.855 -11.677 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.504 -1.891 -11.120 1.00 0.00 H new ATOM 1914 N ALA A 125 8.858 0.535 -11.305 1.00 0.00 N ATOM 1915 CA ALA A 125 7.503 1.029 -11.512 1.00 0.00 C ATOM 1916 C ALA A 125 7.503 2.538 -11.726 1.00 0.00 C ATOM 1917 O ALA A 125 6.610 3.083 -12.373 1.00 0.00 O ATOM 1918 CB ALA A 125 6.617 0.668 -10.331 1.00 0.00 C ATOM 0 H ALA A 125 9.061 0.248 -10.347 1.00 0.00 H new ATOM 0 HA ALA A 125 7.104 0.553 -12.408 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.609 1.045 -10.504 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.585 -0.416 -10.218 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.021 1.115 -9.423 1.00 0.00 H new ATOM 1924 N GLY A 126 8.509 3.204 -11.173 1.00 0.00 N ATOM 1925 CA GLY A 126 8.621 4.640 -11.324 1.00 0.00 C ATOM 1926 C GLY A 126 7.883 5.386 -10.234 1.00 0.00 C ATOM 1927 O GLY A 126 7.366 6.482 -10.456 1.00 0.00 O ATOM 0 H GLY A 126 9.251 2.773 -10.621 1.00 0.00 H new ATOM 0 HA2 GLY A 126 9.673 4.925 -11.309 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.225 4.934 -12.296 1.00 0.00 H new ATOM 1931 N PHE A 127 7.838 4.795 -9.048 1.00 0.00 N ATOM 1932 CA PHE A 127 7.132 5.395 -7.927 1.00 0.00 C ATOM 1933 C PHE A 127 7.931 6.543 -7.324 1.00 0.00 C ATOM 1934 O PHE A 127 9.162 6.568 -7.397 1.00 0.00 O ATOM 1935 CB PHE A 127 6.832 4.350 -6.852 1.00 0.00 C ATOM 1936 CG PHE A 127 5.790 3.343 -7.253 1.00 0.00 C ATOM 1937 CD1 PHE A 127 4.611 3.751 -7.858 1.00 0.00 C ATOM 1938 CD2 PHE A 127 5.979 1.994 -7.010 1.00 0.00 C ATOM 1939 CE1 PHE A 127 3.643 2.832 -8.214 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.015 1.069 -7.365 1.00 0.00 C ATOM 1941 CZ PHE A 127 3.846 1.489 -7.968 1.00 0.00 C ATOM 0 H PHE A 127 8.282 3.901 -8.838 1.00 0.00 H new ATOM 0 HA PHE A 127 6.190 5.791 -8.307 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.754 3.824 -6.603 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.501 4.859 -5.947 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.447 4.801 -8.053 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.891 1.660 -6.537 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.729 3.164 -8.684 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.176 0.019 -7.171 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.092 0.768 -8.247 1.00 0.00 H new ATOM 1951 N LYS A 128 7.218 7.490 -6.733 1.00 0.00 N ATOM 1952 CA LYS A 128 7.839 8.627 -6.076 1.00 0.00 C ATOM 1953 C LYS A 128 8.058 8.328 -4.599 1.00 0.00 C ATOM 1954 O LYS A 128 7.097 8.189 -3.838 1.00 0.00 O ATOM 1955 CB LYS A 128 6.958 9.870 -6.223 1.00 0.00 C ATOM 1956 CG LYS A 128 7.489 11.080 -5.473 1.00 0.00 C ATOM 1957 CD LYS A 128 6.460 12.193 -5.408 1.00 0.00 C ATOM 1958 CE LYS A 128 6.951 13.342 -4.547 1.00 0.00 C ATOM 1959 NZ LYS A 128 5.920 14.398 -4.389 1.00 0.00 N ATOM 0 H LYS A 128 6.199 7.491 -6.696 1.00 0.00 H new ATOM 0 HA LYS A 128 8.803 8.814 -6.549 1.00 0.00 H new ATOM 0 HB2 LYS A 128 6.867 10.119 -7.280 1.00 0.00 H new ATOM 0 HB3 LYS A 128 5.955 9.640 -5.863 1.00 0.00 H new ATOM 0 HG2 LYS A 128 7.773 10.787 -4.462 1.00 0.00 H new ATOM 0 HG3 LYS A 128 8.391 11.446 -5.964 1.00 0.00 H new ATOM 0 HD2 LYS A 128 6.246 12.554 -6.414 1.00 0.00 H new ATOM 0 HD3 LYS A 128 5.525 11.805 -5.003 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.236 12.964 -3.565 1.00 0.00 H new ATOM 0 HE3 LYS A 128 7.846 13.773 -4.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 6.296 15.164 -3.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.666 14.778 -5.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.075 13.993 -3.939 1.00 0.00 H new ATOM 1973 N GLU A 129 9.318 8.217 -4.204 1.00 0.00 N ATOM 1974 CA GLU A 129 9.662 7.973 -2.812 1.00 0.00 C ATOM 1975 C GLU A 129 9.370 9.200 -1.958 1.00 0.00 C ATOM 1976 O GLU A 129 9.665 10.333 -2.349 1.00 0.00 O ATOM 1977 CB GLU A 129 11.135 7.583 -2.673 1.00 0.00 C ATOM 1978 CG GLU A 129 11.461 6.211 -3.234 1.00 0.00 C ATOM 1979 CD GLU A 129 12.898 5.807 -2.974 1.00 0.00 C ATOM 1980 OE1 GLU A 129 13.353 5.928 -1.815 1.00 0.00 O ATOM 1981 OE2 GLU A 129 13.582 5.371 -3.923 1.00 0.00 O ATOM 0 H GLU A 129 10.120 8.292 -4.830 1.00 0.00 H new ATOM 0 HA GLU A 129 9.046 7.145 -2.460 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.748 8.328 -3.181 1.00 0.00 H new ATOM 0 HB3 GLU A 129 11.410 7.609 -1.619 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.793 5.472 -2.791 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.274 6.207 -4.308 1.00 0.00 H new ATOM 1988 N VAL A 130 8.790 8.964 -0.793 1.00 0.00 N ATOM 1989 CA VAL A 130 8.468 10.025 0.146 1.00 0.00 C ATOM 1990 C VAL A 130 9.059 9.694 1.512 1.00 0.00 C ATOM 1991 O VAL A 130 8.390 9.125 2.372 1.00 0.00 O ATOM 1992 CB VAL A 130 6.940 10.227 0.291 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.631 11.423 1.181 1.00 0.00 C ATOM 1994 CG2 VAL A 130 6.279 10.386 -1.068 1.00 0.00 C ATOM 0 H VAL A 130 8.529 8.032 -0.472 1.00 0.00 H new ATOM 0 HA VAL A 130 8.896 10.949 -0.242 1.00 0.00 H new ATOM 0 HB VAL A 130 6.530 9.335 0.765 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.551 11.543 1.267 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.058 11.260 2.171 1.00 0.00 H new ATOM 0 HG13 VAL A 130 7.063 12.323 0.744 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.206 10.526 -0.937 1.00 0.00 H new ATOM 0 HG22 VAL A 130 6.699 11.253 -1.577 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.457 9.492 -1.666 1.00 0.00 H new ATOM 2004 N LYS A 131 10.329 10.012 1.691 1.00 0.00 N ATOM 2005 CA LYS A 131 11.005 9.751 2.951 1.00 0.00 C ATOM 2006 C LYS A 131 10.430 10.660 4.034 1.00 0.00 C ATOM 2007 O LYS A 131 10.453 11.886 3.903 1.00 0.00 O ATOM 2008 CB LYS A 131 12.513 9.964 2.794 1.00 0.00 C ATOM 2009 CG LYS A 131 13.161 8.989 1.817 1.00 0.00 C ATOM 2010 CD LYS A 131 14.647 9.265 1.646 1.00 0.00 C ATOM 2011 CE LYS A 131 15.333 8.184 0.816 1.00 0.00 C ATOM 2012 NZ LYS A 131 14.816 8.121 -0.578 1.00 0.00 N ATOM 0 H LYS A 131 10.914 10.451 0.980 1.00 0.00 H new ATOM 0 HA LYS A 131 10.843 8.714 3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 131 12.696 10.983 2.454 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.991 9.863 3.768 1.00 0.00 H new ATOM 0 HG2 LYS A 131 13.019 7.969 2.174 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.664 9.060 0.849 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.784 10.234 1.165 1.00 0.00 H new ATOM 0 HD3 LYS A 131 15.120 9.326 2.626 1.00 0.00 H new ATOM 0 HE2 LYS A 131 16.406 8.374 0.794 1.00 0.00 H new ATOM 0 HE3 LYS A 131 15.191 7.216 1.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 14.326 7.216 -0.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 14.151 8.905 -0.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 15.609 8.198 -1.246 1.00 0.00 H new ATOM 2026 N LEU A 132 9.898 10.053 5.087 1.00 0.00 N ATOM 2027 CA LEU A 132 9.181 10.792 6.118 1.00 0.00 C ATOM 2028 C LEU A 132 10.146 11.602 6.974 1.00 0.00 C ATOM 2029 O LEU A 132 10.827 11.057 7.842 1.00 0.00 O ATOM 2030 CB LEU A 132 8.363 9.851 7.020 1.00 0.00 C ATOM 2031 CG LEU A 132 7.636 8.694 6.324 1.00 0.00 C ATOM 2032 CD1 LEU A 132 8.583 7.528 6.069 1.00 0.00 C ATOM 2033 CD2 LEU A 132 6.448 8.242 7.160 1.00 0.00 C ATOM 0 H LEU A 132 9.950 9.047 5.250 1.00 0.00 H new ATOM 0 HA LEU A 132 8.495 11.470 5.609 1.00 0.00 H new ATOM 0 HB2 LEU A 132 9.033 9.431 7.770 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.622 10.448 7.552 1.00 0.00 H new ATOM 0 HG LEU A 132 7.273 9.049 5.360 1.00 0.00 H new ATOM 0 HD11 LEU A 132 8.042 6.721 5.575 1.00 0.00 H new ATOM 0 HD12 LEU A 132 9.404 7.858 5.432 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.982 7.169 7.018 1.00 0.00 H new ATOM 0 HD21 LEU A 132 5.940 7.420 6.656 1.00 0.00 H new ATOM 0 HD22 LEU A 132 6.797 7.908 8.137 1.00 0.00 H new ATOM 0 HD23 LEU A 132 5.755 9.074 7.287 1.00 0.00 H new ATOM 2045 N GLU A 133 10.208 12.899 6.719 1.00 0.00 N ATOM 2046 CA GLU A 133 11.058 13.793 7.490 1.00 0.00 C ATOM 2047 C GLU A 133 10.227 14.532 8.532 1.00 0.00 C ATOM 2048 O GLU A 133 10.699 15.465 9.180 1.00 0.00 O ATOM 2049 CB GLU A 133 11.759 14.785 6.562 1.00 0.00 C ATOM 2050 CG GLU A 133 12.683 14.122 5.553 1.00 0.00 C ATOM 2051 CD GLU A 133 13.298 15.111 4.590 1.00 0.00 C ATOM 2052 OE1 GLU A 133 12.674 15.400 3.545 1.00 0.00 O ATOM 2053 OE2 GLU A 133 14.413 15.609 4.864 1.00 0.00 O ATOM 0 H GLU A 133 9.677 13.359 5.980 1.00 0.00 H new ATOM 0 HA GLU A 133 11.818 13.205 8.004 1.00 0.00 H new ATOM 0 HB2 GLU A 133 11.006 15.365 6.028 1.00 0.00 H new ATOM 0 HB3 GLU A 133 12.335 15.488 7.163 1.00 0.00 H new ATOM 0 HG2 GLU A 133 13.477 13.596 6.084 1.00 0.00 H new ATOM 0 HG3 GLU A 133 12.124 13.373 4.991 1.00 0.00 H new ATOM 2060 N HIS A 134 8.985 14.090 8.689 1.00 0.00 N ATOM 2061 CA HIS A 134 8.054 14.694 9.633 1.00 0.00 C ATOM 2062 C HIS A 134 7.512 13.636 10.587 1.00 0.00 C ATOM 2063 O HIS A 134 7.303 12.488 10.195 1.00 0.00 O ATOM 2064 CB HIS A 134 6.886 15.357 8.892 1.00 0.00 C ATOM 2065 CG HIS A 134 7.268 16.566 8.090 1.00 0.00 C ATOM 2066 ND1 HIS A 134 7.693 16.501 6.778 1.00 0.00 N ATOM 2067 CD2 HIS A 134 7.265 17.880 8.416 1.00 0.00 C ATOM 2068 CE1 HIS A 134 7.934 17.721 6.336 1.00 0.00 C ATOM 2069 NE2 HIS A 134 7.681 18.577 7.309 1.00 0.00 N ATOM 0 H HIS A 134 8.596 13.305 8.167 1.00 0.00 H new ATOM 0 HA HIS A 134 8.591 15.454 10.200 1.00 0.00 H new ATOM 0 HB2 HIS A 134 6.430 14.624 8.227 1.00 0.00 H new ATOM 0 HB3 HIS A 134 6.126 15.643 9.619 1.00 0.00 H new ATOM 0 HD2 HIS A 134 6.987 18.302 9.370 1.00 0.00 H new ATOM 0 HE1 HIS A 134 8.280 17.976 5.345 1.00 0.00 H new ATOM 0 HE2 HIS A 134 7.779 19.590 7.248 1.00 0.00 H new ATOM 2078 N HIS A 135 7.294 14.020 11.836 1.00 0.00 N ATOM 2079 CA HIS A 135 6.729 13.109 12.825 1.00 0.00 C ATOM 2080 C HIS A 135 5.242 13.388 13.006 1.00 0.00 C ATOM 2081 O HIS A 135 4.768 14.481 12.699 1.00 0.00 O ATOM 2082 CB HIS A 135 7.438 13.251 14.177 1.00 0.00 C ATOM 2083 CG HIS A 135 8.903 12.935 14.146 1.00 0.00 C ATOM 2084 ND1 HIS A 135 9.872 13.863 14.452 1.00 0.00 N ATOM 2085 CD2 HIS A 135 9.563 11.784 13.871 1.00 0.00 C ATOM 2086 CE1 HIS A 135 11.062 13.303 14.363 1.00 0.00 C ATOM 2087 NE2 HIS A 135 10.905 12.039 14.014 1.00 0.00 N ATOM 0 H HIS A 135 7.499 14.954 12.190 1.00 0.00 H new ATOM 0 HA HIS A 135 6.871 12.092 12.461 1.00 0.00 H new ATOM 0 HB2 HIS A 135 7.307 14.272 14.537 1.00 0.00 H new ATOM 0 HB3 HIS A 135 6.952 12.594 14.899 1.00 0.00 H new ATOM 0 HD2 HIS A 135 9.117 10.841 13.591 1.00 0.00 H new ATOM 0 HE1 HIS A 135 12.006 13.795 14.545 1.00 0.00 H new ATOM 0 HE2 HIS A 135 11.656 11.364 13.874 1.00 0.00 H new ATOM 2096 N HIS A 136 4.509 12.403 13.502 1.00 0.00 N ATOM 2097 CA HIS A 136 3.088 12.580 13.777 1.00 0.00 C ATOM 2098 C HIS A 136 2.850 12.808 15.261 1.00 0.00 C ATOM 2099 O HIS A 136 1.756 13.194 15.676 1.00 0.00 O ATOM 2100 CB HIS A 136 2.275 11.378 13.287 1.00 0.00 C ATOM 2101 CG HIS A 136 1.915 11.454 11.835 1.00 0.00 C ATOM 2102 ND1 HIS A 136 2.321 10.524 10.903 1.00 0.00 N ATOM 2103 CD2 HIS A 136 1.161 12.354 11.161 1.00 0.00 C ATOM 2104 CE1 HIS A 136 1.834 10.851 9.719 1.00 0.00 C ATOM 2105 NE2 HIS A 136 1.125 11.957 9.849 1.00 0.00 N ATOM 0 H HIS A 136 4.871 11.475 13.722 1.00 0.00 H new ATOM 0 HA HIS A 136 2.753 13.462 13.231 1.00 0.00 H new ATOM 0 HB2 HIS A 136 2.845 10.466 13.465 1.00 0.00 H new ATOM 0 HB3 HIS A 136 1.361 11.302 13.877 1.00 0.00 H new ATOM 0 HD2 HIS A 136 0.677 13.224 11.579 1.00 0.00 H new ATOM 0 HE1 HIS A 136 1.990 10.306 8.800 1.00 0.00 H new ATOM 0 HE2 HIS A 136 0.631 12.437 9.097 1.00 0.00 H new ATOM 2114 N HIS A 137 3.882 12.570 16.059 1.00 0.00 N ATOM 2115 CA HIS A 137 3.811 12.814 17.494 1.00 0.00 C ATOM 2116 C HIS A 137 3.976 14.298 17.783 1.00 0.00 C ATOM 2117 O HIS A 137 5.017 14.882 17.480 1.00 0.00 O ATOM 2118 CB HIS A 137 4.889 12.021 18.240 1.00 0.00 C ATOM 2119 CG HIS A 137 4.566 10.569 18.432 1.00 0.00 C ATOM 2120 ND1 HIS A 137 4.696 9.930 19.646 1.00 0.00 N ATOM 2121 CD2 HIS A 137 4.129 9.628 17.560 1.00 0.00 C ATOM 2122 CE1 HIS A 137 4.355 8.663 19.515 1.00 0.00 C ATOM 2123 NE2 HIS A 137 4.006 8.453 18.261 1.00 0.00 N ATOM 0 H HIS A 137 4.779 12.208 15.737 1.00 0.00 H new ATOM 0 HA HIS A 137 2.833 12.484 17.844 1.00 0.00 H new ATOM 0 HB2 HIS A 137 5.828 12.103 17.692 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.049 12.478 19.217 1.00 0.00 H new ATOM 0 HD2 HIS A 137 3.917 9.774 16.511 1.00 0.00 H new ATOM 0 HE1 HIS A 137 4.361 7.923 20.301 1.00 0.00 H new ATOM 0 HE2 HIS A 137 3.695 7.562 17.874 1.00 0.00 H new ATOM 2132 N HIS A 138 2.951 14.906 18.361 1.00 0.00 N ATOM 2133 CA HIS A 138 3.001 16.323 18.695 1.00 0.00 C ATOM 2134 C HIS A 138 2.166 16.599 19.935 1.00 0.00 C ATOM 2135 O HIS A 138 1.399 15.742 20.378 1.00 0.00 O ATOM 2136 CB HIS A 138 2.496 17.191 17.526 1.00 0.00 C ATOM 2137 CG HIS A 138 0.999 17.209 17.359 1.00 0.00 C ATOM 2138 ND1 HIS A 138 0.176 18.083 18.040 1.00 0.00 N ATOM 2139 CD2 HIS A 138 0.182 16.461 16.579 1.00 0.00 C ATOM 2140 CE1 HIS A 138 -1.077 17.865 17.692 1.00 0.00 C ATOM 2141 NE2 HIS A 138 -1.102 16.889 16.807 1.00 0.00 N ATOM 0 H HIS A 138 2.077 14.443 18.608 1.00 0.00 H new ATOM 0 HA HIS A 138 4.041 16.583 18.891 1.00 0.00 H new ATOM 0 HB2 HIS A 138 2.844 18.213 17.673 1.00 0.00 H new ATOM 0 HB3 HIS A 138 2.947 16.830 16.602 1.00 0.00 H new ATOM 0 HD1 HIS A 138 0.488 18.788 18.708 1.00 0.00 H new ATOM 0 HD2 HIS A 138 0.485 15.674 15.904 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -1.938 18.397 18.069 1.00 0.00 H new ATOM 2150 N HIS A 139 2.314 17.791 20.483 1.00 0.00 N ATOM 2151 CA HIS A 139 1.463 18.248 21.568 1.00 0.00 C ATOM 2152 C HIS A 139 0.980 19.654 21.259 1.00 0.00 C ATOM 2153 O HIS A 139 1.468 20.608 21.897 1.00 0.00 O ATOM 2154 CB HIS A 139 2.201 18.219 22.911 1.00 0.00 C ATOM 2155 CG HIS A 139 2.541 16.843 23.389 1.00 0.00 C ATOM 2156 ND1 HIS A 139 3.808 16.310 23.311 1.00 0.00 N ATOM 2157 CD2 HIS A 139 1.768 15.885 23.952 1.00 0.00 C ATOM 2158 CE1 HIS A 139 3.800 15.087 23.806 1.00 0.00 C ATOM 2159 NE2 HIS A 139 2.574 14.805 24.202 1.00 0.00 N ATOM 2160 OXT HIS A 139 0.145 19.800 20.340 1.00 0.00 O ATOM 0 H HIS A 139 3.021 18.466 20.192 1.00 0.00 H new ATOM 0 HA HIS A 139 0.611 17.574 21.652 1.00 0.00 H new ATOM 0 HB2 HIS A 139 3.120 18.799 22.822 1.00 0.00 H new ATOM 0 HB3 HIS A 139 1.585 18.712 23.663 1.00 0.00 H new ATOM 0 HD2 HIS A 139 0.712 15.958 24.165 1.00 0.00 H new ATOM 0 HE1 HIS A 139 4.653 14.428 23.875 1.00 0.00 H new ATOM 0 HE2 HIS A 139 2.275 13.927 24.625 1.00 0.00 H new TER 2169 HIS A 139