USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 944 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 -94:sc= 1.2 USER MOD Set 1.2: A 117 GLN : amide:sc= 1.87 K(o=3.1,f=0.74) USER MOD Set 2.1: A 74 THR OG1 : rot -80:sc= -0.811! USER MOD Set 2.2: A 81 GLN : amide:sc= -0.606 X(o=-0.52,f=-0.64) USER MOD Set 2.3: A 83 ASN : amide:sc= 0.899 X(o=-0.52,f=-0.7) USER MOD Set 3.1: A 9 LYS NZ :NH3+ -170:sc= 0.498 (180deg=-0.301) USER MOD Set 3.2: A 22 THR OG1 : rot 119:sc= -1.12! USER MOD Single : A 7 SER OG : rot 180:sc= -0.061 USER MOD Single : A 8 LYS NZ :NH3+ 151:sc= 2.43 (180deg=1.12) USER MOD Single : A 11 SER OG : rot 27:sc= 0.251 USER MOD Single : A 13 ASN : amide:sc= -2.8! K(o=-2.8!,f=-1) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.0262 USER MOD Single : A 23 TYR OH : rot 180:sc= -0.0208 USER MOD Single : A 25 TYR OH : rot 17:sc= 0.879 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.1) USER MOD Single : A 32 LYS NZ :NH3+ -139:sc= 1.21 (180deg=1.02) USER MOD Single : A 33 GLN : amide:sc= -1 X(o=-1,f=-0.89) USER MOD Single : A 34 SER OG : rot 87:sc= 0.00891 USER MOD Single : A 35 SER OG : rot 180:sc= -0.0103 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.12) USER MOD Single : A 40 GLN : amide:sc= -1.12 X(o=-1.1,f=-1.2) USER MOD Single : A 43 SER OG : rot -153:sc= 0.0715 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc=-0.00264 USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= -0.0308 (180deg=-0.201) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 80:sc= 0.955 USER MOD Single : A 60 SER OG : rot 12:sc= 0.402 USER MOD Single : A 62 LYS NZ :NH3+ -168:sc= -0.0299 (180deg=-0.217) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 147:sc= -1.37 (180deg=-1.96!) USER MOD Single : A 65 ASN : amide:sc= -0.488 X(o=-0.49,f=-0.32) USER MOD Single : A 72 LYS NZ :NH3+ -170:sc=-0.00774 (180deg=-0.117) USER MOD Single : A 75 TYR OH : rot 14:sc= -0.434 USER MOD Single : A 76 THR OG1 : rot 106:sc= 1.9 USER MOD Single : A 78 THR OG1 : rot -25:sc= 0.641 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl 139:sc= -0.0695 (180deg=-2.55!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -132:sc= -0.346 (180deg=-2.04!) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 110 LYS NZ :NH3+ 169:sc=-0.00212 (180deg=-0.147) USER MOD Single : A 111 LYS NZ :NH3+ 175:sc= 1.28 (180deg=1.23) USER MOD Single : A 115 MET CE :methyl -112:sc= -0.353 (180deg=-1.48) USER MOD Single : A 118 MET CE :methyl 142:sc= -2.82! (180deg=-5.63!) USER MOD Single : A 122 MET CE :methyl -178:sc= -3.73! (180deg=-3.77!) USER MOD Single : A 123 LYS NZ :NH3+ -167:sc= -0.0137 (180deg=-0.161) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 162:sc= -0.0365 (180deg=-0.294) USER MOD ----------------------------------------------------------------- ATOM 61 N GLU A 5 15.782 -1.173 12.076 1.00 0.00 N ATOM 62 CA GLU A 5 14.360 -1.039 11.757 1.00 0.00 C ATOM 63 C GLU A 5 14.044 0.381 11.287 1.00 0.00 C ATOM 64 O GLU A 5 14.004 1.323 12.084 1.00 0.00 O ATOM 65 CB GLU A 5 13.496 -1.416 12.962 1.00 0.00 C ATOM 66 CG GLU A 5 12.007 -1.450 12.671 1.00 0.00 C ATOM 67 CD GLU A 5 11.191 -1.696 13.918 1.00 0.00 C ATOM 68 OE1 GLU A 5 11.272 -2.809 14.472 1.00 0.00 O ATOM 69 OE2 GLU A 5 10.491 -0.768 14.371 1.00 0.00 O ATOM 0 HA GLU A 5 14.127 -1.727 10.944 1.00 0.00 H new ATOM 0 HB2 GLU A 5 13.807 -2.395 13.326 1.00 0.00 H new ATOM 0 HB3 GLU A 5 13.682 -0.704 13.766 1.00 0.00 H new ATOM 0 HG2 GLU A 5 11.704 -0.505 12.221 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.798 -2.232 11.941 1.00 0.00 H new ATOM 76 N GLU A 6 13.807 0.527 9.992 1.00 0.00 N ATOM 77 CA GLU A 6 13.618 1.839 9.402 1.00 0.00 C ATOM 78 C GLU A 6 12.360 1.864 8.548 1.00 0.00 C ATOM 79 O GLU A 6 12.003 0.865 7.916 1.00 0.00 O ATOM 80 CB GLU A 6 14.830 2.227 8.551 1.00 0.00 C ATOM 81 CG GLU A 6 14.783 3.663 8.054 1.00 0.00 C ATOM 82 CD GLU A 6 15.840 3.959 7.013 1.00 0.00 C ATOM 83 OE1 GLU A 6 17.035 3.997 7.358 1.00 0.00 O ATOM 84 OE2 GLU A 6 15.474 4.149 5.832 1.00 0.00 O ATOM 0 H GLU A 6 13.741 -0.248 9.332 1.00 0.00 H new ATOM 0 HA GLU A 6 13.510 2.561 10.211 1.00 0.00 H new ATOM 0 HB2 GLU A 6 15.738 2.083 9.137 1.00 0.00 H new ATOM 0 HB3 GLU A 6 14.893 1.556 7.695 1.00 0.00 H new ATOM 0 HG2 GLU A 6 13.798 3.864 7.632 1.00 0.00 H new ATOM 0 HG3 GLU A 6 14.913 4.339 8.899 1.00 0.00 H new ATOM 91 N SER A 7 11.692 3.001 8.541 1.00 0.00 N ATOM 92 CA SER A 7 10.492 3.182 7.750 1.00 0.00 C ATOM 93 C SER A 7 10.833 3.863 6.426 1.00 0.00 C ATOM 94 O SER A 7 11.506 4.899 6.397 1.00 0.00 O ATOM 95 CB SER A 7 9.476 4.014 8.537 1.00 0.00 C ATOM 96 OG SER A 7 8.235 4.098 7.858 1.00 0.00 O ATOM 0 H SER A 7 11.965 3.822 9.081 1.00 0.00 H new ATOM 0 HA SER A 7 10.055 2.208 7.532 1.00 0.00 H new ATOM 0 HB2 SER A 7 9.324 3.569 9.521 1.00 0.00 H new ATOM 0 HB3 SER A 7 9.872 5.017 8.698 1.00 0.00 H new ATOM 0 HG SER A 7 7.608 4.634 8.387 1.00 0.00 H new ATOM 102 N LYS A 8 10.372 3.275 5.330 1.00 0.00 N ATOM 103 CA LYS A 8 10.561 3.872 4.023 1.00 0.00 C ATOM 104 C LYS A 8 9.203 4.280 3.465 1.00 0.00 C ATOM 105 O LYS A 8 8.439 3.459 2.960 1.00 0.00 O ATOM 106 CB LYS A 8 11.263 2.899 3.062 1.00 0.00 C ATOM 107 CG LYS A 8 11.592 3.517 1.709 1.00 0.00 C ATOM 108 CD LYS A 8 12.635 4.617 1.833 1.00 0.00 C ATOM 109 CE LYS A 8 14.055 4.074 1.732 1.00 0.00 C ATOM 110 NZ LYS A 8 14.447 3.789 0.325 1.00 0.00 N ATOM 0 H LYS A 8 9.867 2.389 5.324 1.00 0.00 H new ATOM 0 HA LYS A 8 11.199 4.750 4.124 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.184 2.544 3.525 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.626 2.027 2.910 1.00 0.00 H new ATOM 0 HG2 LYS A 8 11.958 2.743 1.034 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.684 3.925 1.264 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.474 5.358 1.050 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.510 5.129 2.787 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.750 4.795 2.162 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.136 3.161 2.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.476 3.902 0.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.180 2.814 0.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.960 4.451 -0.312 1.00 0.00 H new ATOM 124 N LYS A 9 8.904 5.562 3.605 1.00 0.00 N ATOM 125 CA LYS A 9 7.619 6.101 3.195 1.00 0.00 C ATOM 126 C LYS A 9 7.707 6.686 1.795 1.00 0.00 C ATOM 127 O LYS A 9 8.340 7.722 1.588 1.00 0.00 O ATOM 128 CB LYS A 9 7.179 7.187 4.181 1.00 0.00 C ATOM 129 CG LYS A 9 5.760 7.692 3.968 1.00 0.00 C ATOM 130 CD LYS A 9 5.430 8.809 4.945 1.00 0.00 C ATOM 131 CE LYS A 9 3.943 9.111 4.963 1.00 0.00 C ATOM 132 NZ LYS A 9 3.156 7.983 5.527 1.00 0.00 N ATOM 0 H LYS A 9 9.540 6.253 4.003 1.00 0.00 H new ATOM 0 HA LYS A 9 6.887 5.293 3.189 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.264 6.796 5.195 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.867 8.029 4.105 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.648 8.053 2.946 1.00 0.00 H new ATOM 0 HG3 LYS A 9 5.054 6.871 4.096 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.757 8.527 5.946 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.982 9.708 4.671 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.762 10.010 5.552 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.603 9.320 3.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.142 8.153 5.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 3.435 7.097 5.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 3.339 7.909 6.548 1.00 0.00 H new ATOM 146 N PHE A 10 7.095 6.015 0.834 1.00 0.00 N ATOM 147 CA PHE A 10 6.996 6.559 -0.507 1.00 0.00 C ATOM 148 C PHE A 10 5.529 6.807 -0.826 1.00 0.00 C ATOM 149 O PHE A 10 4.648 6.143 -0.276 1.00 0.00 O ATOM 150 CB PHE A 10 7.650 5.625 -1.543 1.00 0.00 C ATOM 151 CG PHE A 10 6.707 4.677 -2.240 1.00 0.00 C ATOM 152 CD1 PHE A 10 6.000 5.086 -3.362 1.00 0.00 C ATOM 153 CD2 PHE A 10 6.533 3.382 -1.783 1.00 0.00 C ATOM 154 CE1 PHE A 10 5.137 4.226 -4.008 1.00 0.00 C ATOM 155 CE2 PHE A 10 5.671 2.516 -2.429 1.00 0.00 C ATOM 156 CZ PHE A 10 4.971 2.941 -3.543 1.00 0.00 C ATOM 0 H PHE A 10 6.663 5.099 0.957 1.00 0.00 H new ATOM 0 HA PHE A 10 7.539 7.503 -0.556 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.147 6.236 -2.296 1.00 0.00 H new ATOM 0 HB3 PHE A 10 8.424 5.041 -1.044 1.00 0.00 H new ATOM 0 HD1 PHE A 10 6.127 6.092 -3.734 1.00 0.00 H new ATOM 0 HD2 PHE A 10 7.076 3.045 -0.913 1.00 0.00 H new ATOM 0 HE1 PHE A 10 4.592 4.560 -4.878 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.544 1.508 -2.064 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.295 2.266 -4.047 1.00 0.00 H new ATOM 166 N SER A 11 5.263 7.764 -1.691 1.00 0.00 N ATOM 167 CA SER A 11 3.900 8.080 -2.063 1.00 0.00 C ATOM 168 C SER A 11 3.851 8.569 -3.500 1.00 0.00 C ATOM 169 O SER A 11 4.622 9.443 -3.897 1.00 0.00 O ATOM 170 CB SER A 11 3.314 9.131 -1.116 1.00 0.00 C ATOM 171 OG SER A 11 1.938 9.349 -1.377 1.00 0.00 O ATOM 0 H SER A 11 5.972 8.336 -2.149 1.00 0.00 H new ATOM 0 HA SER A 11 3.297 7.175 -1.982 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.444 8.806 -0.084 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.860 10.068 -1.226 1.00 0.00 H new ATOM 0 HG SER A 11 1.548 8.541 -1.770 1.00 0.00 H new ATOM 177 N ALA A 12 2.955 7.991 -4.277 1.00 0.00 N ATOM 178 CA ALA A 12 2.801 8.362 -5.665 1.00 0.00 C ATOM 179 C ALA A 12 1.360 8.736 -5.953 1.00 0.00 C ATOM 180 O ALA A 12 0.458 7.899 -5.873 1.00 0.00 O ATOM 181 CB ALA A 12 3.250 7.227 -6.570 1.00 0.00 C ATOM 0 H ALA A 12 2.319 7.257 -3.964 1.00 0.00 H new ATOM 0 HA ALA A 12 3.429 9.230 -5.866 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.128 7.522 -7.612 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.299 7.001 -6.378 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.646 6.342 -6.370 1.00 0.00 H new ATOM 187 N ASN A 13 1.140 10.005 -6.253 1.00 0.00 N ATOM 188 CA ASN A 13 -0.177 10.471 -6.639 1.00 0.00 C ATOM 189 C ASN A 13 -0.401 10.191 -8.116 1.00 0.00 C ATOM 190 O ASN A 13 0.171 10.858 -8.982 1.00 0.00 O ATOM 191 CB ASN A 13 -0.328 11.968 -6.351 1.00 0.00 C ATOM 192 CG ASN A 13 -1.696 12.512 -6.734 1.00 0.00 C ATOM 193 OD1 ASN A 13 -1.821 13.664 -7.145 1.00 0.00 O ATOM 194 ND2 ASN A 13 -2.732 11.700 -6.589 1.00 0.00 N ATOM 0 H ASN A 13 1.858 10.729 -6.236 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.926 9.938 -6.054 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.156 12.147 -5.290 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.441 12.516 -6.896 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.671 12.025 -6.821 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.591 10.750 -6.245 1.00 0.00 H new ATOM 201 N LEU A 14 -1.205 9.180 -8.400 1.00 0.00 N ATOM 202 CA LEU A 14 -1.498 8.809 -9.772 1.00 0.00 C ATOM 203 C LEU A 14 -2.645 9.670 -10.288 1.00 0.00 C ATOM 204 O LEU A 14 -3.240 10.438 -9.527 1.00 0.00 O ATOM 205 CB LEU A 14 -1.871 7.322 -9.856 1.00 0.00 C ATOM 206 CG LEU A 14 -0.926 6.354 -9.127 1.00 0.00 C ATOM 207 CD1 LEU A 14 -1.452 4.931 -9.230 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.490 6.434 -9.685 1.00 0.00 C ATOM 0 H LEU A 14 -1.666 8.602 -7.697 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.614 8.974 -10.387 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -2.875 7.195 -9.450 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -1.914 7.036 -10.907 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.889 6.647 -8.078 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.774 4.254 -8.710 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -2.441 4.875 -8.775 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.518 4.643 -10.279 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.133 5.737 -9.147 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.479 6.175 -10.744 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.872 7.448 -9.563 1.00 0.00 H new ATOM 220 N ASN A 15 -2.964 9.544 -11.567 1.00 0.00 N ATOM 221 CA ASN A 15 -4.072 10.295 -12.156 1.00 0.00 C ATOM 222 C ASN A 15 -5.415 9.681 -11.765 1.00 0.00 C ATOM 223 O ASN A 15 -6.245 9.367 -12.619 1.00 0.00 O ATOM 224 CB ASN A 15 -3.939 10.355 -13.682 1.00 0.00 C ATOM 225 CG ASN A 15 -2.925 11.389 -14.140 1.00 0.00 C ATOM 226 OD1 ASN A 15 -3.269 12.547 -14.383 1.00 0.00 O ATOM 227 ND2 ASN A 15 -1.669 10.984 -14.255 1.00 0.00 N ATOM 0 H ASN A 15 -2.475 8.931 -12.219 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.032 11.312 -11.765 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.646 9.374 -14.056 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -4.911 10.586 -14.119 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -0.947 11.640 -14.554 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -1.424 10.017 -14.045 1.00 0.00 H new ATOM 234 N GLY A 16 -5.618 9.526 -10.465 1.00 0.00 N ATOM 235 CA GLY A 16 -6.837 8.938 -9.961 1.00 0.00 C ATOM 236 C GLY A 16 -6.736 8.607 -8.488 1.00 0.00 C ATOM 237 O GLY A 16 -7.554 9.058 -7.685 1.00 0.00 O ATOM 0 H GLY A 16 -4.950 9.801 -9.745 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.666 9.627 -10.122 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.062 8.031 -10.522 1.00 0.00 H new ATOM 241 N THR A 17 -5.722 7.834 -8.130 1.00 0.00 N ATOM 242 CA THR A 17 -5.535 7.401 -6.756 1.00 0.00 C ATOM 243 C THR A 17 -4.253 7.969 -6.153 1.00 0.00 C ATOM 244 O THR A 17 -3.255 8.160 -6.847 1.00 0.00 O ATOM 245 CB THR A 17 -5.495 5.867 -6.678 1.00 0.00 C ATOM 246 OG1 THR A 17 -4.685 5.346 -7.741 1.00 0.00 O ATOM 247 CG2 THR A 17 -6.895 5.281 -6.764 1.00 0.00 C ATOM 0 H THR A 17 -5.012 7.492 -8.778 1.00 0.00 H new ATOM 0 HA THR A 17 -6.381 7.778 -6.182 1.00 0.00 H new ATOM 0 HB THR A 17 -5.062 5.585 -5.718 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.662 4.368 -7.685 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.839 4.194 -6.706 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.498 5.657 -5.938 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.353 5.571 -7.709 1.00 0.00 H new ATOM 255 N GLU A 18 -4.293 8.255 -4.860 1.00 0.00 N ATOM 256 CA GLU A 18 -3.114 8.717 -4.144 1.00 0.00 C ATOM 257 C GLU A 18 -2.579 7.585 -3.275 1.00 0.00 C ATOM 258 O GLU A 18 -3.140 7.285 -2.221 1.00 0.00 O ATOM 259 CB GLU A 18 -3.451 9.934 -3.276 1.00 0.00 C ATOM 260 CG GLU A 18 -4.433 10.892 -3.933 1.00 0.00 C ATOM 261 CD GLU A 18 -4.549 12.214 -3.200 1.00 0.00 C ATOM 262 OE1 GLU A 18 -3.504 12.780 -2.820 1.00 0.00 O ATOM 263 OE2 GLU A 18 -5.686 12.698 -3.016 1.00 0.00 O ATOM 0 H GLU A 18 -5.131 8.175 -4.284 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.353 9.015 -4.866 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.868 9.591 -2.329 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.531 10.471 -3.044 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.119 11.078 -4.960 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.415 10.421 -3.980 1.00 0.00 H new ATOM 270 N ILE A 19 -1.517 6.937 -3.727 1.00 0.00 N ATOM 271 CA ILE A 19 -0.995 5.765 -3.038 1.00 0.00 C ATOM 272 C ILE A 19 0.186 6.122 -2.142 1.00 0.00 C ATOM 273 O ILE A 19 1.210 6.617 -2.611 1.00 0.00 O ATOM 274 CB ILE A 19 -0.573 4.668 -4.041 1.00 0.00 C ATOM 275 CG1 ILE A 19 -1.776 4.256 -4.895 1.00 0.00 C ATOM 276 CG2 ILE A 19 0.003 3.461 -3.311 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.488 3.135 -5.868 1.00 0.00 C ATOM 0 H ILE A 19 -1.000 7.201 -4.566 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.801 5.380 -2.413 1.00 0.00 H new ATOM 0 HB ILE A 19 0.204 5.069 -4.692 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.588 3.950 -4.236 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.127 5.125 -5.452 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.293 2.701 -4.037 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.877 3.767 -2.736 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.749 3.050 -2.637 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.390 2.903 -6.434 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.699 3.442 -6.554 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.167 2.250 -5.319 1.00 0.00 H new ATOM 289 N ALA A 20 0.024 5.887 -0.847 1.00 0.00 N ATOM 290 CA ALA A 20 1.100 6.081 0.109 1.00 0.00 C ATOM 291 C ALA A 20 1.494 4.757 0.735 1.00 0.00 C ATOM 292 O ALA A 20 0.762 4.212 1.556 1.00 0.00 O ATOM 293 CB ALA A 20 0.683 7.050 1.199 1.00 0.00 C ATOM 0 H ALA A 20 -0.850 5.560 -0.435 1.00 0.00 H new ATOM 0 HA ALA A 20 1.954 6.497 -0.426 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.504 7.180 1.904 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.431 8.012 0.753 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.186 6.655 1.724 1.00 0.00 H new ATOM 299 N ILE A 21 2.641 4.238 0.351 1.00 0.00 N ATOM 300 CA ILE A 21 3.111 2.992 0.913 1.00 0.00 C ATOM 301 C ILE A 21 4.295 3.241 1.835 1.00 0.00 C ATOM 302 O ILE A 21 5.404 3.551 1.396 1.00 0.00 O ATOM 303 CB ILE A 21 3.478 1.962 -0.172 1.00 0.00 C ATOM 304 CG1 ILE A 21 2.243 1.635 -1.017 1.00 0.00 C ATOM 305 CG2 ILE A 21 4.044 0.701 0.465 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.488 0.600 -2.095 1.00 0.00 C ATOM 0 H ILE A 21 3.260 4.657 -0.343 1.00 0.00 H new ATOM 0 HA ILE A 21 2.290 2.568 1.491 1.00 0.00 H new ATOM 0 HB ILE A 21 4.243 2.387 -0.822 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.450 1.278 -0.359 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.882 2.552 -1.484 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.299 -0.017 -0.314 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.939 0.951 1.034 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.300 0.265 1.132 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.565 0.425 -2.648 1.00 0.00 H new ATOM 0 HD12 ILE A 21 3.257 0.961 -2.778 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.818 -0.332 -1.636 1.00 0.00 H new ATOM 318 N THR A 22 4.024 3.138 3.119 1.00 0.00 N ATOM 319 CA THR A 22 5.027 3.315 4.142 1.00 0.00 C ATOM 320 C THR A 22 5.429 1.954 4.694 1.00 0.00 C ATOM 321 O THR A 22 4.754 1.403 5.569 1.00 0.00 O ATOM 322 CB THR A 22 4.476 4.196 5.278 1.00 0.00 C ATOM 323 OG1 THR A 22 3.797 5.329 4.711 1.00 0.00 O ATOM 324 CG2 THR A 22 5.589 4.670 6.197 1.00 0.00 C ATOM 0 H THR A 22 3.094 2.928 3.482 1.00 0.00 H new ATOM 0 HA THR A 22 5.899 3.806 3.709 1.00 0.00 H new ATOM 0 HB THR A 22 3.781 3.602 5.871 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.855 5.315 4.982 1.00 0.00 H new ATOM 0 HG21 THR A 22 5.168 5.290 6.989 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.089 3.808 6.638 1.00 0.00 H new ATOM 0 HG23 THR A 22 6.310 5.253 5.624 1.00 0.00 H new ATOM 332 N TYR A 23 6.491 1.383 4.153 1.00 0.00 N ATOM 333 CA TYR A 23 6.910 0.058 4.569 1.00 0.00 C ATOM 334 C TYR A 23 8.123 0.126 5.486 1.00 0.00 C ATOM 335 O TYR A 23 9.124 0.774 5.179 1.00 0.00 O ATOM 336 CB TYR A 23 7.171 -0.858 3.362 1.00 0.00 C ATOM 337 CG TYR A 23 8.164 -0.333 2.342 1.00 0.00 C ATOM 338 CD1 TYR A 23 7.743 0.453 1.276 1.00 0.00 C ATOM 339 CD2 TYR A 23 9.516 -0.641 2.434 1.00 0.00 C ATOM 340 CE1 TYR A 23 8.638 0.917 0.333 1.00 0.00 C ATOM 341 CE2 TYR A 23 10.418 -0.182 1.493 1.00 0.00 C ATOM 342 CZ TYR A 23 9.973 0.598 0.447 1.00 0.00 C ATOM 343 OH TYR A 23 10.868 1.054 -0.494 1.00 0.00 O ATOM 0 H TYR A 23 7.073 1.811 3.433 1.00 0.00 H new ATOM 0 HA TYR A 23 6.090 -0.381 5.137 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.529 -1.820 3.729 1.00 0.00 H new ATOM 0 HB3 TYR A 23 6.223 -1.043 2.857 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.697 0.705 1.184 1.00 0.00 H new ATOM 0 HD2 TYR A 23 9.868 -1.249 3.254 1.00 0.00 H new ATOM 0 HE1 TYR A 23 8.293 1.527 -0.489 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.465 -0.433 1.577 1.00 0.00 H new ATOM 0 HH TYR A 23 11.769 0.741 -0.267 1.00 0.00 H new ATOM 353 N VAL A 24 8.002 -0.528 6.628 1.00 0.00 N ATOM 354 CA VAL A 24 9.082 -0.608 7.590 1.00 0.00 C ATOM 355 C VAL A 24 9.859 -1.893 7.381 1.00 0.00 C ATOM 356 O VAL A 24 9.282 -2.986 7.337 1.00 0.00 O ATOM 357 CB VAL A 24 8.556 -0.553 9.042 1.00 0.00 C ATOM 358 CG1 VAL A 24 9.680 -0.784 10.041 1.00 0.00 C ATOM 359 CG2 VAL A 24 7.885 0.782 9.311 1.00 0.00 C ATOM 0 H VAL A 24 7.153 -1.017 6.912 1.00 0.00 H new ATOM 0 HA VAL A 24 9.734 0.252 7.434 1.00 0.00 H new ATOM 0 HB VAL A 24 7.822 -1.350 9.164 1.00 0.00 H new ATOM 0 HG11 VAL A 24 9.281 -0.740 11.054 1.00 0.00 H new ATOM 0 HG12 VAL A 24 10.124 -1.764 9.868 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.441 -0.014 9.917 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.520 0.805 10.338 1.00 0.00 H new ATOM 0 HG22 VAL A 24 8.605 1.587 9.163 1.00 0.00 H new ATOM 0 HG23 VAL A 24 7.048 0.913 8.625 1.00 0.00 H new ATOM 369 N TYR A 25 11.161 -1.763 7.236 1.00 0.00 N ATOM 370 CA TYR A 25 12.008 -2.914 7.022 1.00 0.00 C ATOM 371 C TYR A 25 13.014 -3.047 8.154 1.00 0.00 C ATOM 372 O TYR A 25 13.478 -2.051 8.712 1.00 0.00 O ATOM 373 CB TYR A 25 12.721 -2.820 5.666 1.00 0.00 C ATOM 374 CG TYR A 25 13.628 -1.614 5.512 1.00 0.00 C ATOM 375 CD1 TYR A 25 13.119 -0.377 5.135 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.997 -1.720 5.730 1.00 0.00 C ATOM 377 CE1 TYR A 25 13.946 0.721 4.985 1.00 0.00 C ATOM 378 CE2 TYR A 25 15.831 -0.629 5.577 1.00 0.00 C ATOM 379 CZ TYR A 25 15.302 0.587 5.206 1.00 0.00 C ATOM 380 OH TYR A 25 16.134 1.670 5.039 1.00 0.00 O ATOM 0 H TYR A 25 11.655 -0.871 7.263 1.00 0.00 H new ATOM 0 HA TYR A 25 11.382 -3.806 7.011 1.00 0.00 H new ATOM 0 HB2 TYR A 25 13.312 -3.724 5.518 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.970 -2.797 4.876 1.00 0.00 H new ATOM 0 HD1 TYR A 25 12.059 -0.271 4.956 1.00 0.00 H new ATOM 0 HD2 TYR A 25 15.416 -2.671 6.024 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.534 1.677 4.697 1.00 0.00 H new ATOM 0 HE2 TYR A 25 16.893 -0.730 5.748 1.00 0.00 H new ATOM 0 HH TYR A 25 15.602 2.493 5.033 1.00 0.00 H new ATOM 390 N LYS A 26 13.335 -4.278 8.498 1.00 0.00 N ATOM 391 CA LYS A 26 14.295 -4.548 9.547 1.00 0.00 C ATOM 392 C LYS A 26 15.483 -5.291 8.953 1.00 0.00 C ATOM 393 O LYS A 26 15.464 -6.516 8.817 1.00 0.00 O ATOM 394 CB LYS A 26 13.645 -5.360 10.671 1.00 0.00 C ATOM 395 CG LYS A 26 14.540 -5.577 11.881 1.00 0.00 C ATOM 396 CD LYS A 26 13.834 -6.386 12.961 1.00 0.00 C ATOM 397 CE LYS A 26 12.638 -5.639 13.537 1.00 0.00 C ATOM 398 NZ LYS A 26 11.934 -6.431 14.579 1.00 0.00 N ATOM 0 H LYS A 26 12.941 -5.112 8.062 1.00 0.00 H new ATOM 0 HA LYS A 26 14.642 -3.609 9.977 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.736 -4.852 10.992 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.345 -6.331 10.276 1.00 0.00 H new ATOM 0 HG2 LYS A 26 15.449 -6.094 11.574 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.844 -4.612 12.288 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.502 -7.337 12.544 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.538 -6.617 13.761 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.973 -4.694 13.965 1.00 0.00 H new ATOM 0 HE3 LYS A 26 11.942 -5.396 12.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.127 -5.885 14.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.591 -7.322 14.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 12.590 -6.641 15.358 1.00 0.00 H new ATOM 412 N GLY A 27 16.495 -4.535 8.559 1.00 0.00 N ATOM 413 CA GLY A 27 17.646 -5.122 7.915 1.00 0.00 C ATOM 414 C GLY A 27 17.412 -5.321 6.435 1.00 0.00 C ATOM 415 O GLY A 27 17.144 -4.362 5.711 1.00 0.00 O ATOM 0 H GLY A 27 16.538 -3.523 8.675 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.514 -4.480 8.064 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.875 -6.081 8.380 1.00 0.00 H new ATOM 419 N ASP A 28 17.482 -6.564 5.986 1.00 0.00 N ATOM 420 CA ASP A 28 17.309 -6.873 4.571 1.00 0.00 C ATOM 421 C ASP A 28 15.894 -7.363 4.281 1.00 0.00 C ATOM 422 O ASP A 28 15.575 -7.724 3.148 1.00 0.00 O ATOM 423 CB ASP A 28 18.328 -7.927 4.120 1.00 0.00 C ATOM 424 CG ASP A 28 18.095 -9.285 4.754 1.00 0.00 C ATOM 425 OD1 ASP A 28 18.462 -9.464 5.937 1.00 0.00 O ATOM 426 OD2 ASP A 28 17.558 -10.182 4.071 1.00 0.00 O ATOM 0 H ASP A 28 17.657 -7.376 6.578 1.00 0.00 H new ATOM 0 HA ASP A 28 17.476 -5.953 4.010 1.00 0.00 H new ATOM 0 HB2 ASP A 28 18.284 -8.026 3.035 1.00 0.00 H new ATOM 0 HB3 ASP A 28 19.332 -7.583 4.368 1.00 0.00 H new ATOM 431 N LYS A 29 15.041 -7.365 5.295 1.00 0.00 N ATOM 432 CA LYS A 29 13.675 -7.840 5.123 1.00 0.00 C ATOM 433 C LYS A 29 12.665 -6.758 5.483 1.00 0.00 C ATOM 434 O LYS A 29 12.789 -6.102 6.517 1.00 0.00 O ATOM 435 CB LYS A 29 13.416 -9.077 5.987 1.00 0.00 C ATOM 436 CG LYS A 29 12.118 -9.786 5.637 1.00 0.00 C ATOM 437 CD LYS A 29 11.905 -11.031 6.480 1.00 0.00 C ATOM 438 CE LYS A 29 10.582 -11.701 6.146 1.00 0.00 C ATOM 439 NZ LYS A 29 10.559 -12.238 4.758 1.00 0.00 N ATOM 0 H LYS A 29 15.267 -7.046 6.237 1.00 0.00 H new ATOM 0 HA LYS A 29 13.554 -8.101 4.072 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.246 -9.774 5.872 1.00 0.00 H new ATOM 0 HB3 LYS A 29 13.391 -8.782 7.036 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.281 -9.103 5.782 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.127 -10.060 4.582 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.723 -11.731 6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.925 -10.766 7.537 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.399 -12.512 6.851 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.771 -10.983 6.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.713 -12.829 4.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.537 -11.449 4.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.411 -12.811 4.593 1.00 0.00 H new ATOM 453 N VAL A 30 11.671 -6.574 4.624 1.00 0.00 N ATOM 454 CA VAL A 30 10.554 -5.692 4.928 1.00 0.00 C ATOM 455 C VAL A 30 9.532 -6.472 5.745 1.00 0.00 C ATOM 456 O VAL A 30 9.214 -7.612 5.409 1.00 0.00 O ATOM 457 CB VAL A 30 9.889 -5.148 3.645 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.861 -4.081 3.981 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.935 -4.596 2.690 1.00 0.00 C ATOM 0 H VAL A 30 11.616 -7.025 3.711 1.00 0.00 H new ATOM 0 HA VAL A 30 10.927 -4.836 5.491 1.00 0.00 H new ATOM 0 HB VAL A 30 9.376 -5.975 3.154 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.406 -3.712 3.062 1.00 0.00 H new ATOM 0 HG12 VAL A 30 8.090 -4.508 4.622 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.349 -3.256 4.500 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.445 -4.218 1.793 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.479 -3.786 3.175 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.632 -5.388 2.416 1.00 0.00 H new ATOM 469 N LEU A 31 9.037 -5.886 6.825 1.00 0.00 N ATOM 470 CA LEU A 31 8.195 -6.636 7.749 1.00 0.00 C ATOM 471 C LEU A 31 6.797 -6.045 7.892 1.00 0.00 C ATOM 472 O LEU A 31 5.871 -6.740 8.306 1.00 0.00 O ATOM 473 CB LEU A 31 8.890 -6.747 9.108 1.00 0.00 C ATOM 474 CG LEU A 31 10.170 -7.587 9.085 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.876 -7.551 10.427 1.00 0.00 C ATOM 476 CD2 LEU A 31 9.852 -9.020 8.696 1.00 0.00 C ATOM 0 H LEU A 31 9.199 -4.912 7.082 1.00 0.00 H new ATOM 0 HA LEU A 31 8.057 -7.633 7.331 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.131 -5.746 9.464 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.195 -7.182 9.826 1.00 0.00 H new ATOM 0 HG LEU A 31 10.841 -7.158 8.341 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.781 -8.157 10.378 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.141 -6.522 10.671 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.214 -7.948 11.197 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.771 -9.606 8.684 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.158 -9.448 9.420 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.398 -9.036 7.705 1.00 0.00 H new ATOM 488 N LYS A 32 6.623 -4.781 7.540 1.00 0.00 N ATOM 489 CA LYS A 32 5.291 -4.183 7.576 1.00 0.00 C ATOM 490 C LYS A 32 5.128 -3.149 6.473 1.00 0.00 C ATOM 491 O LYS A 32 5.817 -2.133 6.458 1.00 0.00 O ATOM 492 CB LYS A 32 5.010 -3.534 8.936 1.00 0.00 C ATOM 493 CG LYS A 32 3.565 -3.076 9.091 1.00 0.00 C ATOM 494 CD LYS A 32 3.391 -2.121 10.264 1.00 0.00 C ATOM 495 CE LYS A 32 3.562 -2.818 11.605 1.00 0.00 C ATOM 496 NZ LYS A 32 2.441 -3.751 11.904 1.00 0.00 N ATOM 0 H LYS A 32 7.369 -4.157 7.231 1.00 0.00 H new ATOM 0 HA LYS A 32 4.572 -4.986 7.417 1.00 0.00 H new ATOM 0 HB2 LYS A 32 5.247 -4.245 9.727 1.00 0.00 H new ATOM 0 HB3 LYS A 32 5.672 -2.678 9.068 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.240 -2.586 8.173 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.923 -3.945 9.233 1.00 0.00 H new ATOM 0 HD2 LYS A 32 4.117 -1.312 10.182 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.401 -1.667 10.216 1.00 0.00 H new ATOM 0 HE2 LYS A 32 4.502 -3.370 11.608 1.00 0.00 H new ATOM 0 HE3 LYS A 32 3.630 -2.070 12.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.178 -3.668 12.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.622 -3.511 11.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.739 -4.727 11.704 1.00 0.00 H new ATOM 510 N GLN A 33 4.206 -3.406 5.561 1.00 0.00 N ATOM 511 CA GLN A 33 3.950 -2.505 4.453 1.00 0.00 C ATOM 512 C GLN A 33 2.612 -1.798 4.640 1.00 0.00 C ATOM 513 O GLN A 33 1.553 -2.410 4.502 1.00 0.00 O ATOM 514 CB GLN A 33 3.951 -3.281 3.135 1.00 0.00 C ATOM 515 CG GLN A 33 3.849 -2.401 1.902 1.00 0.00 C ATOM 516 CD GLN A 33 3.729 -3.205 0.621 1.00 0.00 C ATOM 517 OE1 GLN A 33 3.161 -4.293 0.607 1.00 0.00 O ATOM 518 NE2 GLN A 33 4.276 -2.677 -0.462 1.00 0.00 N ATOM 0 H GLN A 33 3.618 -4.239 5.568 1.00 0.00 H new ATOM 0 HA GLN A 33 4.740 -1.755 4.425 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.865 -3.871 3.073 1.00 0.00 H new ATOM 0 HB3 GLN A 33 3.118 -3.983 3.138 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.983 -1.746 1.998 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.729 -1.760 1.844 1.00 0.00 H new ATOM 0 HE21 GLN A 33 4.739 -1.770 -0.409 1.00 0.00 H new ATOM 0 HE22 GLN A 33 4.234 -3.177 -1.350 1.00 0.00 H new ATOM 527 N SER A 34 2.654 -0.520 4.977 1.00 0.00 N ATOM 528 CA SER A 34 1.439 0.260 5.128 1.00 0.00 C ATOM 529 C SER A 34 1.056 0.883 3.788 1.00 0.00 C ATOM 530 O SER A 34 1.655 1.864 3.363 1.00 0.00 O ATOM 531 CB SER A 34 1.642 1.351 6.182 1.00 0.00 C ATOM 532 OG SER A 34 2.248 0.820 7.350 1.00 0.00 O ATOM 0 H SER A 34 3.515 -0.002 5.151 1.00 0.00 H new ATOM 0 HA SER A 34 0.632 -0.395 5.457 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.266 2.146 5.773 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.682 1.799 6.437 1.00 0.00 H new ATOM 0 HG SER A 34 3.223 0.832 7.247 1.00 0.00 H new ATOM 538 N SER A 35 0.070 0.307 3.124 1.00 0.00 N ATOM 539 CA SER A 35 -0.333 0.771 1.810 1.00 0.00 C ATOM 540 C SER A 35 -1.659 1.501 1.920 1.00 0.00 C ATOM 541 O SER A 35 -2.708 0.882 2.069 1.00 0.00 O ATOM 542 CB SER A 35 -0.446 -0.409 0.839 1.00 0.00 C ATOM 543 OG SER A 35 -0.756 0.031 -0.472 1.00 0.00 O ATOM 0 H SER A 35 -0.468 -0.486 3.475 1.00 0.00 H new ATOM 0 HA SER A 35 0.421 1.456 1.422 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.492 -0.964 0.826 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.218 -1.096 1.186 1.00 0.00 H new ATOM 0 HG SER A 35 -0.820 -0.743 -1.070 1.00 0.00 H new ATOM 549 N GLU A 36 -1.618 2.816 1.873 1.00 0.00 N ATOM 550 CA GLU A 36 -2.813 3.601 2.064 1.00 0.00 C ATOM 551 C GLU A 36 -3.180 4.303 0.764 1.00 0.00 C ATOM 552 O GLU A 36 -2.533 5.266 0.353 1.00 0.00 O ATOM 553 CB GLU A 36 -2.587 4.586 3.207 1.00 0.00 C ATOM 554 CG GLU A 36 -3.850 5.236 3.735 1.00 0.00 C ATOM 555 CD GLU A 36 -3.658 5.798 5.128 1.00 0.00 C ATOM 556 OE1 GLU A 36 -3.630 4.999 6.089 1.00 0.00 O ATOM 557 OE2 GLU A 36 -3.548 7.032 5.274 1.00 0.00 O ATOM 0 H GLU A 36 -0.772 3.360 1.705 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.652 2.960 2.334 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.092 4.065 4.026 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -1.906 5.367 2.868 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.156 6.036 3.060 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -4.657 4.503 3.747 1.00 0.00 H new ATOM 564 N THR A 37 -4.198 3.778 0.101 1.00 0.00 N ATOM 565 CA THR A 37 -4.597 4.268 -1.206 1.00 0.00 C ATOM 566 C THR A 37 -5.829 5.162 -1.105 1.00 0.00 C ATOM 567 O THR A 37 -6.926 4.701 -0.803 1.00 0.00 O ATOM 568 CB THR A 37 -4.884 3.092 -2.158 1.00 0.00 C ATOM 569 OG1 THR A 37 -3.753 2.212 -2.196 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.194 3.586 -3.563 1.00 0.00 C ATOM 0 H THR A 37 -4.766 3.007 0.451 1.00 0.00 H new ATOM 0 HA THR A 37 -3.773 4.859 -1.605 1.00 0.00 H new ATOM 0 HB THR A 37 -5.756 2.556 -1.783 1.00 0.00 H new ATOM 0 HG1 THR A 37 -3.940 1.464 -2.801 1.00 0.00 H new ATOM 0 HG21 THR A 37 -5.392 2.734 -4.213 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.070 4.233 -3.536 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.342 4.145 -3.948 1.00 0.00 H new ATOM 578 N LYS A 38 -5.634 6.446 -1.345 1.00 0.00 N ATOM 579 CA LYS A 38 -6.722 7.408 -1.308 1.00 0.00 C ATOM 580 C LYS A 38 -7.396 7.489 -2.674 1.00 0.00 C ATOM 581 O LYS A 38 -6.815 7.994 -3.635 1.00 0.00 O ATOM 582 CB LYS A 38 -6.182 8.771 -0.884 1.00 0.00 C ATOM 583 CG LYS A 38 -7.231 9.860 -0.782 1.00 0.00 C ATOM 584 CD LYS A 38 -6.580 11.194 -0.468 1.00 0.00 C ATOM 585 CE LYS A 38 -7.550 12.347 -0.619 1.00 0.00 C ATOM 586 NZ LYS A 38 -6.834 13.642 -0.745 1.00 0.00 N ATOM 0 H LYS A 38 -4.725 6.850 -1.569 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.469 7.087 -0.581 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.689 8.667 0.083 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.420 9.084 -1.598 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.784 9.930 -1.719 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.952 9.608 -0.004 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.192 11.177 0.550 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.729 11.347 -1.131 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -8.174 12.187 -1.498 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -8.216 12.380 0.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.525 14.410 -0.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.271 13.812 0.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -6.204 13.611 -1.572 1.00 0.00 H new ATOM 600 N ILE A 39 -8.611 6.965 -2.758 1.00 0.00 N ATOM 601 CA ILE A 39 -9.344 6.925 -4.014 1.00 0.00 C ATOM 602 C ILE A 39 -10.374 8.046 -4.075 1.00 0.00 C ATOM 603 O ILE A 39 -11.240 8.155 -3.207 1.00 0.00 O ATOM 604 CB ILE A 39 -10.073 5.576 -4.201 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.100 4.409 -4.027 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.737 5.517 -5.574 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.751 3.050 -4.173 1.00 0.00 C ATOM 0 H ILE A 39 -9.111 6.560 -1.967 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.612 7.050 -4.812 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.846 5.494 -3.437 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.301 4.501 -4.762 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.637 4.477 -3.043 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.247 4.561 -5.691 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.461 6.327 -5.663 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.978 5.621 -6.350 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.001 2.271 -4.037 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.531 2.938 -3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.190 2.962 -5.167 1.00 0.00 H new ATOM 619 N GLN A 40 -10.274 8.878 -5.098 1.00 0.00 N ATOM 620 CA GLN A 40 -11.268 9.914 -5.330 1.00 0.00 C ATOM 621 C GLN A 40 -12.525 9.290 -5.927 1.00 0.00 C ATOM 622 O GLN A 40 -12.446 8.308 -6.665 1.00 0.00 O ATOM 623 CB GLN A 40 -10.720 10.985 -6.274 1.00 0.00 C ATOM 624 CG GLN A 40 -9.534 11.765 -5.723 1.00 0.00 C ATOM 625 CD GLN A 40 -9.885 12.588 -4.497 1.00 0.00 C ATOM 626 OE1 GLN A 40 -11.032 12.996 -4.316 1.00 0.00 O ATOM 627 NE2 GLN A 40 -8.896 12.864 -3.661 1.00 0.00 N ATOM 0 H GLN A 40 -9.516 8.857 -5.780 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.512 10.386 -4.378 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.423 10.510 -7.209 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.520 11.685 -6.512 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.734 11.069 -5.470 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -9.148 12.426 -6.499 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -7.958 12.508 -3.845 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.072 13.433 -2.833 1.00 0.00 H new ATOM 636 N PHE A 41 -13.682 9.856 -5.614 1.00 0.00 N ATOM 637 CA PHE A 41 -14.948 9.328 -6.118 1.00 0.00 C ATOM 638 C PHE A 41 -15.045 9.449 -7.638 1.00 0.00 C ATOM 639 O PHE A 41 -15.771 8.690 -8.283 1.00 0.00 O ATOM 640 CB PHE A 41 -16.134 10.037 -5.460 1.00 0.00 C ATOM 641 CG PHE A 41 -16.452 9.546 -4.072 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.715 8.527 -3.488 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.500 10.103 -3.354 1.00 0.00 C ATOM 644 CE1 PHE A 41 -16.015 8.075 -2.216 1.00 0.00 C ATOM 645 CE2 PHE A 41 -17.804 9.655 -2.083 1.00 0.00 C ATOM 646 CZ PHE A 41 -17.061 8.640 -1.513 1.00 0.00 C ATOM 0 H PHE A 41 -13.773 10.677 -5.016 1.00 0.00 H new ATOM 0 HA PHE A 41 -14.981 8.269 -5.860 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.926 11.106 -5.417 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -17.015 9.909 -6.090 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.897 8.081 -4.033 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.086 10.897 -3.794 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.432 7.281 -1.773 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -18.622 10.098 -1.535 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.297 8.289 -0.519 1.00 0.00 H new ATOM 656 N ALA A 42 -14.296 10.387 -8.203 1.00 0.00 N ATOM 657 CA ALA A 42 -14.325 10.631 -9.641 1.00 0.00 C ATOM 658 C ALA A 42 -13.786 9.439 -10.430 1.00 0.00 C ATOM 659 O ALA A 42 -14.306 9.104 -11.491 1.00 0.00 O ATOM 660 CB ALA A 42 -13.534 11.886 -9.977 1.00 0.00 C ATOM 0 H ALA A 42 -13.659 10.993 -7.686 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.366 10.774 -9.931 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.563 12.057 -11.053 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.972 12.741 -9.461 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.499 11.760 -9.658 1.00 0.00 H new ATOM 666 N SER A 43 -12.752 8.793 -9.903 1.00 0.00 N ATOM 667 CA SER A 43 -12.107 7.695 -10.608 1.00 0.00 C ATOM 668 C SER A 43 -12.822 6.366 -10.374 1.00 0.00 C ATOM 669 O SER A 43 -12.771 5.471 -11.216 1.00 0.00 O ATOM 670 CB SER A 43 -10.639 7.601 -10.191 1.00 0.00 C ATOM 671 OG SER A 43 -10.473 7.957 -8.829 1.00 0.00 O ATOM 0 H SER A 43 -12.345 9.010 -8.993 1.00 0.00 H new ATOM 0 HA SER A 43 -12.164 7.903 -11.676 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.276 6.586 -10.352 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.036 8.258 -10.818 1.00 0.00 H new ATOM 0 HG SER A 43 -9.566 8.300 -8.689 1.00 0.00 H new ATOM 677 N ILE A 44 -13.489 6.233 -9.233 1.00 0.00 N ATOM 678 CA ILE A 44 -14.229 5.011 -8.935 1.00 0.00 C ATOM 679 C ILE A 44 -15.613 5.040 -9.588 1.00 0.00 C ATOM 680 O ILE A 44 -16.161 3.999 -9.958 1.00 0.00 O ATOM 681 CB ILE A 44 -14.357 4.771 -7.407 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.120 3.470 -7.124 1.00 0.00 C ATOM 683 CG2 ILE A 44 -15.037 5.947 -6.724 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.282 3.165 -5.649 1.00 0.00 C ATOM 0 H ILE A 44 -13.533 6.947 -8.506 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.661 4.180 -9.354 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.351 4.677 -6.998 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.107 3.531 -7.583 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.597 2.642 -7.602 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.114 5.752 -5.654 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.450 6.851 -6.887 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -16.035 6.082 -7.140 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -15.831 2.231 -5.529 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.299 3.071 -5.187 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -15.833 3.974 -5.169 1.00 0.00 H new ATOM 696 N GLY A 45 -16.158 6.239 -9.758 1.00 0.00 N ATOM 697 CA GLY A 45 -17.471 6.377 -10.352 1.00 0.00 C ATOM 698 C GLY A 45 -18.569 6.374 -9.309 1.00 0.00 C ATOM 699 O GLY A 45 -19.674 5.895 -9.557 1.00 0.00 O ATOM 0 H GLY A 45 -15.712 7.118 -9.494 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.515 7.305 -10.922 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.638 5.562 -11.056 1.00 0.00 H new ATOM 703 N ALA A 46 -18.261 6.907 -8.139 1.00 0.00 N ATOM 704 CA ALA A 46 -19.222 6.969 -7.051 1.00 0.00 C ATOM 705 C ALA A 46 -19.571 8.415 -6.737 1.00 0.00 C ATOM 706 O ALA A 46 -18.747 9.308 -6.911 1.00 0.00 O ATOM 707 CB ALA A 46 -18.670 6.275 -5.815 1.00 0.00 C ATOM 0 H ALA A 46 -17.348 7.305 -7.918 1.00 0.00 H new ATOM 0 HA ALA A 46 -20.131 6.452 -7.360 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.402 6.330 -5.009 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.463 5.230 -6.046 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.749 6.767 -5.503 1.00 0.00 H new ATOM 713 N THR A 47 -20.798 8.650 -6.298 1.00 0.00 N ATOM 714 CA THR A 47 -21.217 9.989 -5.918 1.00 0.00 C ATOM 715 C THR A 47 -21.303 10.110 -4.399 1.00 0.00 C ATOM 716 O THR A 47 -21.027 11.167 -3.828 1.00 0.00 O ATOM 717 CB THR A 47 -22.580 10.334 -6.546 1.00 0.00 C ATOM 718 OG1 THR A 47 -22.552 10.023 -7.944 1.00 0.00 O ATOM 719 CG2 THR A 47 -22.912 11.810 -6.363 1.00 0.00 C ATOM 0 H THR A 47 -21.518 7.934 -6.197 1.00 0.00 H new ATOM 0 HA THR A 47 -20.473 10.693 -6.290 1.00 0.00 H new ATOM 0 HB THR A 47 -23.348 9.744 -6.045 1.00 0.00 H new ATOM 0 HG1 THR A 47 -23.419 10.240 -8.345 1.00 0.00 H new ATOM 0 HG21 THR A 47 -23.880 12.024 -6.816 1.00 0.00 H new ATOM 0 HG22 THR A 47 -22.949 12.045 -5.299 1.00 0.00 H new ATOM 0 HG23 THR A 47 -22.144 12.418 -6.842 1.00 0.00 H new ATOM 727 N THR A 48 -21.665 9.014 -3.751 1.00 0.00 N ATOM 728 CA THR A 48 -21.794 8.989 -2.307 1.00 0.00 C ATOM 729 C THR A 48 -21.116 7.738 -1.745 1.00 0.00 C ATOM 730 O THR A 48 -20.589 6.914 -2.503 1.00 0.00 O ATOM 731 CB THR A 48 -23.284 9.042 -1.884 1.00 0.00 C ATOM 732 OG1 THR A 48 -23.405 9.204 -0.463 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.022 7.785 -2.318 1.00 0.00 C ATOM 0 H THR A 48 -21.875 8.126 -4.208 1.00 0.00 H new ATOM 0 HA THR A 48 -21.300 9.870 -1.898 1.00 0.00 H new ATOM 0 HB THR A 48 -23.734 9.902 -2.380 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.353 9.237 -0.217 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.065 7.850 -2.008 1.00 0.00 H new ATOM 0 HG22 THR A 48 -23.971 7.689 -3.403 1.00 0.00 H new ATOM 0 HG23 THR A 48 -23.559 6.913 -1.855 1.00 0.00 H new ATOM 741 N LYS A 49 -21.146 7.596 -0.427 1.00 0.00 N ATOM 742 CA LYS A 49 -20.452 6.512 0.257 1.00 0.00 C ATOM 743 C LYS A 49 -21.053 5.154 -0.098 1.00 0.00 C ATOM 744 O LYS A 49 -20.330 4.169 -0.205 1.00 0.00 O ATOM 745 CB LYS A 49 -20.488 6.753 1.773 1.00 0.00 C ATOM 746 CG LYS A 49 -19.827 5.661 2.607 1.00 0.00 C ATOM 747 CD LYS A 49 -20.826 4.611 3.077 1.00 0.00 C ATOM 748 CE LYS A 49 -21.907 5.219 3.963 1.00 0.00 C ATOM 749 NZ LYS A 49 -21.338 5.878 5.167 1.00 0.00 N ATOM 0 H LYS A 49 -21.650 8.226 0.197 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.414 6.499 -0.075 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -19.998 7.703 1.988 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -21.527 6.852 2.087 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -19.046 5.179 2.018 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -19.342 6.111 3.473 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -21.289 4.136 2.212 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -20.301 3.830 3.627 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -22.479 5.947 3.388 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -22.603 4.439 4.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -22.103 6.097 5.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.652 5.241 5.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -20.860 6.759 4.888 1.00 0.00 H new ATOM 763 N GLU A 50 -22.370 5.112 -0.283 1.00 0.00 N ATOM 764 CA GLU A 50 -23.074 3.868 -0.607 1.00 0.00 C ATOM 765 C GLU A 50 -22.452 3.161 -1.811 1.00 0.00 C ATOM 766 O GLU A 50 -22.129 1.974 -1.749 1.00 0.00 O ATOM 767 CB GLU A 50 -24.544 4.155 -0.903 1.00 0.00 C ATOM 768 CG GLU A 50 -25.264 4.872 0.221 1.00 0.00 C ATOM 769 CD GLU A 50 -26.693 5.206 -0.134 1.00 0.00 C ATOM 770 OE1 GLU A 50 -26.905 5.974 -1.096 1.00 0.00 O ATOM 771 OE2 GLU A 50 -27.613 4.692 0.538 1.00 0.00 O ATOM 0 H GLU A 50 -22.977 5.929 -0.214 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.988 3.213 0.260 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.612 4.758 -1.809 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -25.055 3.214 -1.107 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -25.250 4.248 1.114 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -24.729 5.790 0.465 1.00 0.00 H new ATOM 778 N ASP A 51 -22.282 3.899 -2.901 1.00 0.00 N ATOM 779 CA ASP A 51 -21.757 3.334 -4.142 1.00 0.00 C ATOM 780 C ASP A 51 -20.310 2.897 -3.969 1.00 0.00 C ATOM 781 O ASP A 51 -19.909 1.836 -4.449 1.00 0.00 O ATOM 782 CB ASP A 51 -21.858 4.349 -5.282 1.00 0.00 C ATOM 783 CG ASP A 51 -23.283 4.776 -5.550 1.00 0.00 C ATOM 784 OD1 ASP A 51 -23.742 5.747 -4.913 1.00 0.00 O ATOM 785 OD2 ASP A 51 -23.956 4.141 -6.389 1.00 0.00 O ATOM 0 H ASP A 51 -22.500 4.894 -2.953 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.359 2.460 -4.391 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -21.259 5.226 -5.038 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.435 3.916 -6.188 1.00 0.00 H new ATOM 790 N ALA A 52 -19.535 3.718 -3.271 1.00 0.00 N ATOM 791 CA ALA A 52 -18.135 3.411 -3.016 1.00 0.00 C ATOM 792 C ALA A 52 -18.008 2.151 -2.169 1.00 0.00 C ATOM 793 O ALA A 52 -17.207 1.270 -2.472 1.00 0.00 O ATOM 794 CB ALA A 52 -17.452 4.586 -2.335 1.00 0.00 C ATOM 0 H ALA A 52 -19.853 4.601 -2.872 1.00 0.00 H new ATOM 0 HA ALA A 52 -17.641 3.230 -3.971 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.406 4.342 -2.151 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.512 5.464 -2.978 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.948 4.796 -1.387 1.00 0.00 H new ATOM 800 N ALA A 53 -18.823 2.064 -1.126 1.00 0.00 N ATOM 801 CA ALA A 53 -18.802 0.920 -0.227 1.00 0.00 C ATOM 802 C ALA A 53 -19.169 -0.359 -0.963 1.00 0.00 C ATOM 803 O ALA A 53 -18.455 -1.349 -0.884 1.00 0.00 O ATOM 804 CB ALA A 53 -19.739 1.143 0.949 1.00 0.00 C ATOM 0 H ALA A 53 -19.510 2.777 -0.882 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.787 0.813 0.155 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.708 0.276 1.609 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.426 2.030 1.500 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.756 1.284 0.582 1.00 0.00 H new ATOM 810 N LYS A 54 -20.261 -0.328 -1.715 1.00 0.00 N ATOM 811 CA LYS A 54 -20.721 -1.518 -2.426 1.00 0.00 C ATOM 812 C LYS A 54 -19.697 -1.985 -3.463 1.00 0.00 C ATOM 813 O LYS A 54 -19.801 -3.092 -3.993 1.00 0.00 O ATOM 814 CB LYS A 54 -22.080 -1.261 -3.082 1.00 0.00 C ATOM 815 CG LYS A 54 -23.197 -1.084 -2.068 1.00 0.00 C ATOM 816 CD LYS A 54 -24.563 -0.969 -2.725 1.00 0.00 C ATOM 817 CE LYS A 54 -24.733 0.345 -3.468 1.00 0.00 C ATOM 818 NZ LYS A 54 -26.121 0.513 -3.976 1.00 0.00 N ATOM 0 H LYS A 54 -20.842 0.500 -1.849 1.00 0.00 H new ATOM 0 HA LYS A 54 -20.835 -2.318 -1.695 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.015 -0.369 -3.704 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.323 -2.093 -3.742 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -23.197 -1.930 -1.381 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -23.006 -0.190 -1.474 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.701 -1.798 -3.419 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -25.339 -1.058 -1.964 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -24.485 1.173 -2.804 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -24.033 0.385 -4.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -26.200 1.421 -4.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -26.348 -0.264 -4.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -26.787 0.500 -3.177 1.00 0.00 H new ATOM 832 N THR A 55 -18.710 -1.145 -3.736 1.00 0.00 N ATOM 833 CA THR A 55 -17.627 -1.505 -4.634 1.00 0.00 C ATOM 834 C THR A 55 -16.380 -1.946 -3.854 1.00 0.00 C ATOM 835 O THR A 55 -15.749 -2.952 -4.186 1.00 0.00 O ATOM 836 CB THR A 55 -17.265 -0.320 -5.553 1.00 0.00 C ATOM 837 OG1 THR A 55 -18.446 0.161 -6.211 1.00 0.00 O ATOM 838 CG2 THR A 55 -16.235 -0.727 -6.596 1.00 0.00 C ATOM 0 H THR A 55 -18.638 -0.205 -3.346 1.00 0.00 H new ATOM 0 HA THR A 55 -17.972 -2.341 -5.243 1.00 0.00 H new ATOM 0 HB THR A 55 -16.836 0.469 -4.935 1.00 0.00 H new ATOM 0 HG1 THR A 55 -18.950 0.738 -5.599 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.000 0.129 -7.229 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.328 -1.070 -6.098 1.00 0.00 H new ATOM 0 HG23 THR A 55 -16.638 -1.532 -7.210 1.00 0.00 H new ATOM 846 N LEU A 56 -16.048 -1.204 -2.797 1.00 0.00 N ATOM 847 CA LEU A 56 -14.787 -1.399 -2.079 1.00 0.00 C ATOM 848 C LEU A 56 -14.892 -2.430 -0.958 1.00 0.00 C ATOM 849 O LEU A 56 -13.932 -3.145 -0.691 1.00 0.00 O ATOM 850 CB LEU A 56 -14.294 -0.067 -1.512 1.00 0.00 C ATOM 851 CG LEU A 56 -13.943 0.992 -2.557 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.517 2.284 -1.881 1.00 0.00 C ATOM 853 CD2 LEU A 56 -12.843 0.489 -3.479 1.00 0.00 C ATOM 0 H LEU A 56 -16.636 -0.461 -2.418 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.071 -1.787 -2.803 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -15.063 0.336 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.413 -0.255 -0.898 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.831 1.191 -3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.271 3.027 -2.639 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.332 2.656 -1.260 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.642 2.097 -1.258 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.607 1.256 -4.216 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.952 0.262 -2.893 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.180 -0.413 -3.990 1.00 0.00 H new ATOM 865 N GLU A 57 -16.044 -2.508 -0.304 1.00 0.00 N ATOM 866 CA GLU A 57 -16.239 -3.446 0.806 1.00 0.00 C ATOM 867 C GLU A 57 -15.931 -4.896 0.393 1.00 0.00 C ATOM 868 O GLU A 57 -15.183 -5.589 1.083 1.00 0.00 O ATOM 869 CB GLU A 57 -17.661 -3.343 1.363 1.00 0.00 C ATOM 870 CG GLU A 57 -17.984 -1.988 1.973 1.00 0.00 C ATOM 871 CD GLU A 57 -17.216 -1.708 3.242 1.00 0.00 C ATOM 872 OE1 GLU A 57 -17.209 -2.570 4.144 1.00 0.00 O ATOM 873 OE2 GLU A 57 -16.645 -0.606 3.358 1.00 0.00 O ATOM 0 H GLU A 57 -16.860 -1.935 -0.519 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.534 -3.168 1.589 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.371 -3.549 0.562 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.802 -4.115 2.120 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -17.765 -1.207 1.244 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -19.052 -1.937 2.184 1.00 0.00 H new ATOM 880 N PRO A 58 -16.498 -5.394 -0.731 1.00 0.00 N ATOM 881 CA PRO A 58 -16.161 -6.729 -1.246 1.00 0.00 C ATOM 882 C PRO A 58 -14.748 -6.789 -1.832 1.00 0.00 C ATOM 883 O PRO A 58 -14.220 -7.867 -2.099 1.00 0.00 O ATOM 884 CB PRO A 58 -17.207 -6.967 -2.337 1.00 0.00 C ATOM 885 CG PRO A 58 -17.611 -5.605 -2.779 1.00 0.00 C ATOM 886 CD PRO A 58 -17.535 -4.737 -1.556 1.00 0.00 C ATOM 0 HA PRO A 58 -16.172 -7.483 -0.459 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -16.792 -7.544 -3.163 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.059 -7.527 -1.953 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -16.949 -5.236 -3.562 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.620 -5.611 -3.192 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.259 -3.713 -1.807 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.492 -4.691 -1.036 1.00 0.00 H new ATOM 894 N LEU A 59 -14.138 -5.624 -2.019 1.00 0.00 N ATOM 895 CA LEU A 59 -12.787 -5.540 -2.557 1.00 0.00 C ATOM 896 C LEU A 59 -11.773 -5.722 -1.429 1.00 0.00 C ATOM 897 O LEU A 59 -10.770 -6.413 -1.586 1.00 0.00 O ATOM 898 CB LEU A 59 -12.589 -4.195 -3.277 1.00 0.00 C ATOM 899 CG LEU A 59 -11.306 -4.047 -4.109 1.00 0.00 C ATOM 900 CD1 LEU A 59 -11.488 -2.960 -5.154 1.00 0.00 C ATOM 901 CD2 LEU A 59 -10.112 -3.712 -3.224 1.00 0.00 C ATOM 0 H LEU A 59 -14.561 -4.721 -1.804 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.633 -6.335 -3.286 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.443 -4.030 -3.934 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.605 -3.402 -2.529 1.00 0.00 H new ATOM 0 HG LEU A 59 -11.112 -4.999 -4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -10.574 -2.861 -5.739 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -12.315 -3.224 -5.814 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.706 -2.013 -4.660 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -9.218 -3.613 -3.840 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -10.298 -2.773 -2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -9.964 -4.509 -2.496 1.00 0.00 H new ATOM 913 N SER A 60 -12.047 -5.112 -0.283 1.00 0.00 N ATOM 914 CA SER A 60 -11.203 -5.290 0.889 1.00 0.00 C ATOM 915 C SER A 60 -11.376 -6.701 1.445 1.00 0.00 C ATOM 916 O SER A 60 -10.463 -7.267 2.050 1.00 0.00 O ATOM 917 CB SER A 60 -11.545 -4.240 1.948 1.00 0.00 C ATOM 918 OG SER A 60 -12.945 -4.162 2.153 1.00 0.00 O ATOM 0 H SER A 60 -12.844 -4.492 -0.141 1.00 0.00 H new ATOM 0 HA SER A 60 -10.159 -5.158 0.603 1.00 0.00 H new ATOM 0 HB2 SER A 60 -11.050 -4.490 2.886 1.00 0.00 H new ATOM 0 HB3 SER A 60 -11.165 -3.267 1.637 1.00 0.00 H new ATOM 0 HG SER A 60 -13.382 -4.926 1.722 1.00 0.00 H new ATOM 924 N ALA A 61 -12.552 -7.275 1.196 1.00 0.00 N ATOM 925 CA ALA A 61 -12.855 -8.639 1.616 1.00 0.00 C ATOM 926 C ALA A 61 -12.018 -9.655 0.844 1.00 0.00 C ATOM 927 O ALA A 61 -12.001 -10.836 1.175 1.00 0.00 O ATOM 928 CB ALA A 61 -14.338 -8.931 1.434 1.00 0.00 C ATOM 0 H ALA A 61 -13.314 -6.811 0.702 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.603 -8.728 2.673 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.549 -9.952 1.751 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.922 -8.235 2.036 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.606 -8.815 0.384 1.00 0.00 H new ATOM 934 N LYS A 62 -11.327 -9.191 -0.192 1.00 0.00 N ATOM 935 CA LYS A 62 -10.427 -10.051 -0.948 1.00 0.00 C ATOM 936 C LYS A 62 -9.217 -10.419 -0.102 1.00 0.00 C ATOM 937 O LYS A 62 -8.652 -11.506 -0.240 1.00 0.00 O ATOM 938 CB LYS A 62 -9.974 -9.364 -2.236 1.00 0.00 C ATOM 939 CG LYS A 62 -11.110 -9.057 -3.194 1.00 0.00 C ATOM 940 CD LYS A 62 -10.611 -8.336 -4.434 1.00 0.00 C ATOM 941 CE LYS A 62 -11.750 -8.033 -5.389 1.00 0.00 C ATOM 942 NZ LYS A 62 -12.384 -9.273 -5.909 1.00 0.00 N ATOM 0 H LYS A 62 -11.373 -8.228 -0.525 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.967 -10.960 -1.213 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.463 -8.435 -1.982 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.247 -10.000 -2.740 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.603 -9.985 -3.485 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.857 -8.443 -2.690 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.119 -7.407 -4.145 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -9.864 -8.949 -4.938 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.500 -7.429 -4.879 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -11.376 -7.440 -6.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -13.013 -9.035 -6.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -11.646 -9.929 -6.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.937 -9.724 -5.152 1.00 0.00 H new ATOM 956 N TYR A 63 -8.828 -9.512 0.790 1.00 0.00 N ATOM 957 CA TYR A 63 -7.714 -9.767 1.689 1.00 0.00 C ATOM 958 C TYR A 63 -8.159 -10.701 2.800 1.00 0.00 C ATOM 959 O TYR A 63 -7.623 -11.797 2.946 1.00 0.00 O ATOM 960 CB TYR A 63 -7.175 -8.467 2.302 1.00 0.00 C ATOM 961 CG TYR A 63 -6.557 -7.510 1.308 1.00 0.00 C ATOM 962 CD1 TYR A 63 -7.343 -6.775 0.429 1.00 0.00 C ATOM 963 CD2 TYR A 63 -5.181 -7.343 1.256 1.00 0.00 C ATOM 964 CE1 TYR A 63 -6.772 -5.899 -0.475 1.00 0.00 C ATOM 965 CE2 TYR A 63 -4.603 -6.471 0.358 1.00 0.00 C ATOM 966 CZ TYR A 63 -5.402 -5.749 -0.507 1.00 0.00 C ATOM 967 OH TYR A 63 -4.830 -4.880 -1.408 1.00 0.00 O ATOM 0 H TYR A 63 -9.267 -8.599 0.907 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.914 -10.227 1.109 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.990 -7.959 2.817 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.429 -8.718 3.056 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.417 -6.890 0.452 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -4.552 -7.905 1.930 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.396 -5.335 -1.153 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -3.530 -6.353 0.331 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.856 -4.891 -1.300 1.00 0.00 H new ATOM 977 N LYS A 64 -9.186 -10.279 3.538 1.00 0.00 N ATOM 978 CA LYS A 64 -9.654 -11.003 4.719 1.00 0.00 C ATOM 979 C LYS A 64 -8.583 -10.993 5.805 1.00 0.00 C ATOM 980 O LYS A 64 -7.516 -10.405 5.634 1.00 0.00 O ATOM 981 CB LYS A 64 -10.040 -12.446 4.366 1.00 0.00 C ATOM 982 CG LYS A 64 -11.349 -12.559 3.606 1.00 0.00 C ATOM 983 CD LYS A 64 -11.470 -13.885 2.869 1.00 0.00 C ATOM 984 CE LYS A 64 -10.825 -13.825 1.487 1.00 0.00 C ATOM 985 NZ LYS A 64 -9.343 -13.682 1.545 1.00 0.00 N ATOM 0 H LYS A 64 -9.714 -9.430 3.335 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.543 -10.497 5.095 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -9.244 -12.890 3.768 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.112 -13.029 5.284 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -12.182 -12.454 4.301 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -11.425 -11.739 2.892 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -10.998 -14.672 3.457 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -12.522 -14.150 2.768 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -11.076 -14.730 0.935 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -11.245 -12.986 0.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -8.914 -14.178 0.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -9.090 -12.674 1.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -8.989 -14.094 2.432 1.00 0.00 H new ATOM 999 N ASN A 65 -8.861 -11.642 6.918 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.901 -11.702 8.008 1.00 0.00 C ATOM 1001 C ASN A 65 -6.932 -12.866 7.814 1.00 0.00 C ATOM 1002 O ASN A 65 -7.003 -13.880 8.502 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.610 -11.782 9.371 1.00 0.00 C ATOM 1004 CG ASN A 65 -9.718 -12.821 9.419 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -9.490 -13.980 9.759 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -10.933 -12.408 9.096 1.00 0.00 N ATOM 0 H ASN A 65 -9.738 -12.133 7.093 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.320 -10.780 7.997 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -7.874 -12.012 10.141 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -9.029 -10.805 9.612 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -11.717 -13.059 9.125 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.085 -11.438 8.818 1.00 0.00 H new ATOM 1013 N ILE A 66 -6.042 -12.715 6.838 1.00 0.00 N ATOM 1014 CA ILE A 66 -5.015 -13.719 6.561 1.00 0.00 C ATOM 1015 C ILE A 66 -4.033 -13.795 7.720 1.00 0.00 C ATOM 1016 O ILE A 66 -3.884 -14.825 8.373 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.241 -13.385 5.264 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.209 -13.211 4.094 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -3.222 -14.473 4.952 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -4.546 -12.731 2.819 1.00 0.00 C ATOM 0 H ILE A 66 -6.010 -11.903 6.222 1.00 0.00 H new ATOM 0 HA ILE A 66 -5.515 -14.679 6.434 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.707 -12.447 5.416 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.704 -14.162 3.899 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.985 -12.500 4.379 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.688 -14.220 4.036 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.512 -14.554 5.775 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.735 -15.426 4.821 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.296 -12.631 2.034 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.075 -11.764 2.996 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.790 -13.452 2.509 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.378 -12.680 7.964 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.451 -12.557 9.075 1.00 0.00 C ATOM 1034 C ALA A 67 -2.546 -11.163 9.671 1.00 0.00 C ATOM 1035 O ALA A 67 -3.358 -10.910 10.559 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.024 -12.844 8.629 1.00 0.00 C ATOM 0 H ALA A 67 -3.471 -11.834 7.401 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.721 -13.292 9.834 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.350 -12.745 9.480 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.963 -13.858 8.234 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.736 -12.135 7.853 1.00 0.00 H new ATOM 1042 N GLY A 68 -1.746 -10.256 9.139 1.00 0.00 N ATOM 1043 CA GLY A 68 -1.763 -8.892 9.605 1.00 0.00 C ATOM 1044 C GLY A 68 -2.135 -7.927 8.506 1.00 0.00 C ATOM 1045 O GLY A 68 -1.630 -6.813 8.460 1.00 0.00 O ATOM 0 H GLY A 68 -1.082 -10.443 8.388 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.473 -8.798 10.427 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.781 -8.631 10.000 1.00 0.00 H new ATOM 1049 N VAL A 69 -2.999 -8.370 7.599 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.503 -7.497 6.549 1.00 0.00 C ATOM 1051 C VAL A 69 -4.788 -6.819 7.000 1.00 0.00 C ATOM 1052 O VAL A 69 -5.870 -7.406 6.975 1.00 0.00 O ATOM 1053 CB VAL A 69 -3.734 -8.232 5.205 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.414 -8.475 4.496 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.466 -9.548 5.402 1.00 0.00 C ATOM 0 H VAL A 69 -3.362 -9.323 7.571 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.731 -6.748 6.370 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.360 -7.588 4.587 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.597 -8.992 3.554 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.927 -7.520 4.297 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.769 -9.087 5.127 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.609 -10.033 4.436 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -3.879 -10.198 6.051 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.437 -9.359 5.860 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.649 -5.588 7.447 1.00 0.00 N ATOM 1066 CA GLU A 70 -5.778 -4.828 7.946 1.00 0.00 C ATOM 1067 C GLU A 70 -6.362 -3.965 6.840 1.00 0.00 C ATOM 1068 O GLU A 70 -5.665 -3.138 6.249 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.348 -3.961 9.126 1.00 0.00 C ATOM 1070 CG GLU A 70 -4.677 -4.756 10.235 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.285 -3.896 11.411 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -3.204 -3.278 11.365 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -5.058 -3.831 12.389 1.00 0.00 O ATOM 0 H GLU A 70 -3.760 -5.089 7.475 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.546 -5.523 8.285 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.662 -3.191 8.773 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.221 -3.449 9.531 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.353 -5.542 10.574 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -3.789 -5.248 9.838 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.635 -4.182 6.552 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.330 -3.436 5.520 1.00 0.00 C ATOM 1082 C GLU A 71 -9.339 -2.465 6.129 1.00 0.00 C ATOM 1083 O GLU A 71 -10.475 -2.829 6.429 1.00 0.00 O ATOM 1084 CB GLU A 71 -9.020 -4.387 4.524 1.00 0.00 C ATOM 1085 CG GLU A 71 -9.277 -5.801 5.050 1.00 0.00 C ATOM 1086 CD GLU A 71 -10.207 -5.848 6.247 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -11.441 -5.867 6.053 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -9.704 -5.873 7.391 1.00 0.00 O ATOM 0 H GLU A 71 -8.212 -4.877 7.025 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.589 -2.852 4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.972 -3.948 4.226 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.406 -4.456 3.626 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.701 -6.406 4.248 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -8.325 -6.256 5.323 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.911 -1.231 6.330 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.786 -0.211 6.878 1.00 0.00 C ATOM 1097 C LYS A 72 -10.184 0.777 5.789 1.00 0.00 C ATOM 1098 O LYS A 72 -9.347 1.485 5.243 1.00 0.00 O ATOM 1099 CB LYS A 72 -9.098 0.515 8.040 1.00 0.00 C ATOM 1100 CG LYS A 72 -9.979 1.549 8.726 1.00 0.00 C ATOM 1101 CD LYS A 72 -11.218 0.911 9.334 1.00 0.00 C ATOM 1102 CE LYS A 72 -12.095 1.937 10.035 1.00 0.00 C ATOM 1103 NZ LYS A 72 -11.417 2.563 11.203 1.00 0.00 N ATOM 0 H LYS A 72 -7.965 -0.912 6.122 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.688 -0.689 7.260 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -8.777 -0.221 8.777 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -8.199 1.007 7.668 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.409 2.054 9.506 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -10.277 2.310 8.005 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.793 0.415 8.552 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -10.919 0.142 10.046 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -12.379 2.713 9.325 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -13.015 1.457 10.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -12.105 3.124 11.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -11.019 1.820 11.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.652 3.183 10.869 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.462 0.800 5.459 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.967 1.706 4.441 1.00 0.00 C ATOM 1119 C LEU A 73 -12.569 2.951 5.077 1.00 0.00 C ATOM 1120 O LEU A 73 -13.614 2.889 5.729 1.00 0.00 O ATOM 1121 CB LEU A 73 -13.001 0.990 3.572 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.418 -0.006 2.569 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.479 -0.980 2.101 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.838 0.730 1.375 1.00 0.00 C ATOM 0 H LEU A 73 -12.171 0.201 5.881 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.136 2.020 3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.699 0.462 4.223 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.577 1.738 3.027 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.625 -0.565 3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.042 -1.679 1.388 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.870 -1.531 2.956 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.290 -0.432 1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.426 0.009 0.668 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.623 1.308 0.888 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.048 1.402 1.710 1.00 0.00 H new ATOM 1136 N THR A 74 -11.895 4.078 4.907 1.00 0.00 N ATOM 1137 CA THR A 74 -12.378 5.337 5.441 1.00 0.00 C ATOM 1138 C THR A 74 -13.017 6.178 4.343 1.00 0.00 C ATOM 1139 O THR A 74 -12.345 6.635 3.419 1.00 0.00 O ATOM 1140 CB THR A 74 -11.254 6.142 6.126 1.00 0.00 C ATOM 1141 OG1 THR A 74 -10.122 6.259 5.259 1.00 0.00 O ATOM 1142 CG2 THR A 74 -10.826 5.481 7.424 1.00 0.00 C ATOM 0 H THR A 74 -11.011 4.144 4.402 1.00 0.00 H new ATOM 0 HA THR A 74 -13.128 5.097 6.194 1.00 0.00 H new ATOM 0 HB THR A 74 -11.645 7.135 6.347 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.599 5.431 5.290 1.00 0.00 H new ATOM 0 HG21 THR A 74 -10.033 6.068 7.887 1.00 0.00 H new ATOM 0 HG22 THR A 74 -11.678 5.424 8.101 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.459 4.476 7.217 1.00 0.00 H new ATOM 1150 N TYR A 75 -14.322 6.352 4.436 1.00 0.00 N ATOM 1151 CA TYR A 75 -15.056 7.151 3.473 1.00 0.00 C ATOM 1152 C TYR A 75 -15.215 8.569 4.003 1.00 0.00 C ATOM 1153 O TYR A 75 -16.026 8.821 4.894 1.00 0.00 O ATOM 1154 CB TYR A 75 -16.422 6.520 3.194 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.332 5.083 2.722 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -16.225 4.039 3.633 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.344 4.771 1.370 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -16.127 2.728 3.209 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.251 3.462 0.939 1.00 0.00 C ATOM 1160 CZ TYR A 75 -16.140 2.445 1.862 1.00 0.00 C ATOM 1161 OH TYR A 75 -16.041 1.143 1.434 1.00 0.00 O ATOM 0 H TYR A 75 -14.899 5.948 5.174 1.00 0.00 H new ATOM 0 HA TYR A 75 -14.501 7.187 2.535 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -17.025 6.560 4.101 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.941 7.111 2.439 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -16.218 4.256 4.691 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.427 5.565 0.643 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -16.041 1.929 3.931 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.265 3.237 -0.117 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.192 0.538 2.190 1.00 0.00 H new ATOM 1171 N THR A 76 -14.417 9.481 3.477 1.00 0.00 N ATOM 1172 CA THR A 76 -14.381 10.842 3.979 1.00 0.00 C ATOM 1173 C THR A 76 -15.072 11.825 3.031 1.00 0.00 C ATOM 1174 O THR A 76 -14.445 12.753 2.508 1.00 0.00 O ATOM 1175 CB THR A 76 -12.930 11.277 4.237 1.00 0.00 C ATOM 1176 OG1 THR A 76 -12.037 10.384 3.556 1.00 0.00 O ATOM 1177 CG2 THR A 76 -12.621 11.274 5.727 1.00 0.00 C ATOM 0 H THR A 76 -13.783 9.302 2.699 1.00 0.00 H new ATOM 0 HA THR A 76 -14.933 10.857 4.919 1.00 0.00 H new ATOM 0 HB THR A 76 -12.797 12.291 3.861 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.666 10.831 2.767 1.00 0.00 H new ATOM 0 HG21 THR A 76 -11.588 11.585 5.885 1.00 0.00 H new ATOM 0 HG22 THR A 76 -13.291 11.965 6.239 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.762 10.269 6.126 1.00 0.00 H new ATOM 1185 N ASP A 77 -16.359 11.568 2.787 1.00 0.00 N ATOM 1186 CA ASP A 77 -17.265 12.497 2.099 1.00 0.00 C ATOM 1187 C ASP A 77 -17.046 12.518 0.591 1.00 0.00 C ATOM 1188 O ASP A 77 -17.965 12.251 -0.181 1.00 0.00 O ATOM 1189 CB ASP A 77 -17.128 13.916 2.669 1.00 0.00 C ATOM 1190 CG ASP A 77 -18.107 14.896 2.050 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -17.810 15.445 0.967 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -19.172 15.139 2.653 1.00 0.00 O ATOM 0 H ASP A 77 -16.810 10.696 3.065 1.00 0.00 H new ATOM 0 HA ASP A 77 -18.277 12.133 2.277 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -17.284 13.886 3.747 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -16.111 14.272 2.504 1.00 0.00 H new ATOM 1197 N THR A 78 -15.833 12.828 0.180 1.00 0.00 N ATOM 1198 CA THR A 78 -15.540 13.046 -1.234 1.00 0.00 C ATOM 1199 C THR A 78 -14.585 11.984 -1.773 1.00 0.00 C ATOM 1200 O THR A 78 -14.426 11.826 -2.985 1.00 0.00 O ATOM 1201 CB THR A 78 -14.915 14.437 -1.446 1.00 0.00 C ATOM 1202 OG1 THR A 78 -15.521 15.387 -0.557 1.00 0.00 O ATOM 1203 CG2 THR A 78 -15.097 14.906 -2.884 1.00 0.00 C ATOM 0 H THR A 78 -15.030 12.936 0.800 1.00 0.00 H new ATOM 0 HA THR A 78 -16.483 12.980 -1.776 1.00 0.00 H new ATOM 0 HB THR A 78 -13.848 14.362 -1.236 1.00 0.00 H new ATOM 0 HG1 THR A 78 -16.421 15.083 -0.318 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.646 15.891 -3.005 1.00 0.00 H new ATOM 0 HG22 THR A 78 -14.615 14.200 -3.561 1.00 0.00 H new ATOM 0 HG23 THR A 78 -16.160 14.963 -3.116 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.955 11.253 -0.871 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.969 10.261 -1.256 1.00 0.00 C ATOM 1213 C TYR A 79 -12.997 9.075 -0.306 1.00 0.00 C ATOM 1214 O TYR A 79 -13.388 9.205 0.855 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.564 10.887 -1.313 1.00 0.00 C ATOM 1216 CG TYR A 79 -11.233 11.800 -0.149 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -11.644 13.128 -0.148 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -10.504 11.342 0.941 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -11.346 13.968 0.906 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -10.200 12.178 1.999 1.00 0.00 C ATOM 1221 CZ TYR A 79 -10.624 13.490 1.976 1.00 0.00 C ATOM 1222 OH TYR A 79 -10.331 14.327 3.030 1.00 0.00 O ATOM 0 H TYR A 79 -14.109 11.328 0.134 1.00 0.00 H new ATOM 0 HA TYR A 79 -13.220 9.899 -2.253 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.825 10.087 -1.352 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.470 11.453 -2.240 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -12.207 13.509 -0.987 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -10.169 10.315 0.962 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -11.678 14.996 0.891 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.633 11.806 2.839 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.817 13.836 3.704 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.606 7.923 -0.815 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.572 6.704 -0.031 1.00 0.00 C ATOM 1234 C ALA A 80 -11.144 6.205 0.069 1.00 0.00 C ATOM 1235 O ALA A 80 -10.486 5.966 -0.943 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.472 5.648 -0.652 1.00 0.00 C ATOM 0 H ALA A 80 -12.303 7.806 -1.782 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.943 6.912 0.973 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.435 4.739 -0.051 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.497 6.018 -0.687 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.131 5.428 -1.664 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.653 6.070 1.282 1.00 0.00 N ATOM 1243 CA GLN A 81 -9.272 5.696 1.493 1.00 0.00 C ATOM 1244 C GLN A 81 -9.160 4.238 1.909 1.00 0.00 C ATOM 1245 O GLN A 81 -9.770 3.814 2.894 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.649 6.593 2.562 1.00 0.00 C ATOM 1247 CG GLN A 81 -7.132 6.611 2.539 1.00 0.00 C ATOM 1248 CD GLN A 81 -6.557 7.645 3.483 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -7.156 7.973 4.506 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -5.389 8.168 3.148 1.00 0.00 N ATOM 0 H GLN A 81 -11.190 6.214 2.137 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.734 5.825 0.554 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -9.017 7.610 2.429 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -8.984 6.259 3.544 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.755 5.625 2.810 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -6.788 6.816 1.525 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -4.924 7.870 2.291 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.954 8.870 3.747 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.395 3.470 1.147 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.072 2.110 1.525 1.00 0.00 C ATOM 1261 C GLU A 82 -6.881 2.138 2.467 1.00 0.00 C ATOM 1262 O GLU A 82 -5.728 2.156 2.021 1.00 0.00 O ATOM 1263 CB GLU A 82 -7.723 1.240 0.312 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.704 1.318 -0.847 1.00 0.00 C ATOM 1265 CD GLU A 82 -8.222 0.519 -2.047 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -7.456 1.074 -2.866 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -8.581 -0.669 -2.169 1.00 0.00 O ATOM 0 H GLU A 82 -7.987 3.770 0.262 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.949 1.676 2.005 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -6.736 1.528 -0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.653 0.202 0.638 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -9.676 0.943 -0.527 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.844 2.360 -1.136 1.00 0.00 H new ATOM 1274 N ASN A 83 -7.150 2.204 3.756 1.00 0.00 N ATOM 1275 CA ASN A 83 -6.099 2.169 4.754 1.00 0.00 C ATOM 1276 C ASN A 83 -5.654 0.729 4.936 1.00 0.00 C ATOM 1277 O ASN A 83 -6.226 -0.008 5.743 1.00 0.00 O ATOM 1278 CB ASN A 83 -6.585 2.738 6.095 1.00 0.00 C ATOM 1279 CG ASN A 83 -7.215 4.114 5.973 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -8.411 4.241 5.711 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -6.429 5.154 6.182 1.00 0.00 N ATOM 0 H ASN A 83 -8.092 2.283 4.138 1.00 0.00 H new ATOM 0 HA ASN A 83 -5.266 2.785 4.415 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.311 2.052 6.531 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -5.743 2.792 6.785 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -6.809 6.099 6.128 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.442 5.012 6.397 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.672 0.309 4.155 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.261 -1.084 4.157 1.00 0.00 C ATOM 1290 C VAL A 84 -2.953 -1.245 4.911 1.00 0.00 C ATOM 1291 O VAL A 84 -1.998 -0.502 4.691 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.105 -1.639 2.722 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -3.797 -3.130 2.744 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.356 -1.364 1.896 1.00 0.00 C ATOM 0 H VAL A 84 -4.149 0.908 3.516 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.045 -1.654 4.656 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.265 -1.125 2.254 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.692 -3.495 1.722 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -2.868 -3.302 3.288 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.610 -3.662 3.238 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.223 -1.763 0.891 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.215 -1.843 2.366 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.526 -0.289 1.840 1.00 0.00 H new ATOM 1304 N THR A 85 -2.922 -2.198 5.814 1.00 0.00 N ATOM 1305 CA THR A 85 -1.727 -2.487 6.571 1.00 0.00 C ATOM 1306 C THR A 85 -1.343 -3.937 6.344 1.00 0.00 C ATOM 1307 O THR A 85 -2.080 -4.835 6.726 1.00 0.00 O ATOM 1308 CB THR A 85 -1.947 -2.220 8.072 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.474 -0.897 8.254 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.646 -2.362 8.848 1.00 0.00 C ATOM 0 H THR A 85 -3.719 -2.791 6.043 1.00 0.00 H new ATOM 0 HA THR A 85 -0.922 -1.834 6.234 1.00 0.00 H new ATOM 0 HB THR A 85 -2.656 -2.956 8.451 1.00 0.00 H new ATOM 0 HG1 THR A 85 -2.615 -0.730 9.209 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.830 -2.168 9.905 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.258 -3.373 8.726 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.083 -1.646 8.469 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.224 -4.161 5.674 1.00 0.00 N ATOM 1319 CA ILE A 86 0.192 -5.508 5.326 1.00 0.00 C ATOM 1320 C ILE A 86 1.380 -5.952 6.170 1.00 0.00 C ATOM 1321 O ILE A 86 2.523 -5.586 5.889 1.00 0.00 O ATOM 1322 CB ILE A 86 0.563 -5.611 3.829 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.602 -5.128 2.958 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.942 -7.042 3.468 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.287 -5.102 1.477 1.00 0.00 C ATOM 0 H ILE A 86 0.411 -3.427 5.361 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.654 -6.165 5.528 1.00 0.00 H new ATOM 0 HB ILE A 86 1.425 -4.971 3.642 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.462 -5.776 3.126 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -0.891 -4.126 3.276 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.200 -7.094 2.410 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.798 -7.354 4.066 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.099 -7.703 3.669 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.159 -4.750 0.926 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.553 -4.431 1.295 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.028 -6.106 1.142 1.00 0.00 H new ATOM 1337 N ASP A 87 1.107 -6.706 7.224 1.00 0.00 N ATOM 1338 CA ASP A 87 2.175 -7.309 8.009 1.00 0.00 C ATOM 1339 C ASP A 87 2.840 -8.419 7.216 1.00 0.00 C ATOM 1340 O ASP A 87 2.246 -9.471 6.971 1.00 0.00 O ATOM 1341 CB ASP A 87 1.660 -7.856 9.345 1.00 0.00 C ATOM 1342 CG ASP A 87 1.485 -6.765 10.384 1.00 0.00 C ATOM 1343 OD1 ASP A 87 2.483 -6.088 10.708 1.00 0.00 O ATOM 1344 OD2 ASP A 87 0.353 -6.575 10.873 1.00 0.00 O ATOM 0 H ASP A 87 0.165 -6.914 7.554 1.00 0.00 H new ATOM 0 HA ASP A 87 2.905 -6.530 8.229 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.706 -8.359 9.186 1.00 0.00 H new ATOM 0 HB3 ASP A 87 2.357 -8.605 9.721 1.00 0.00 H new ATOM 1349 N MET A 88 4.080 -8.180 6.822 1.00 0.00 N ATOM 1350 CA MET A 88 4.827 -9.127 6.011 1.00 0.00 C ATOM 1351 C MET A 88 5.485 -10.182 6.883 1.00 0.00 C ATOM 1352 O MET A 88 6.314 -10.961 6.412 1.00 0.00 O ATOM 1353 CB MET A 88 5.897 -8.414 5.180 1.00 0.00 C ATOM 1354 CG MET A 88 5.339 -7.527 4.079 1.00 0.00 C ATOM 1355 SD MET A 88 6.629 -6.908 2.981 1.00 0.00 S ATOM 1356 CE MET A 88 5.645 -6.160 1.686 1.00 0.00 C ATOM 0 H MET A 88 4.594 -7.330 7.053 1.00 0.00 H new ATOM 0 HA MET A 88 4.120 -9.610 5.337 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.513 -7.807 5.844 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.552 -9.161 4.733 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.609 -8.089 3.497 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.810 -6.685 4.526 1.00 0.00 H new ATOM 0 HE1 MET A 88 6.097 -5.215 1.386 1.00 0.00 H new ATOM 0 HE2 MET A 88 5.602 -6.831 0.828 1.00 0.00 H new ATOM 0 HE3 MET A 88 4.636 -5.978 2.055 1.00 0.00 H new ATOM 1366 N GLU A 89 5.098 -10.219 8.151 1.00 0.00 N ATOM 1367 CA GLU A 89 5.664 -11.176 9.084 1.00 0.00 C ATOM 1368 C GLU A 89 4.977 -12.524 8.925 1.00 0.00 C ATOM 1369 O GLU A 89 5.451 -13.540 9.430 1.00 0.00 O ATOM 1370 CB GLU A 89 5.534 -10.682 10.528 1.00 0.00 C ATOM 1371 CG GLU A 89 6.199 -9.337 10.782 1.00 0.00 C ATOM 1372 CD GLU A 89 6.545 -9.130 12.244 1.00 0.00 C ATOM 1373 OE1 GLU A 89 5.656 -8.745 13.032 1.00 0.00 O ATOM 1374 OE2 GLU A 89 7.713 -9.369 12.619 1.00 0.00 O ATOM 0 H GLU A 89 4.396 -9.598 8.554 1.00 0.00 H new ATOM 0 HA GLU A 89 6.725 -11.286 8.860 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.477 -10.607 10.782 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.971 -11.424 11.196 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.107 -9.265 10.183 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.535 -8.538 10.452 1.00 0.00 H new ATOM 1381 N LYS A 90 3.856 -12.524 8.213 1.00 0.00 N ATOM 1382 CA LYS A 90 3.117 -13.749 7.959 1.00 0.00 C ATOM 1383 C LYS A 90 2.276 -13.610 6.688 1.00 0.00 C ATOM 1384 O LYS A 90 1.122 -14.034 6.642 1.00 0.00 O ATOM 1385 CB LYS A 90 2.218 -14.087 9.154 1.00 0.00 C ATOM 1386 CG LYS A 90 1.721 -15.529 9.147 1.00 0.00 C ATOM 1387 CD LYS A 90 0.777 -15.814 10.305 1.00 0.00 C ATOM 1388 CE LYS A 90 1.489 -15.731 11.643 1.00 0.00 C ATOM 1389 NZ LYS A 90 0.583 -16.065 12.771 1.00 0.00 N ATOM 0 H LYS A 90 3.441 -11.688 7.802 1.00 0.00 H new ATOM 0 HA LYS A 90 3.831 -14.561 7.818 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.768 -13.904 10.077 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.360 -13.414 9.156 1.00 0.00 H new ATOM 0 HG2 LYS A 90 1.211 -15.732 8.205 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.574 -16.206 9.200 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.047 -15.101 10.287 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.343 -16.806 10.185 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.339 -16.413 11.645 1.00 0.00 H new ATOM 0 HE3 LYS A 90 1.887 -14.726 11.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.105 -15.997 13.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.215 -15.399 12.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.223 -17.034 12.652 1.00 0.00 H new ATOM 1403 N VAL A 91 2.854 -13.011 5.654 1.00 0.00 N ATOM 1404 CA VAL A 91 2.161 -12.900 4.375 1.00 0.00 C ATOM 1405 C VAL A 91 1.981 -14.264 3.740 1.00 0.00 C ATOM 1406 O VAL A 91 2.930 -14.850 3.217 1.00 0.00 O ATOM 1407 CB VAL A 91 2.884 -11.984 3.363 1.00 0.00 C ATOM 1408 CG1 VAL A 91 2.312 -10.578 3.406 1.00 0.00 C ATOM 1409 CG2 VAL A 91 4.385 -11.969 3.608 1.00 0.00 C ATOM 0 H VAL A 91 3.787 -12.600 5.673 1.00 0.00 H new ATOM 0 HA VAL A 91 1.195 -12.451 4.606 1.00 0.00 H new ATOM 0 HB VAL A 91 2.716 -12.389 2.365 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.836 -9.950 2.685 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.251 -10.609 3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.438 -10.165 4.407 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.866 -11.316 2.880 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.586 -11.601 4.614 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.780 -12.980 3.506 1.00 0.00 H new ATOM 1419 N ASP A 92 0.768 -14.779 3.805 1.00 0.00 N ATOM 1420 CA ASP A 92 0.461 -16.030 3.141 1.00 0.00 C ATOM 1421 C ASP A 92 0.197 -15.756 1.673 1.00 0.00 C ATOM 1422 O ASP A 92 -0.909 -15.378 1.286 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.737 -16.734 3.784 1.00 0.00 C ATOM 1424 CG ASP A 92 -1.097 -18.026 3.072 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -0.369 -19.026 3.232 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -2.108 -18.049 2.350 1.00 0.00 O ATOM 0 H ASP A 92 -0.013 -14.355 4.306 1.00 0.00 H new ATOM 0 HA ASP A 92 1.315 -16.700 3.244 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.512 -16.948 4.829 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.597 -16.065 3.774 1.00 0.00 H new ATOM 1431 N PHE A 93 1.235 -15.918 0.864 1.00 0.00 N ATOM 1432 CA PHE A 93 1.159 -15.611 -0.558 1.00 0.00 C ATOM 1433 C PHE A 93 0.262 -16.603 -1.300 1.00 0.00 C ATOM 1434 O PHE A 93 0.062 -16.491 -2.506 1.00 0.00 O ATOM 1435 CB PHE A 93 2.558 -15.600 -1.181 1.00 0.00 C ATOM 1436 CG PHE A 93 3.404 -14.432 -0.758 1.00 0.00 C ATOM 1437 CD1 PHE A 93 3.093 -13.147 -1.176 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.516 -14.619 0.047 1.00 0.00 C ATOM 1439 CE1 PHE A 93 3.875 -12.072 -0.798 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.300 -13.547 0.429 1.00 0.00 C ATOM 1441 CZ PHE A 93 4.979 -12.272 0.006 1.00 0.00 C ATOM 0 H PHE A 93 2.145 -16.262 1.171 1.00 0.00 H new ATOM 0 HA PHE A 93 0.718 -14.619 -0.656 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.071 -16.524 -0.914 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.461 -15.592 -2.267 1.00 0.00 H new ATOM 0 HD1 PHE A 93 2.230 -12.984 -1.804 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.773 -15.614 0.380 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.622 -11.076 -1.131 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.163 -13.706 1.058 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.591 -11.433 0.304 1.00 0.00 H new ATOM 1451 N LYS A 94 -0.277 -17.570 -0.567 1.00 0.00 N ATOM 1452 CA LYS A 94 -1.160 -18.570 -1.143 1.00 0.00 C ATOM 1453 C LYS A 94 -2.604 -18.069 -1.130 1.00 0.00 C ATOM 1454 O LYS A 94 -3.363 -18.310 -2.067 1.00 0.00 O ATOM 1455 CB LYS A 94 -1.018 -19.890 -0.381 1.00 0.00 C ATOM 1456 CG LYS A 94 0.409 -20.420 -0.385 1.00 0.00 C ATOM 1457 CD LYS A 94 0.574 -21.688 0.443 1.00 0.00 C ATOM 1458 CE LYS A 94 -0.093 -22.895 -0.202 1.00 0.00 C ATOM 1459 NZ LYS A 94 -1.543 -22.985 0.118 1.00 0.00 N ATOM 0 H LYS A 94 -0.115 -17.681 0.434 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.879 -18.747 -2.181 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.345 -19.747 0.649 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.679 -20.634 -0.825 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.713 -20.621 -1.412 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.078 -19.651 0.001 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.636 -21.893 0.580 1.00 0.00 H new ATOM 0 HD3 LYS A 94 0.150 -21.529 1.434 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.034 -22.841 -1.283 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.407 -23.804 0.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.772 -23.953 0.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.772 -22.319 0.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.100 -22.746 -0.727 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.979 -17.372 -0.065 1.00 0.00 N ATOM 1474 CA ALA A 95 -4.264 -16.683 -0.015 1.00 0.00 C ATOM 1475 C ALA A 95 -4.151 -15.337 -0.712 1.00 0.00 C ATOM 1476 O ALA A 95 -5.093 -14.867 -1.352 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.723 -16.493 1.422 1.00 0.00 C ATOM 0 H ALA A 95 -2.412 -17.268 0.777 1.00 0.00 H new ATOM 0 HA ALA A 95 -5.006 -17.294 -0.529 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.683 -15.977 1.432 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.829 -17.466 1.902 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.987 -15.900 1.964 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.972 -14.733 -0.597 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.682 -13.462 -1.249 1.00 0.00 C ATOM 1485 C LEU A 96 -2.532 -13.679 -2.760 1.00 0.00 C ATOM 1486 O LEU A 96 -2.452 -12.733 -3.530 1.00 0.00 O ATOM 1487 CB LEU A 96 -1.407 -12.850 -0.637 1.00 0.00 C ATOM 1488 CG LEU A 96 -1.114 -11.378 -0.970 1.00 0.00 C ATOM 1489 CD1 LEU A 96 -0.426 -10.701 0.205 1.00 0.00 C ATOM 1490 CD2 LEU A 96 -0.234 -11.265 -2.207 1.00 0.00 C ATOM 0 H LEU A 96 -2.196 -15.109 -0.053 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.504 -12.764 -1.090 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.471 -12.947 0.447 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.555 -13.447 -0.961 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.064 -10.883 -1.170 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.224 -9.659 -0.043 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.073 -10.747 1.081 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.513 -11.212 0.420 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.041 -10.214 -2.422 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.711 -11.778 -2.029 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -0.741 -11.722 -3.057 1.00 0.00 H new ATOM 1502 N GLN A 97 -2.538 -14.946 -3.166 1.00 0.00 N ATOM 1503 CA GLN A 97 -2.417 -15.329 -4.573 1.00 0.00 C ATOM 1504 C GLN A 97 -3.557 -14.741 -5.411 1.00 0.00 C ATOM 1505 O GLN A 97 -3.418 -14.545 -6.618 1.00 0.00 O ATOM 1506 CB GLN A 97 -2.417 -16.857 -4.679 1.00 0.00 C ATOM 1507 CG GLN A 97 -2.212 -17.396 -6.085 1.00 0.00 C ATOM 1508 CD GLN A 97 -2.238 -18.912 -6.127 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -1.867 -19.580 -5.160 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -2.679 -19.469 -7.243 1.00 0.00 N ATOM 0 H GLN A 97 -2.627 -15.738 -2.529 1.00 0.00 H new ATOM 0 HA GLN A 97 -1.481 -14.930 -4.964 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -1.632 -17.252 -4.035 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -3.365 -17.234 -4.294 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -2.989 -17.003 -6.740 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -1.258 -17.040 -6.473 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -2.978 -18.883 -8.022 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -2.721 -20.485 -7.324 1.00 0.00 H new ATOM 1519 N GLY A 98 -4.680 -14.454 -4.763 1.00 0.00 N ATOM 1520 CA GLY A 98 -5.813 -13.879 -5.465 1.00 0.00 C ATOM 1521 C GLY A 98 -5.763 -12.363 -5.488 1.00 0.00 C ATOM 1522 O GLY A 98 -6.627 -11.712 -6.076 1.00 0.00 O ATOM 0 H GLY A 98 -4.827 -14.609 -3.766 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.834 -14.256 -6.488 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -6.737 -14.203 -4.987 1.00 0.00 H new ATOM 1526 N ILE A 99 -4.742 -11.809 -4.852 1.00 0.00 N ATOM 1527 CA ILE A 99 -4.571 -10.365 -4.740 1.00 0.00 C ATOM 1528 C ILE A 99 -3.092 -10.008 -4.849 1.00 0.00 C ATOM 1529 O ILE A 99 -2.318 -10.749 -5.454 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.126 -9.832 -3.396 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -4.653 -10.716 -2.236 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.645 -9.750 -3.437 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -5.096 -10.231 -0.874 1.00 0.00 C ATOM 0 H ILE A 99 -4.005 -12.348 -4.397 1.00 0.00 H new ATOM 0 HA ILE A 99 -5.129 -9.900 -5.553 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.741 -8.825 -3.235 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -5.026 -11.729 -2.389 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.565 -10.771 -2.255 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.015 -9.373 -2.483 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -6.952 -9.076 -4.237 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.058 -10.742 -3.620 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -4.722 -10.909 -0.107 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.701 -9.230 -0.698 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -6.185 -10.203 -0.834 1.00 0.00 H new ATOM 1648 N ASP A 108 6.327 -10.607 -9.201 1.00 0.00 N ATOM 1649 CA ASP A 108 7.326 -10.277 -8.188 1.00 0.00 C ATOM 1650 C ASP A 108 6.763 -10.506 -6.785 1.00 0.00 C ATOM 1651 O ASP A 108 7.503 -10.794 -5.845 1.00 0.00 O ATOM 1652 CB ASP A 108 7.781 -8.821 -8.348 1.00 0.00 C ATOM 1653 CG ASP A 108 9.162 -8.569 -7.763 1.00 0.00 C ATOM 1654 OD1 ASP A 108 10.171 -8.824 -8.467 1.00 0.00 O ATOM 1655 OD2 ASP A 108 9.249 -8.109 -6.608 1.00 0.00 O ATOM 0 HA ASP A 108 8.187 -10.931 -8.324 1.00 0.00 H new ATOM 0 HB2 ASP A 108 7.786 -8.561 -9.406 1.00 0.00 H new ATOM 0 HB3 ASP A 108 7.060 -8.164 -7.862 1.00 0.00 H new ATOM 1660 N ALA A 109 5.442 -10.399 -6.661 1.00 0.00 N ATOM 1661 CA ALA A 109 4.768 -10.595 -5.380 1.00 0.00 C ATOM 1662 C ALA A 109 4.860 -12.047 -4.917 1.00 0.00 C ATOM 1663 O ALA A 109 5.324 -12.326 -3.811 1.00 0.00 O ATOM 1664 CB ALA A 109 3.312 -10.160 -5.475 1.00 0.00 C ATOM 0 H ALA A 109 4.816 -10.177 -7.435 1.00 0.00 H new ATOM 0 HA ALA A 109 5.274 -9.976 -4.639 1.00 0.00 H new ATOM 0 HB1 ALA A 109 2.823 -10.312 -4.513 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.264 -9.105 -5.743 1.00 0.00 H new ATOM 0 HB3 ALA A 109 2.805 -10.751 -6.237 1.00 0.00 H new ATOM 1670 N LYS A 110 4.439 -12.975 -5.777 1.00 0.00 N ATOM 1671 CA LYS A 110 4.480 -14.404 -5.447 1.00 0.00 C ATOM 1672 C LYS A 110 5.914 -14.925 -5.510 1.00 0.00 C ATOM 1673 O LYS A 110 6.195 -16.082 -5.195 1.00 0.00 O ATOM 1674 CB LYS A 110 3.581 -15.209 -6.392 1.00 0.00 C ATOM 1675 CG LYS A 110 3.982 -15.127 -7.858 1.00 0.00 C ATOM 1676 CD LYS A 110 3.083 -15.996 -8.722 1.00 0.00 C ATOM 1677 CE LYS A 110 3.481 -15.949 -10.190 1.00 0.00 C ATOM 1678 NZ LYS A 110 4.854 -16.474 -10.419 1.00 0.00 N ATOM 0 H LYS A 110 4.067 -12.767 -6.704 1.00 0.00 H new ATOM 0 HA LYS A 110 4.106 -14.528 -4.431 1.00 0.00 H new ATOM 0 HB2 LYS A 110 3.591 -16.254 -6.082 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.555 -14.856 -6.288 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.926 -14.092 -8.196 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.018 -15.444 -7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 110 3.126 -17.026 -8.368 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.050 -15.666 -8.616 1.00 0.00 H new ATOM 0 HE2 LYS A 110 2.769 -16.531 -10.776 1.00 0.00 H new ATOM 0 HE3 LYS A 110 3.423 -14.921 -10.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 5.013 -16.597 -11.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.551 -15.802 -10.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.960 -17.391 -9.939 1.00 0.00 H new ATOM 1692 N LYS A 111 6.803 -14.047 -5.931 1.00 0.00 N ATOM 1693 CA LYS A 111 8.228 -14.324 -6.004 1.00 0.00 C ATOM 1694 C LYS A 111 8.878 -14.115 -4.633 1.00 0.00 C ATOM 1695 O LYS A 111 10.006 -14.546 -4.390 1.00 0.00 O ATOM 1696 CB LYS A 111 8.819 -13.398 -7.072 1.00 0.00 C ATOM 1697 CG LYS A 111 10.315 -13.154 -7.012 1.00 0.00 C ATOM 1698 CD LYS A 111 10.690 -12.098 -8.034 1.00 0.00 C ATOM 1699 CE LYS A 111 12.090 -11.556 -7.831 1.00 0.00 C ATOM 1700 NZ LYS A 111 12.354 -10.421 -8.753 1.00 0.00 N ATOM 0 H LYS A 111 6.554 -13.106 -6.237 1.00 0.00 H new ATOM 0 HA LYS A 111 8.418 -15.361 -6.280 1.00 0.00 H new ATOM 0 HB2 LYS A 111 8.581 -13.813 -8.051 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.314 -12.434 -7.003 1.00 0.00 H new ATOM 0 HG2 LYS A 111 10.602 -12.828 -6.012 1.00 0.00 H new ATOM 0 HG3 LYS A 111 10.855 -14.079 -7.213 1.00 0.00 H new ATOM 0 HD2 LYS A 111 10.611 -12.523 -9.035 1.00 0.00 H new ATOM 0 HD3 LYS A 111 9.976 -11.276 -7.980 1.00 0.00 H new ATOM 0 HE2 LYS A 111 12.212 -11.228 -6.799 1.00 0.00 H new ATOM 0 HE3 LYS A 111 12.820 -12.347 -8.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 13.285 -10.010 -8.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 12.342 -10.762 -9.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 11.619 -9.695 -8.630 1.00 0.00 H new ATOM 1714 N GLY A 112 8.142 -13.472 -3.734 1.00 0.00 N ATOM 1715 CA GLY A 112 8.649 -13.219 -2.401 1.00 0.00 C ATOM 1716 C GLY A 112 9.274 -11.849 -2.297 1.00 0.00 C ATOM 1717 O GLY A 112 10.391 -11.641 -2.758 1.00 0.00 O ATOM 0 H GLY A 112 7.200 -13.121 -3.907 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.837 -13.305 -1.679 1.00 0.00 H new ATOM 0 HA3 GLY A 112 9.388 -13.978 -2.142 1.00 0.00 H new ATOM 1721 N ILE A 113 8.550 -10.915 -1.699 1.00 0.00 N ATOM 1722 CA ILE A 113 8.991 -9.528 -1.626 1.00 0.00 C ATOM 1723 C ILE A 113 10.116 -9.345 -0.609 1.00 0.00 C ATOM 1724 O ILE A 113 9.940 -9.594 0.585 1.00 0.00 O ATOM 1725 CB ILE A 113 7.819 -8.589 -1.265 1.00 0.00 C ATOM 1726 CG1 ILE A 113 6.712 -8.687 -2.321 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.298 -7.150 -1.124 1.00 0.00 C ATOM 1728 CD1 ILE A 113 7.155 -8.276 -3.711 1.00 0.00 C ATOM 0 H ILE A 113 7.649 -11.093 -1.255 1.00 0.00 H new ATOM 0 HA ILE A 113 9.369 -9.267 -2.614 1.00 0.00 H new ATOM 0 HB ILE A 113 7.412 -8.905 -0.304 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.345 -9.713 -2.355 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.875 -8.059 -2.016 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.454 -6.509 -0.870 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.048 -7.092 -0.336 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.735 -6.818 -2.066 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.318 -8.372 -4.403 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.494 -7.240 -3.693 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.972 -8.920 -4.038 1.00 0.00 H new ATOM 1740 N THR A 114 11.273 -8.923 -1.096 1.00 0.00 N ATOM 1741 CA THR A 114 12.394 -8.586 -0.235 1.00 0.00 C ATOM 1742 C THR A 114 12.564 -7.071 -0.169 1.00 0.00 C ATOM 1743 O THR A 114 11.797 -6.328 -0.784 1.00 0.00 O ATOM 1744 CB THR A 114 13.703 -9.222 -0.741 1.00 0.00 C ATOM 1745 OG1 THR A 114 13.935 -8.846 -2.104 1.00 0.00 O ATOM 1746 CG2 THR A 114 13.655 -10.739 -0.627 1.00 0.00 C ATOM 0 H THR A 114 11.460 -8.805 -2.092 1.00 0.00 H new ATOM 0 HA THR A 114 12.179 -8.980 0.758 1.00 0.00 H new ATOM 0 HB THR A 114 14.520 -8.857 -0.119 1.00 0.00 H new ATOM 0 HG1 THR A 114 13.576 -9.536 -2.700 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.592 -11.161 -0.991 1.00 0.00 H new ATOM 0 HG22 THR A 114 13.511 -11.021 0.416 1.00 0.00 H new ATOM 0 HG23 THR A 114 12.828 -11.123 -1.224 1.00 0.00 H new ATOM 1754 N MET A 115 13.573 -6.616 0.559 1.00 0.00 N ATOM 1755 CA MET A 115 13.835 -5.190 0.678 1.00 0.00 C ATOM 1756 C MET A 115 14.458 -4.679 -0.617 1.00 0.00 C ATOM 1757 O MET A 115 14.068 -3.630 -1.134 1.00 0.00 O ATOM 1758 CB MET A 115 14.752 -4.915 1.877 1.00 0.00 C ATOM 1759 CG MET A 115 14.757 -3.465 2.338 1.00 0.00 C ATOM 1760 SD MET A 115 15.673 -2.368 1.242 1.00 0.00 S ATOM 1761 CE MET A 115 15.210 -0.776 1.912 1.00 0.00 C ATOM 0 H MET A 115 14.221 -7.211 1.074 1.00 0.00 H new ATOM 0 HA MET A 115 12.897 -4.661 0.848 1.00 0.00 H new ATOM 0 HB2 MET A 115 14.443 -5.548 2.709 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.770 -5.205 1.616 1.00 0.00 H new ATOM 0 HG2 MET A 115 13.728 -3.113 2.415 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.189 -3.411 3.337 1.00 0.00 H new ATOM 0 HE1 MET A 115 14.587 -0.245 1.192 1.00 0.00 H new ATOM 0 HE2 MET A 115 14.653 -0.919 2.838 1.00 0.00 H new ATOM 0 HE3 MET A 115 16.108 -0.192 2.115 1.00 0.00 H new ATOM 1771 N ALA A 116 15.398 -5.454 -1.155 1.00 0.00 N ATOM 1772 CA ALA A 116 16.052 -5.115 -2.416 1.00 0.00 C ATOM 1773 C ALA A 116 15.032 -5.018 -3.546 1.00 0.00 C ATOM 1774 O ALA A 116 15.207 -4.251 -4.495 1.00 0.00 O ATOM 1775 CB ALA A 116 17.122 -6.143 -2.750 1.00 0.00 C ATOM 0 H ALA A 116 15.724 -6.324 -0.735 1.00 0.00 H new ATOM 0 HA ALA A 116 16.528 -4.141 -2.304 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.601 -5.877 -3.692 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.869 -6.162 -1.956 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.664 -7.128 -2.841 1.00 0.00 H new ATOM 1781 N GLN A 117 13.968 -5.807 -3.444 1.00 0.00 N ATOM 1782 CA GLN A 117 12.871 -5.730 -4.397 1.00 0.00 C ATOM 1783 C GLN A 117 12.173 -4.387 -4.303 1.00 0.00 C ATOM 1784 O GLN A 117 12.190 -3.645 -5.260 1.00 0.00 O ATOM 1785 CB GLN A 117 11.896 -6.886 -4.197 1.00 0.00 C ATOM 1786 CG GLN A 117 12.228 -8.080 -5.076 1.00 0.00 C ATOM 1787 CD GLN A 117 11.684 -9.380 -4.534 1.00 0.00 C ATOM 1788 OE1 GLN A 117 12.368 -10.082 -3.791 1.00 0.00 O ATOM 1789 NE2 GLN A 117 10.459 -9.707 -4.889 1.00 0.00 N ATOM 0 H GLN A 117 13.843 -6.506 -2.711 1.00 0.00 H new ATOM 0 HA GLN A 117 13.281 -5.819 -5.403 1.00 0.00 H new ATOM 0 HB2 GLN A 117 11.910 -7.193 -3.151 1.00 0.00 H new ATOM 0 HB3 GLN A 117 10.884 -6.547 -4.416 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.825 -7.912 -6.075 1.00 0.00 H new ATOM 0 HG3 GLN A 117 13.310 -8.160 -5.178 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.927 -9.095 -5.508 1.00 0.00 H new ATOM 0 HE22 GLN A 117 10.042 -10.572 -4.545 1.00 0.00 H new ATOM 1798 N MET A 118 11.596 -4.068 -3.149 1.00 0.00 N ATOM 1799 CA MET A 118 10.937 -2.770 -2.937 1.00 0.00 C ATOM 1800 C MET A 118 11.750 -1.612 -3.530 1.00 0.00 C ATOM 1801 O MET A 118 11.216 -0.790 -4.271 1.00 0.00 O ATOM 1802 CB MET A 118 10.706 -2.523 -1.443 1.00 0.00 C ATOM 1803 CG MET A 118 9.704 -3.469 -0.786 1.00 0.00 C ATOM 1804 SD MET A 118 7.979 -3.097 -1.184 1.00 0.00 S ATOM 1805 CE MET A 118 7.864 -3.663 -2.879 1.00 0.00 C ATOM 0 H MET A 118 11.568 -4.688 -2.340 1.00 0.00 H new ATOM 0 HA MET A 118 9.978 -2.809 -3.453 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.660 -2.609 -0.923 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.360 -1.498 -1.308 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.926 -4.490 -1.095 1.00 0.00 H new ATOM 0 HG3 MET A 118 9.835 -3.428 0.295 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.892 -4.129 -3.042 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.978 -2.815 -3.554 1.00 0.00 H new ATOM 0 HE3 MET A 118 8.652 -4.390 -3.074 1.00 0.00 H new ATOM 1815 N GLU A 119 13.044 -1.579 -3.232 1.00 0.00 N ATOM 1816 CA GLU A 119 13.930 -0.526 -3.729 1.00 0.00 C ATOM 1817 C GLU A 119 13.940 -0.445 -5.261 1.00 0.00 C ATOM 1818 O GLU A 119 13.560 0.574 -5.841 1.00 0.00 O ATOM 1819 CB GLU A 119 15.351 -0.764 -3.220 1.00 0.00 C ATOM 1820 CG GLU A 119 15.521 -0.502 -1.734 1.00 0.00 C ATOM 1821 CD GLU A 119 15.436 0.971 -1.389 1.00 0.00 C ATOM 1822 OE1 GLU A 119 16.336 1.731 -1.808 1.00 0.00 O ATOM 1823 OE2 GLU A 119 14.487 1.376 -0.687 1.00 0.00 O ATOM 0 H GLU A 119 13.508 -2.273 -2.645 1.00 0.00 H new ATOM 0 HA GLU A 119 13.548 0.423 -3.353 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.635 -1.795 -3.433 1.00 0.00 H new ATOM 0 HB3 GLU A 119 16.037 -0.123 -3.773 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.754 -1.045 -1.183 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.485 -0.893 -1.408 1.00 0.00 H new ATOM 1830 N LEU A 120 14.366 -1.523 -5.912 1.00 0.00 N ATOM 1831 CA LEU A 120 14.537 -1.535 -7.368 1.00 0.00 C ATOM 1832 C LEU A 120 13.194 -1.552 -8.095 1.00 0.00 C ATOM 1833 O LEU A 120 13.087 -1.123 -9.242 1.00 0.00 O ATOM 1834 CB LEU A 120 15.367 -2.749 -7.802 1.00 0.00 C ATOM 1835 CG LEU A 120 16.885 -2.628 -7.628 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.269 -2.468 -6.164 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.576 -3.843 -8.225 1.00 0.00 C ATOM 0 H LEU A 120 14.601 -2.405 -5.456 1.00 0.00 H new ATOM 0 HA LEU A 120 15.061 -0.618 -7.638 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.026 -3.617 -7.238 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.157 -2.949 -8.853 1.00 0.00 H new ATOM 0 HG LEU A 120 17.213 -1.733 -8.156 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.353 -2.385 -6.079 1.00 0.00 H new ATOM 0 HD12 LEU A 120 16.804 -1.568 -5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 120 16.926 -3.336 -5.601 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.654 -3.748 -8.097 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.228 -4.744 -7.720 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.342 -3.909 -9.287 1.00 0.00 H new ATOM 1849 N VAL A 121 12.184 -2.046 -7.410 1.00 0.00 N ATOM 1850 CA VAL A 121 10.847 -2.195 -7.960 1.00 0.00 C ATOM 1851 C VAL A 121 10.088 -0.867 -7.919 1.00 0.00 C ATOM 1852 O VAL A 121 9.396 -0.509 -8.874 1.00 0.00 O ATOM 1853 CB VAL A 121 10.098 -3.313 -7.190 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.594 -3.204 -7.306 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.556 -4.680 -7.681 1.00 0.00 C ATOM 0 H VAL A 121 12.266 -2.360 -6.443 1.00 0.00 H new ATOM 0 HA VAL A 121 10.916 -2.485 -9.008 1.00 0.00 H new ATOM 0 HB VAL A 121 10.346 -3.190 -6.136 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.126 -4.014 -6.746 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.266 -2.247 -6.901 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.304 -3.273 -8.354 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.025 -5.460 -7.135 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.344 -4.774 -8.746 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.628 -4.786 -7.514 1.00 0.00 H new ATOM 1865 N MET A 122 10.241 -0.123 -6.827 1.00 0.00 N ATOM 1866 CA MET A 122 9.695 1.231 -6.747 1.00 0.00 C ATOM 1867 C MET A 122 10.413 2.136 -7.741 1.00 0.00 C ATOM 1868 O MET A 122 9.814 3.032 -8.341 1.00 0.00 O ATOM 1869 CB MET A 122 9.841 1.802 -5.332 1.00 0.00 C ATOM 1870 CG MET A 122 8.612 1.645 -4.437 1.00 0.00 C ATOM 1871 SD MET A 122 8.152 -0.072 -4.103 1.00 0.00 S ATOM 1872 CE MET A 122 7.129 -0.453 -5.522 1.00 0.00 C ATOM 0 H MET A 122 10.735 -0.431 -5.990 1.00 0.00 H new ATOM 0 HA MET A 122 8.634 1.185 -6.991 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.688 1.317 -4.847 1.00 0.00 H new ATOM 0 HB3 MET A 122 10.082 2.862 -5.408 1.00 0.00 H new ATOM 0 HG2 MET A 122 8.800 2.150 -3.489 1.00 0.00 H new ATOM 0 HG3 MET A 122 7.768 2.151 -4.906 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.746 -1.469 -5.432 1.00 0.00 H new ATOM 0 HE2 MET A 122 6.294 0.247 -5.567 1.00 0.00 H new ATOM 0 HE3 MET A 122 7.723 -0.369 -6.432 1.00 0.00 H new ATOM 1882 N LYS A 123 11.703 1.879 -7.914 1.00 0.00 N ATOM 1883 CA LYS A 123 12.531 2.638 -8.841 1.00 0.00 C ATOM 1884 C LYS A 123 12.190 2.285 -10.290 1.00 0.00 C ATOM 1885 O LYS A 123 12.283 3.129 -11.180 1.00 0.00 O ATOM 1886 CB LYS A 123 14.008 2.358 -8.545 1.00 0.00 C ATOM 1887 CG LYS A 123 14.983 3.070 -9.466 1.00 0.00 C ATOM 1888 CD LYS A 123 16.417 2.877 -9.000 1.00 0.00 C ATOM 1889 CE LYS A 123 17.409 3.465 -9.987 1.00 0.00 C ATOM 1890 NZ LYS A 123 17.426 2.712 -11.267 1.00 0.00 N ATOM 0 H LYS A 123 12.203 1.141 -7.418 1.00 0.00 H new ATOM 0 HA LYS A 123 12.335 3.702 -8.707 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.221 2.650 -7.517 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.182 1.284 -8.614 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.873 2.689 -10.481 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.748 4.134 -9.497 1.00 0.00 H new ATOM 0 HD2 LYS A 123 16.550 3.347 -8.026 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.618 1.814 -8.871 1.00 0.00 H new ATOM 0 HE2 LYS A 123 17.154 4.507 -10.182 1.00 0.00 H new ATOM 0 HE3 LYS A 123 18.407 3.458 -9.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 18.256 2.996 -11.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 17.475 1.692 -11.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.560 2.920 -11.803 1.00 0.00 H new ATOM 1904 N ALA A 124 11.771 1.043 -10.513 1.00 0.00 N ATOM 1905 CA ALA A 124 11.410 0.579 -11.850 1.00 0.00 C ATOM 1906 C ALA A 124 10.197 1.332 -12.390 1.00 0.00 C ATOM 1907 O ALA A 124 10.145 1.673 -13.570 1.00 0.00 O ATOM 1908 CB ALA A 124 11.139 -0.918 -11.838 1.00 0.00 C ATOM 0 H ALA A 124 11.673 0.337 -9.783 1.00 0.00 H new ATOM 0 HA ALA A 124 12.253 0.780 -12.511 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.871 -1.247 -12.842 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.033 -1.447 -11.509 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.318 -1.134 -11.154 1.00 0.00 H new ATOM 1914 N ALA A 125 9.227 1.592 -11.520 1.00 0.00 N ATOM 1915 CA ALA A 125 8.035 2.336 -11.916 1.00 0.00 C ATOM 1916 C ALA A 125 8.289 3.835 -11.843 1.00 0.00 C ATOM 1917 O ALA A 125 7.557 4.631 -12.434 1.00 0.00 O ATOM 1918 CB ALA A 125 6.849 1.959 -11.041 1.00 0.00 C ATOM 0 H ALA A 125 9.241 1.301 -10.542 1.00 0.00 H new ATOM 0 HA ALA A 125 7.800 2.074 -12.948 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.972 2.525 -11.354 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.647 0.893 -11.141 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.077 2.189 -10.000 1.00 0.00 H new ATOM 1924 N GLY A 126 9.334 4.213 -11.120 1.00 0.00 N ATOM 1925 CA GLY A 126 9.664 5.613 -10.967 1.00 0.00 C ATOM 1926 C GLY A 126 8.771 6.297 -9.955 1.00 0.00 C ATOM 1927 O GLY A 126 8.202 7.352 -10.233 1.00 0.00 O ATOM 0 H GLY A 126 9.961 3.571 -10.635 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.704 5.709 -10.656 1.00 0.00 H new ATOM 0 HA3 GLY A 126 9.572 6.115 -11.930 1.00 0.00 H new ATOM 1931 N PHE A 127 8.637 5.691 -8.784 1.00 0.00 N ATOM 1932 CA PHE A 127 7.807 6.256 -7.730 1.00 0.00 C ATOM 1933 C PHE A 127 8.532 7.388 -7.006 1.00 0.00 C ATOM 1934 O PHE A 127 9.686 7.694 -7.304 1.00 0.00 O ATOM 1935 CB PHE A 127 7.386 5.175 -6.733 1.00 0.00 C ATOM 1936 CG PHE A 127 6.387 4.195 -7.285 1.00 0.00 C ATOM 1937 CD1 PHE A 127 5.177 4.634 -7.796 1.00 0.00 C ATOM 1938 CD2 PHE A 127 6.650 2.835 -7.278 1.00 0.00 C ATOM 1939 CE1 PHE A 127 4.249 3.737 -8.290 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.727 1.933 -7.772 1.00 0.00 C ATOM 1941 CZ PHE A 127 4.525 2.385 -8.278 1.00 0.00 C ATOM 0 H PHE A 127 9.091 4.811 -8.540 1.00 0.00 H new ATOM 0 HA PHE A 127 6.912 6.667 -8.197 1.00 0.00 H new ATOM 0 HB2 PHE A 127 8.272 4.631 -6.406 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.962 5.654 -5.850 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.956 5.691 -7.809 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.588 2.475 -6.882 1.00 0.00 H new ATOM 0 HE1 PHE A 127 3.309 4.094 -8.685 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.946 0.875 -7.762 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.802 1.682 -8.664 1.00 0.00 H new ATOM 1951 N LYS A 128 7.845 8.007 -6.059 1.00 0.00 N ATOM 1952 CA LYS A 128 8.389 9.142 -5.331 1.00 0.00 C ATOM 1953 C LYS A 128 8.575 8.804 -3.855 1.00 0.00 C ATOM 1954 O LYS A 128 7.625 8.414 -3.174 1.00 0.00 O ATOM 1955 CB LYS A 128 7.455 10.346 -5.469 1.00 0.00 C ATOM 1956 CG LYS A 128 7.885 11.553 -4.653 1.00 0.00 C ATOM 1957 CD LYS A 128 6.797 12.612 -4.616 1.00 0.00 C ATOM 1958 CE LYS A 128 7.190 13.784 -3.735 1.00 0.00 C ATOM 1959 NZ LYS A 128 6.077 14.756 -3.577 1.00 0.00 N ATOM 0 H LYS A 128 6.902 7.740 -5.775 1.00 0.00 H new ATOM 0 HA LYS A 128 9.363 9.385 -5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 128 7.398 10.631 -6.520 1.00 0.00 H new ATOM 0 HB3 LYS A 128 6.451 10.052 -5.164 1.00 0.00 H new ATOM 0 HG2 LYS A 128 8.125 11.240 -3.637 1.00 0.00 H new ATOM 0 HG3 LYS A 128 8.794 11.977 -5.079 1.00 0.00 H new ATOM 0 HD2 LYS A 128 6.599 12.966 -5.627 1.00 0.00 H new ATOM 0 HD3 LYS A 128 5.872 12.171 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.492 13.416 -2.755 1.00 0.00 H new ATOM 0 HE3 LYS A 128 8.054 14.289 -4.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 6.386 15.541 -2.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.805 15.127 -4.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.261 14.281 -3.142 1.00 0.00 H new ATOM 1973 N GLU A 129 9.799 8.949 -3.367 1.00 0.00 N ATOM 1974 CA GLU A 129 10.078 8.764 -1.952 1.00 0.00 C ATOM 1975 C GLU A 129 9.751 10.036 -1.183 1.00 0.00 C ATOM 1976 O GLU A 129 10.213 11.120 -1.538 1.00 0.00 O ATOM 1977 CB GLU A 129 11.545 8.407 -1.715 1.00 0.00 C ATOM 1978 CG GLU A 129 11.978 7.079 -2.310 1.00 0.00 C ATOM 1979 CD GLU A 129 13.394 6.720 -1.909 1.00 0.00 C ATOM 1980 OE1 GLU A 129 14.339 7.170 -2.582 1.00 0.00 O ATOM 1981 OE2 GLU A 129 13.567 6.008 -0.898 1.00 0.00 O ATOM 0 H GLU A 129 10.613 9.194 -3.930 1.00 0.00 H new ATOM 0 HA GLU A 129 9.455 7.942 -1.600 1.00 0.00 H new ATOM 0 HB2 GLU A 129 12.169 9.197 -2.132 1.00 0.00 H new ATOM 0 HB3 GLU A 129 11.731 8.387 -0.641 1.00 0.00 H new ATOM 0 HG2 GLU A 129 11.297 6.294 -1.982 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.909 7.127 -3.397 1.00 0.00 H new ATOM 1988 N VAL A 130 8.951 9.903 -0.139 1.00 0.00 N ATOM 1989 CA VAL A 130 8.664 11.026 0.737 1.00 0.00 C ATOM 1990 C VAL A 130 9.717 11.075 1.834 1.00 0.00 C ATOM 1991 O VAL A 130 10.256 12.134 2.145 1.00 0.00 O ATOM 1992 CB VAL A 130 7.258 10.917 1.366 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.938 12.151 2.196 1.00 0.00 C ATOM 1994 CG2 VAL A 130 6.206 10.712 0.288 1.00 0.00 C ATOM 0 H VAL A 130 8.490 9.031 0.122 1.00 0.00 H new ATOM 0 HA VAL A 130 8.688 11.941 0.145 1.00 0.00 H new ATOM 0 HB VAL A 130 7.249 10.051 2.028 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.943 12.050 2.629 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.672 12.252 2.995 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.969 13.036 1.560 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.222 10.637 0.750 1.00 0.00 H new ATOM 0 HG22 VAL A 130 6.221 11.557 -0.400 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.420 9.794 -0.260 1.00 0.00 H new ATOM 2004 N LYS A 131 9.998 9.895 2.386 1.00 0.00 N ATOM 2005 CA LYS A 131 11.045 9.693 3.390 1.00 0.00 C ATOM 2006 C LYS A 131 10.796 10.535 4.642 1.00 0.00 C ATOM 2007 O LYS A 131 11.048 11.737 4.667 1.00 0.00 O ATOM 2008 CB LYS A 131 12.426 9.998 2.801 1.00 0.00 C ATOM 2009 CG LYS A 131 13.556 9.252 3.491 1.00 0.00 C ATOM 2010 CD LYS A 131 14.899 9.567 2.856 1.00 0.00 C ATOM 2011 CE LYS A 131 15.987 8.626 3.351 1.00 0.00 C ATOM 2012 NZ LYS A 131 15.763 7.230 2.891 1.00 0.00 N ATOM 0 H LYS A 131 9.498 9.039 2.145 1.00 0.00 H new ATOM 0 HA LYS A 131 11.017 8.645 3.687 1.00 0.00 H new ATOM 0 HB2 LYS A 131 12.425 9.742 1.742 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.613 11.070 2.870 1.00 0.00 H new ATOM 0 HG2 LYS A 131 13.580 9.521 4.547 1.00 0.00 H new ATOM 0 HG3 LYS A 131 13.370 8.179 3.439 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.816 9.490 1.772 1.00 0.00 H new ATOM 0 HD3 LYS A 131 15.177 10.596 3.083 1.00 0.00 H new ATOM 0 HE2 LYS A 131 16.957 8.974 2.996 1.00 0.00 H new ATOM 0 HE3 LYS A 131 16.019 8.649 4.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 16.648 6.690 2.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 15.028 6.785 3.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 15.456 7.237 1.897 1.00 0.00 H new