USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1001 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 100 SER OG : rot 180:sc= -0.308 USER MOD Set 1.2: A 111 ASN : amide:sc= -0.648 K(o=-0.96,f=-1.9) USER MOD Set 1.3: A 113 MET CE :methyl -165:sc= 0 (180deg=0) USER MOD Set 2.1: A 19 MET CE :methyl -173:sc=-0.000615 (180deg=-0.188) USER MOD Set 2.2: A 75 THR OG1 : rot 180:sc= 0.0173 USER MOD Set 3.1: A 8 GLN : amide:sc= 0.951 K(o=-1.4,f=-2.1) USER MOD Set 3.2: A 10 GLN : amide:sc= -2.4! C(o=-1.4!,f=-1.4!) USER MOD Single : A 4 SER OG : rot -31:sc= 0.179 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -12:sc= 1.08 USER MOD Single : A 11 SER OG : rot 6:sc= 0.341 USER MOD Single : A 12 GLN : amide:sc= -1.6 K(o=-1.6,f=-0.028) USER MOD Single : A 14 ASN : amide:sc= -3.01 K(o=-3,f=-1) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 1.12 (180deg=1.12) USER MOD Single : A 22 MET CE :methyl 164:sc= -0.0985 (180deg=-0.511) USER MOD Single : A 30 GLN : amide:sc= -0.705 X(o=-0.71,f=-0.6) USER MOD Single : A 31 LYS NZ :NH3+ 150:sc= 1.22 (180deg=0.638) USER MOD Single : A 33 LYS NZ :NH3+ 140:sc= 0.863 (180deg=-0.0202) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= -0.916 USER MOD Single : A 43 HIS : no HD1:sc= -3.76! C(o=-3.8!,f=-8.5!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -158:sc= 1.23 (180deg=0.754) USER MOD Single : A 49 LYS NZ :NH3+ 172:sc= 1.23 (180deg=1.2) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0236 USER MOD Single : A 54 TYR OH : rot 180:sc= -0.0637 USER MOD Single : A 56 SER OG : rot -35:sc= 0.0434 USER MOD Single : A 57 LYS NZ :NH3+ 170:sc= 0.667! (180deg=0.308!) USER MOD Single : A 60 HIS : no HE2:sc= 0.376 K(o=0.38,f=-5.7!) USER MOD Single : A 61 ASN : amide:sc= -1.23 K(o=-1.2,f=-3.2!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -130:sc= -0.0563 USER MOD Single : A 73 THR OG1 : rot -70:sc= 0.628 USER MOD Single : A 74 MET CE :methyl 152:sc= -0.0392 (180deg=-0.498) USER MOD Single : A 78 LYS NZ :NH3+ -162:sc= -0.0933 (180deg=-0.42) USER MOD Single : A 80 LYS NZ :NH3+ -165:sc= -0.0289 (180deg=-0.218) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl -171:sc= -1.24 (180deg=-1.31) USER MOD Single : A 89 ASN : amide:sc= -7.58! C(o=-7.6!,f=-7.1!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -153:sc= -1.38 (180deg=-3.92!) USER MOD Single : A 93 THR OG1 : rot -160:sc= -0.567 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 70:sc= 1.1 USER MOD Single : A 105 ASN : amide:sc= -0.191! X(o=-0.19!,f=-0.47) USER MOD Single : A 108 THR OG1 : rot 33:sc= 1.18 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 130:sc= -0.282 USER MOD Single : A 121 LYS NZ :NH3+ -170:sc=-0.00301 (180deg=-0.109) USER MOD Single : A 124 SER OG : rot -130:sc= -0.216 USER MOD Single : A 125 LYS NZ :NH3+ -159:sc= 1.24 (180deg=0.822) USER MOD ----------------------------------------------------------------- ATOM 54 N SER A 4 5.102 -12.380 5.134 1.00 0.00 N ATOM 55 CA SER A 4 5.054 -11.339 6.150 1.00 0.00 C ATOM 56 C SER A 4 6.435 -10.769 6.473 1.00 0.00 C ATOM 57 O SER A 4 7.436 -11.140 5.853 1.00 0.00 O ATOM 58 CB SER A 4 4.406 -11.903 7.411 1.00 0.00 C ATOM 59 OG SER A 4 5.027 -13.108 7.825 1.00 0.00 O ATOM 0 HA SER A 4 4.461 -10.514 5.756 1.00 0.00 H new ATOM 0 HB2 SER A 4 4.469 -11.167 8.213 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.347 -12.084 7.226 1.00 0.00 H new ATOM 0 HG SER A 4 5.371 -13.585 7.041 1.00 0.00 H new ATOM 65 N GLY A 5 6.466 -9.868 7.451 1.00 0.00 N ATOM 66 CA GLY A 5 7.693 -9.210 7.850 1.00 0.00 C ATOM 67 C GLY A 5 7.533 -7.709 7.861 1.00 0.00 C ATOM 68 O GLY A 5 6.458 -7.198 7.560 1.00 0.00 O ATOM 0 H GLY A 5 5.644 -9.579 7.982 1.00 0.00 H new ATOM 0 HA2 GLY A 5 7.986 -9.554 8.842 1.00 0.00 H new ATOM 0 HA3 GLY A 5 8.495 -9.487 7.166 1.00 0.00 H new ATOM 72 N LYS A 6 8.589 -6.998 8.216 1.00 0.00 N ATOM 73 CA LYS A 6 8.548 -5.547 8.209 1.00 0.00 C ATOM 74 C LYS A 6 9.364 -5.034 7.039 1.00 0.00 C ATOM 75 O LYS A 6 10.541 -5.343 6.905 1.00 0.00 O ATOM 76 CB LYS A 6 9.075 -4.932 9.521 1.00 0.00 C ATOM 77 CG LYS A 6 8.665 -5.669 10.801 1.00 0.00 C ATOM 78 CD LYS A 6 9.452 -6.945 11.054 1.00 0.00 C ATOM 79 CE LYS A 6 10.947 -6.699 11.062 1.00 0.00 C ATOM 80 NZ LYS A 6 11.704 -7.944 11.347 1.00 0.00 N ATOM 0 H LYS A 6 9.479 -7.399 8.511 1.00 0.00 H new ATOM 0 HA LYS A 6 7.505 -5.246 8.113 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.163 -4.896 9.475 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.725 -3.902 9.586 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.793 -4.999 11.651 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.604 -5.913 10.745 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.150 -7.373 12.010 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.210 -7.679 10.285 1.00 0.00 H new ATOM 0 HE2 LYS A 6 11.256 -6.298 10.097 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.188 -5.946 11.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 12.724 -7.739 11.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 11.427 -8.313 12.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.492 -8.654 10.617 1.00 0.00 H new ATOM 94 N TYR A 7 8.723 -4.270 6.187 1.00 0.00 N ATOM 95 CA TYR A 7 9.347 -3.741 4.995 1.00 0.00 C ATOM 96 C TYR A 7 9.127 -2.241 4.962 1.00 0.00 C ATOM 97 O TYR A 7 8.000 -1.773 5.059 1.00 0.00 O ATOM 98 CB TYR A 7 8.744 -4.399 3.749 1.00 0.00 C ATOM 99 CG TYR A 7 8.807 -5.915 3.757 1.00 0.00 C ATOM 100 CD1 TYR A 7 7.939 -6.665 4.542 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.721 -6.595 2.969 1.00 0.00 C ATOM 102 CE1 TYR A 7 7.990 -8.044 4.546 1.00 0.00 C ATOM 103 CE2 TYR A 7 9.776 -7.977 2.968 1.00 0.00 C ATOM 104 CZ TYR A 7 8.909 -8.696 3.757 1.00 0.00 C ATOM 105 OH TYR A 7 8.957 -10.071 3.759 1.00 0.00 O ATOM 0 H TYR A 7 7.747 -3.995 6.301 1.00 0.00 H new ATOM 0 HA TYR A 7 10.416 -3.955 5.006 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.703 -4.090 3.656 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.267 -4.029 2.867 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.212 -6.159 5.160 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.402 -6.036 2.345 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.311 -8.609 5.167 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.498 -8.490 2.349 1.00 0.00 H new ATOM 0 HH TYR A 7 8.418 -10.416 4.501 1.00 0.00 H new ATOM 115 N GLN A 8 10.195 -1.487 4.835 1.00 0.00 N ATOM 116 CA GLN A 8 10.111 -0.046 4.963 1.00 0.00 C ATOM 117 C GLN A 8 9.931 0.568 3.586 1.00 0.00 C ATOM 118 O GLN A 8 10.612 0.170 2.636 1.00 0.00 O ATOM 119 CB GLN A 8 11.384 0.488 5.620 1.00 0.00 C ATOM 120 CG GLN A 8 11.199 1.798 6.355 1.00 0.00 C ATOM 121 CD GLN A 8 12.315 2.783 6.085 1.00 0.00 C ATOM 122 OE1 GLN A 8 13.327 2.804 6.788 1.00 0.00 O ATOM 123 NE2 GLN A 8 12.145 3.607 5.064 1.00 0.00 N ATOM 0 H GLN A 8 11.131 -1.844 4.644 1.00 0.00 H new ATOM 0 HA GLN A 8 9.258 0.220 5.588 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.759 -0.259 6.320 1.00 0.00 H new ATOM 0 HB3 GLN A 8 12.148 0.619 4.854 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.248 2.243 6.061 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.143 1.604 7.426 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.293 3.558 4.506 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.866 4.291 4.835 1.00 0.00 H new ATOM 132 N VAL A 9 9.001 1.510 3.458 1.00 0.00 N ATOM 133 CA VAL A 9 8.819 2.186 2.191 1.00 0.00 C ATOM 134 C VAL A 9 10.023 3.085 1.942 1.00 0.00 C ATOM 135 O VAL A 9 10.503 3.785 2.838 1.00 0.00 O ATOM 136 CB VAL A 9 7.491 2.983 2.103 1.00 0.00 C ATOM 137 CG1 VAL A 9 7.668 4.397 2.548 1.00 0.00 C ATOM 138 CG2 VAL A 9 6.935 2.940 0.690 1.00 0.00 C ATOM 0 H VAL A 9 8.376 1.814 4.204 1.00 0.00 H new ATOM 0 HA VAL A 9 8.747 1.428 1.411 1.00 0.00 H new ATOM 0 HB VAL A 9 6.778 2.508 2.777 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.717 4.924 2.472 1.00 0.00 H new ATOM 0 HG12 VAL A 9 8.010 4.413 3.583 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.406 4.888 1.914 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.003 3.504 0.648 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.657 3.379 0.001 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.745 1.905 0.405 1.00 0.00 H new ATOM 148 N GLN A 10 10.523 3.018 0.735 1.00 0.00 N ATOM 149 CA GLN A 10 11.777 3.645 0.385 1.00 0.00 C ATOM 150 C GLN A 10 11.571 4.743 -0.639 1.00 0.00 C ATOM 151 O GLN A 10 12.170 5.815 -0.564 1.00 0.00 O ATOM 152 CB GLN A 10 12.709 2.588 -0.158 1.00 0.00 C ATOM 153 CG GLN A 10 13.126 1.607 0.887 1.00 0.00 C ATOM 154 CD GLN A 10 14.352 2.068 1.642 1.00 0.00 C ATOM 155 OE1 GLN A 10 14.250 2.724 2.678 1.00 0.00 O ATOM 156 NE2 GLN A 10 15.519 1.762 1.110 1.00 0.00 N ATOM 0 H GLN A 10 10.073 2.526 -0.037 1.00 0.00 H new ATOM 0 HA GLN A 10 12.210 4.104 1.274 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.218 2.059 -0.974 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.594 3.068 -0.576 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.305 1.454 1.588 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.330 0.644 0.419 1.00 0.00 H new ATOM 0 HE21 GLN A 10 15.560 1.216 0.249 1.00 0.00 H new ATOM 0 HE22 GLN A 10 16.381 2.071 1.559 1.00 0.00 H new ATOM 165 N SER A 11 10.706 4.460 -1.593 1.00 0.00 N ATOM 166 CA SER A 11 10.432 5.370 -2.687 1.00 0.00 C ATOM 167 C SER A 11 9.057 5.085 -3.261 1.00 0.00 C ATOM 168 O SER A 11 8.577 3.952 -3.182 1.00 0.00 O ATOM 169 CB SER A 11 11.489 5.212 -3.775 1.00 0.00 C ATOM 170 OG SER A 11 12.753 5.687 -3.340 1.00 0.00 O ATOM 0 H SER A 11 10.173 3.591 -1.631 1.00 0.00 H new ATOM 0 HA SER A 11 10.459 6.393 -2.312 1.00 0.00 H new ATOM 0 HB2 SER A 11 11.570 4.162 -4.056 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.180 5.758 -4.667 1.00 0.00 H new ATOM 0 HG SER A 11 12.701 5.935 -2.393 1.00 0.00 H new ATOM 176 N GLN A 12 8.419 6.102 -3.815 1.00 0.00 N ATOM 177 CA GLN A 12 7.150 5.909 -4.489 1.00 0.00 C ATOM 178 C GLN A 12 7.089 6.704 -5.772 1.00 0.00 C ATOM 179 O GLN A 12 7.678 7.777 -5.901 1.00 0.00 O ATOM 180 CB GLN A 12 5.946 6.292 -3.628 1.00 0.00 C ATOM 181 CG GLN A 12 5.842 5.543 -2.304 1.00 0.00 C ATOM 182 CD GLN A 12 6.304 6.360 -1.107 1.00 0.00 C ATOM 183 OE1 GLN A 12 5.822 6.165 0.005 1.00 0.00 O ATOM 184 NE2 GLN A 12 7.233 7.277 -1.324 1.00 0.00 N ATOM 0 H GLN A 12 8.758 7.064 -3.811 1.00 0.00 H new ATOM 0 HA GLN A 12 7.094 4.841 -4.699 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.990 7.361 -3.422 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.036 6.115 -4.202 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.807 5.238 -2.148 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.437 4.632 -2.363 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.609 7.409 -2.263 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.573 7.851 -0.553 1.00 0.00 H new ATOM 193 N GLU A 13 6.368 6.148 -6.705 1.00 0.00 N ATOM 194 CA GLU A 13 6.108 6.759 -7.980 1.00 0.00 C ATOM 195 C GLU A 13 4.699 7.320 -8.006 1.00 0.00 C ATOM 196 O GLU A 13 3.755 6.629 -7.633 1.00 0.00 O ATOM 197 CB GLU A 13 6.238 5.702 -9.057 1.00 0.00 C ATOM 198 CG GLU A 13 7.644 5.470 -9.585 1.00 0.00 C ATOM 199 CD GLU A 13 8.634 5.030 -8.525 1.00 0.00 C ATOM 200 OE1 GLU A 13 8.748 3.811 -8.287 1.00 0.00 O ATOM 201 OE2 GLU A 13 9.319 5.898 -7.941 1.00 0.00 O ATOM 0 H GLU A 13 5.933 5.232 -6.597 1.00 0.00 H new ATOM 0 HA GLU A 13 6.819 7.567 -8.150 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.857 4.760 -8.663 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.597 5.981 -9.893 1.00 0.00 H new ATOM 0 HG2 GLU A 13 7.607 4.714 -10.369 1.00 0.00 H new ATOM 0 HG3 GLU A 13 8.005 6.390 -10.046 1.00 0.00 H new ATOM 208 N ASN A 14 4.567 8.573 -8.415 1.00 0.00 N ATOM 209 CA ASN A 14 3.262 9.160 -8.713 1.00 0.00 C ATOM 210 C ASN A 14 2.372 9.348 -7.500 1.00 0.00 C ATOM 211 O ASN A 14 1.160 9.454 -7.635 1.00 0.00 O ATOM 212 CB ASN A 14 2.505 8.304 -9.691 1.00 0.00 C ATOM 213 CG ASN A 14 2.703 8.711 -11.113 1.00 0.00 C ATOM 214 OD1 ASN A 14 3.760 9.189 -11.520 1.00 0.00 O ATOM 215 ND2 ASN A 14 1.654 8.532 -11.859 1.00 0.00 N ATOM 0 H ASN A 14 5.352 9.210 -8.550 1.00 0.00 H new ATOM 0 HA ASN A 14 3.491 10.143 -9.124 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.817 7.266 -9.571 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.442 8.347 -9.453 1.00 0.00 H new ATOM 0 HD21 ASN A 14 1.678 8.794 -12.845 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.806 8.130 -11.459 1.00 0.00 H new ATOM 222 N PHE A 15 2.958 9.390 -6.342 1.00 0.00 N ATOM 223 CA PHE A 15 2.222 9.663 -5.095 1.00 0.00 C ATOM 224 C PHE A 15 1.681 11.106 -5.049 1.00 0.00 C ATOM 225 O PHE A 15 1.314 11.606 -3.991 1.00 0.00 O ATOM 226 CB PHE A 15 3.112 9.386 -3.877 1.00 0.00 C ATOM 227 CG PHE A 15 4.393 10.175 -3.864 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.520 9.702 -4.515 1.00 0.00 C ATOM 229 CD2 PHE A 15 4.470 11.384 -3.196 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.697 10.424 -4.505 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.644 12.109 -3.184 1.00 0.00 C ATOM 232 CZ PHE A 15 6.759 11.628 -3.837 1.00 0.00 C ATOM 0 H PHE A 15 3.958 9.239 -6.210 1.00 0.00 H new ATOM 0 HA PHE A 15 1.364 8.992 -5.069 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.550 9.610 -2.970 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.352 8.323 -3.849 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.478 8.757 -5.037 1.00 0.00 H new ATOM 0 HD2 PHE A 15 3.602 11.764 -2.678 1.00 0.00 H new ATOM 0 HE1 PHE A 15 7.568 10.046 -5.020 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.690 13.054 -2.663 1.00 0.00 H new ATOM 0 HZ PHE A 15 7.679 12.193 -3.825 1.00 0.00 H new ATOM 242 N GLU A 16 1.629 11.754 -6.204 1.00 0.00 N ATOM 243 CA GLU A 16 1.282 13.172 -6.312 1.00 0.00 C ATOM 244 C GLU A 16 0.239 13.405 -7.412 1.00 0.00 C ATOM 245 O GLU A 16 -0.734 14.117 -7.196 1.00 0.00 O ATOM 246 CB GLU A 16 2.552 13.972 -6.562 1.00 0.00 C ATOM 247 CG GLU A 16 3.580 13.728 -5.503 1.00 0.00 C ATOM 248 CD GLU A 16 4.903 14.411 -5.772 1.00 0.00 C ATOM 249 OE1 GLU A 16 5.611 13.989 -6.706 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.256 15.353 -5.045 1.00 0.00 O ATOM 0 H GLU A 16 1.827 11.311 -7.101 1.00 0.00 H new ATOM 0 HA GLU A 16 0.830 13.508 -5.379 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.963 13.706 -7.536 1.00 0.00 H new ATOM 0 HB3 GLU A 16 2.311 15.035 -6.597 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.191 14.073 -4.545 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.747 12.655 -5.411 1.00 0.00 H new ATOM 257 N PRO A 17 0.394 12.787 -8.601 1.00 0.00 N ATOM 258 CA PRO A 17 -0.659 12.783 -9.604 1.00 0.00 C ATOM 259 C PRO A 17 -1.798 11.917 -9.138 1.00 0.00 C ATOM 260 O PRO A 17 -2.959 12.131 -9.474 1.00 0.00 O ATOM 261 CB PRO A 17 -0.020 12.176 -10.825 1.00 0.00 C ATOM 262 CG PRO A 17 1.108 11.372 -10.307 1.00 0.00 C ATOM 263 CD PRO A 17 1.566 12.036 -9.044 1.00 0.00 C ATOM 0 HA PRO A 17 -1.059 13.779 -9.796 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -0.728 11.555 -11.374 1.00 0.00 H new ATOM 0 HB3 PRO A 17 0.328 12.947 -11.513 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.795 10.346 -10.113 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.917 11.326 -11.036 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.878 11.305 -8.298 1.00 0.00 H new ATOM 0 HD3 PRO A 17 2.418 12.692 -9.223 1.00 0.00 H new ATOM 271 N PHE A 18 -1.426 10.939 -8.339 1.00 0.00 N ATOM 272 CA PHE A 18 -2.360 10.062 -7.694 1.00 0.00 C ATOM 273 C PHE A 18 -3.188 10.858 -6.709 1.00 0.00 C ATOM 274 O PHE A 18 -4.406 10.841 -6.760 1.00 0.00 O ATOM 275 CB PHE A 18 -1.563 8.961 -6.995 1.00 0.00 C ATOM 276 CG PHE A 18 -2.375 8.001 -6.167 1.00 0.00 C ATOM 277 CD1 PHE A 18 -2.960 8.380 -4.967 1.00 0.00 C ATOM 278 CD2 PHE A 18 -2.560 6.709 -6.616 1.00 0.00 C ATOM 279 CE1 PHE A 18 -3.710 7.481 -4.236 1.00 0.00 C ATOM 280 CE2 PHE A 18 -3.309 5.806 -5.890 1.00 0.00 C ATOM 281 CZ PHE A 18 -3.887 6.192 -4.699 1.00 0.00 C ATOM 0 H PHE A 18 -0.451 10.734 -8.121 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.042 9.607 -8.412 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.021 8.393 -7.751 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -0.818 9.428 -6.352 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.827 9.388 -4.602 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.112 6.400 -7.549 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.158 7.786 -3.302 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -3.442 4.798 -6.254 1.00 0.00 H new ATOM 0 HZ PHE A 18 -4.476 5.488 -4.130 1.00 0.00 H new ATOM 291 N MET A 19 -2.509 11.584 -5.838 1.00 0.00 N ATOM 292 CA MET A 19 -3.192 12.457 -4.883 1.00 0.00 C ATOM 293 C MET A 19 -3.994 13.518 -5.607 1.00 0.00 C ATOM 294 O MET A 19 -5.079 13.865 -5.168 1.00 0.00 O ATOM 295 CB MET A 19 -2.218 13.167 -3.938 1.00 0.00 C ATOM 296 CG MET A 19 -1.444 12.260 -2.998 1.00 0.00 C ATOM 297 SD MET A 19 -2.488 11.045 -2.162 1.00 0.00 S ATOM 298 CE MET A 19 -3.597 12.114 -1.246 1.00 0.00 C ATOM 0 H MET A 19 -1.491 11.591 -5.768 1.00 0.00 H new ATOM 0 HA MET A 19 -3.845 11.810 -4.297 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.505 13.734 -4.537 1.00 0.00 H new ATOM 0 HB3 MET A 19 -2.777 13.888 -3.341 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.670 11.738 -3.562 1.00 0.00 H new ATOM 0 HG3 MET A 19 -0.937 12.870 -2.250 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.219 11.511 -0.584 1.00 0.00 H new ATOM 0 HE2 MET A 19 -3.015 12.820 -0.653 1.00 0.00 H new ATOM 0 HE3 MET A 19 -4.232 12.662 -1.942 1.00 0.00 H new ATOM 308 N LYS A 20 -3.472 14.043 -6.708 1.00 0.00 N ATOM 309 CA LYS A 20 -4.153 15.126 -7.392 1.00 0.00 C ATOM 310 C LYS A 20 -5.432 14.615 -8.044 1.00 0.00 C ATOM 311 O LYS A 20 -6.450 15.310 -8.083 1.00 0.00 O ATOM 312 CB LYS A 20 -3.233 15.819 -8.402 1.00 0.00 C ATOM 313 CG LYS A 20 -3.204 15.231 -9.804 1.00 0.00 C ATOM 314 CD LYS A 20 -2.313 16.097 -10.670 1.00 0.00 C ATOM 315 CE LYS A 20 -1.466 15.283 -11.622 1.00 0.00 C ATOM 316 NZ LYS A 20 -0.337 16.080 -12.170 1.00 0.00 N ATOM 0 H LYS A 20 -2.597 13.742 -7.137 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.429 15.880 -6.655 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.533 16.864 -8.476 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -2.218 15.806 -8.005 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.828 14.208 -9.778 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.211 15.190 -10.219 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -2.930 16.792 -11.240 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.663 16.697 -10.032 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.076 14.407 -11.104 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -2.086 14.919 -12.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.222 15.490 -12.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.711 16.902 -12.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.269 16.406 -11.390 1.00 0.00 H new ATOM 330 N ALA A 21 -5.363 13.392 -8.545 1.00 0.00 N ATOM 331 CA ALA A 21 -6.535 12.688 -9.049 1.00 0.00 C ATOM 332 C ALA A 21 -7.449 12.271 -7.896 1.00 0.00 C ATOM 333 O ALA A 21 -8.660 12.110 -8.056 1.00 0.00 O ATOM 334 CB ALA A 21 -6.101 11.471 -9.847 1.00 0.00 C ATOM 0 H ALA A 21 -4.496 12.859 -8.614 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.094 13.359 -9.701 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -6.981 10.949 -10.221 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.483 11.788 -10.687 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.527 10.802 -9.206 1.00 0.00 H new ATOM 340 N MET A 22 -6.838 12.109 -6.734 1.00 0.00 N ATOM 341 CA MET A 22 -7.510 11.636 -5.530 1.00 0.00 C ATOM 342 C MET A 22 -8.244 12.768 -4.798 1.00 0.00 C ATOM 343 O MET A 22 -9.380 12.595 -4.364 1.00 0.00 O ATOM 344 CB MET A 22 -6.464 10.965 -4.629 1.00 0.00 C ATOM 345 CG MET A 22 -6.892 10.759 -3.197 1.00 0.00 C ATOM 346 SD MET A 22 -8.372 9.741 -3.031 1.00 0.00 S ATOM 347 CE MET A 22 -7.811 8.206 -3.766 1.00 0.00 C ATOM 0 H MET A 22 -5.846 12.305 -6.596 1.00 0.00 H new ATOM 0 HA MET A 22 -8.278 10.913 -5.805 1.00 0.00 H new ATOM 0 HB2 MET A 22 -6.205 9.997 -5.058 1.00 0.00 H new ATOM 0 HB3 MET A 22 -5.557 11.570 -4.638 1.00 0.00 H new ATOM 0 HG2 MET A 22 -6.076 10.293 -2.645 1.00 0.00 H new ATOM 0 HG3 MET A 22 -7.074 11.730 -2.737 1.00 0.00 H new ATOM 0 HE1 MET A 22 -8.492 7.401 -3.491 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.789 8.309 -4.851 1.00 0.00 H new ATOM 0 HE3 MET A 22 -6.810 7.974 -3.404 1.00 0.00 H new ATOM 357 N GLY A 23 -7.600 13.919 -4.670 1.00 0.00 N ATOM 358 CA GLY A 23 -8.214 15.041 -4.000 1.00 0.00 C ATOM 359 C GLY A 23 -7.203 16.083 -3.560 1.00 0.00 C ATOM 360 O GLY A 23 -7.431 17.283 -3.719 1.00 0.00 O ATOM 0 H GLY A 23 -6.658 14.094 -5.021 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.941 15.504 -4.667 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.764 14.683 -3.129 1.00 0.00 H new ATOM 364 N LEU A 24 -6.081 15.628 -3.013 1.00 0.00 N ATOM 365 CA LEU A 24 -5.050 16.517 -2.521 1.00 0.00 C ATOM 366 C LEU A 24 -4.219 17.045 -3.684 1.00 0.00 C ATOM 367 O LEU A 24 -3.725 16.272 -4.497 1.00 0.00 O ATOM 368 CB LEU A 24 -4.160 15.754 -1.546 1.00 0.00 C ATOM 369 CG LEU A 24 -3.072 16.572 -0.867 1.00 0.00 C ATOM 370 CD1 LEU A 24 -3.649 17.323 0.311 1.00 0.00 C ATOM 371 CD2 LEU A 24 -1.934 15.673 -0.447 1.00 0.00 C ATOM 0 H LEU A 24 -5.867 14.637 -2.901 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.509 17.363 -2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.792 15.313 -0.775 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.689 14.930 -2.082 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.677 17.305 -1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -2.863 17.906 0.791 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.437 17.992 -0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.063 16.613 1.027 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.160 16.268 0.038 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.303 14.920 0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.516 15.181 -1.325 1.00 0.00 H new ATOM 383 N PRO A 25 -4.042 18.363 -3.778 1.00 0.00 N ATOM 384 CA PRO A 25 -3.303 18.972 -4.878 1.00 0.00 C ATOM 385 C PRO A 25 -1.809 18.734 -4.744 1.00 0.00 C ATOM 386 O PRO A 25 -1.313 18.616 -3.622 1.00 0.00 O ATOM 387 CB PRO A 25 -3.622 20.454 -4.731 1.00 0.00 C ATOM 388 CG PRO A 25 -3.812 20.618 -3.276 1.00 0.00 C ATOM 389 CD PRO A 25 -4.501 19.367 -2.805 1.00 0.00 C ATOM 0 HA PRO A 25 -3.580 18.560 -5.848 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -2.810 21.079 -5.104 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -4.518 20.730 -5.287 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.856 20.751 -2.770 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -4.413 21.501 -3.058 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.214 19.105 -1.786 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -5.586 19.474 -2.814 1.00 0.00 H new ATOM 397 N GLU A 26 -1.098 18.660 -5.864 1.00 0.00 N ATOM 398 CA GLU A 26 0.332 18.424 -5.839 1.00 0.00 C ATOM 399 C GLU A 26 1.019 19.367 -4.889 1.00 0.00 C ATOM 400 O GLU A 26 1.800 18.908 -4.085 1.00 0.00 O ATOM 401 CB GLU A 26 0.926 18.556 -7.235 1.00 0.00 C ATOM 402 CG GLU A 26 1.794 17.373 -7.639 1.00 0.00 C ATOM 403 CD GLU A 26 2.062 17.323 -9.133 1.00 0.00 C ATOM 404 OE1 GLU A 26 1.166 16.886 -9.891 1.00 0.00 O ATOM 405 OE2 GLU A 26 3.173 17.705 -9.559 1.00 0.00 O ATOM 0 H GLU A 26 -1.493 18.761 -6.799 1.00 0.00 H new ATOM 0 HA GLU A 26 0.495 17.405 -5.487 1.00 0.00 H new ATOM 0 HB2 GLU A 26 0.117 18.666 -7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.522 19.467 -7.283 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.743 17.426 -7.106 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.306 16.448 -7.331 1.00 0.00 H new ATOM 412 N ASP A 27 0.677 20.654 -4.903 1.00 0.00 N ATOM 413 CA ASP A 27 1.344 21.600 -4.009 1.00 0.00 C ATOM 414 C ASP A 27 1.194 21.153 -2.568 1.00 0.00 C ATOM 415 O ASP A 27 2.166 21.094 -1.854 1.00 0.00 O ATOM 416 CB ASP A 27 0.823 23.017 -4.164 1.00 0.00 C ATOM 417 CG ASP A 27 1.589 23.998 -3.296 1.00 0.00 C ATOM 418 OD1 ASP A 27 2.787 24.242 -3.573 1.00 0.00 O ATOM 419 OD2 ASP A 27 1.003 24.537 -2.338 1.00 0.00 O ATOM 0 H ASP A 27 -0.039 21.059 -5.506 1.00 0.00 H new ATOM 0 HA ASP A 27 2.398 21.609 -4.287 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.899 23.320 -5.208 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.234 23.046 -3.900 1.00 0.00 H new ATOM 424 N LEU A 28 0.012 20.707 -2.176 1.00 0.00 N ATOM 425 CA LEU A 28 -0.187 20.282 -0.790 1.00 0.00 C ATOM 426 C LEU A 28 0.603 19.013 -0.532 1.00 0.00 C ATOM 427 O LEU A 28 1.113 18.797 0.568 1.00 0.00 O ATOM 428 CB LEU A 28 -1.669 20.076 -0.478 1.00 0.00 C ATOM 429 CG LEU A 28 -2.446 21.371 -0.259 1.00 0.00 C ATOM 430 CD1 LEU A 28 -3.939 21.125 -0.146 1.00 0.00 C ATOM 431 CD2 LEU A 28 -1.960 22.033 0.997 1.00 0.00 C ATOM 0 H LEU A 28 -0.809 20.629 -2.776 1.00 0.00 H new ATOM 0 HA LEU A 28 0.174 21.069 -0.128 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.128 19.524 -1.298 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.759 19.456 0.414 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.276 22.012 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.453 22.073 0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.302 20.661 -1.063 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.136 20.463 0.697 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.512 22.959 1.157 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.117 21.365 1.844 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.897 22.256 0.903 1.00 0.00 H new ATOM 443 N ILE A 29 0.707 18.190 -1.558 1.00 0.00 N ATOM 444 CA ILE A 29 1.592 17.043 -1.532 1.00 0.00 C ATOM 445 C ILE A 29 3.051 17.488 -1.395 1.00 0.00 C ATOM 446 O ILE A 29 3.768 16.991 -0.564 1.00 0.00 O ATOM 447 CB ILE A 29 1.468 16.243 -2.821 1.00 0.00 C ATOM 448 CG1 ILE A 29 0.025 15.924 -3.101 1.00 0.00 C ATOM 449 CG2 ILE A 29 2.252 14.963 -2.723 1.00 0.00 C ATOM 450 CD1 ILE A 29 -0.220 15.538 -4.517 1.00 0.00 C ATOM 0 H ILE A 29 0.184 18.297 -2.427 1.00 0.00 H new ATOM 0 HA ILE A 29 1.305 16.430 -0.678 1.00 0.00 H new ATOM 0 HB ILE A 29 1.868 16.846 -3.636 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.295 15.112 -2.448 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.588 16.791 -2.855 1.00 0.00 H new ATOM 0 HG21 ILE A 29 2.152 14.403 -3.653 1.00 0.00 H new ATOM 0 HG22 ILE A 29 3.303 15.193 -2.548 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.869 14.364 -1.896 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.279 15.320 -4.657 1.00 0.00 H new ATOM 0 HD12 ILE A 29 0.071 16.358 -5.173 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.368 14.653 -4.760 1.00 0.00 H new ATOM 462 N GLN A 30 3.438 18.470 -2.203 1.00 0.00 N ATOM 463 CA GLN A 30 4.840 18.941 -2.333 1.00 0.00 C ATOM 464 C GLN A 30 5.458 19.298 -0.995 1.00 0.00 C ATOM 465 O GLN A 30 6.638 19.040 -0.752 1.00 0.00 O ATOM 466 CB GLN A 30 4.914 20.192 -3.230 1.00 0.00 C ATOM 467 CG GLN A 30 4.258 20.027 -4.556 1.00 0.00 C ATOM 468 CD GLN A 30 4.755 18.815 -5.312 1.00 0.00 C ATOM 469 OE1 GLN A 30 5.722 18.894 -6.066 1.00 0.00 O ATOM 470 NE2 GLN A 30 4.087 17.695 -5.128 1.00 0.00 N ATOM 0 H GLN A 30 2.787 18.978 -2.801 1.00 0.00 H new ATOM 0 HA GLN A 30 5.395 18.112 -2.773 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.449 21.029 -2.708 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.961 20.454 -3.384 1.00 0.00 H new ATOM 0 HG2 GLN A 30 3.180 19.944 -4.415 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.433 20.920 -5.156 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.290 17.675 -4.492 1.00 0.00 H new ATOM 0 HE22 GLN A 30 4.367 16.847 -5.621 1.00 0.00 H new ATOM 479 N LYS A 31 4.666 19.895 -0.139 1.00 0.00 N ATOM 480 CA LYS A 31 5.145 20.312 1.164 1.00 0.00 C ATOM 481 C LYS A 31 5.441 19.094 2.014 1.00 0.00 C ATOM 482 O LYS A 31 6.324 19.112 2.871 1.00 0.00 O ATOM 483 CB LYS A 31 4.127 21.196 1.852 1.00 0.00 C ATOM 484 CG LYS A 31 4.048 22.622 1.287 1.00 0.00 C ATOM 485 CD LYS A 31 3.444 22.679 -0.114 1.00 0.00 C ATOM 486 CE LYS A 31 4.500 22.694 -1.218 1.00 0.00 C ATOM 487 NZ LYS A 31 4.811 24.072 -1.675 1.00 0.00 N ATOM 0 H LYS A 31 3.684 20.105 -0.318 1.00 0.00 H new ATOM 0 HA LYS A 31 6.061 20.888 1.031 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.145 20.730 1.772 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.368 21.251 2.914 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.452 23.240 1.959 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.049 23.053 1.262 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.789 21.820 -0.257 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.823 23.571 -0.200 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.411 22.219 -0.854 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.148 22.103 -2.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.798 24.116 -2.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.177 24.329 -2.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.676 24.738 -0.888 1.00 0.00 H new ATOM 501 N GLY A 32 4.696 18.034 1.757 1.00 0.00 N ATOM 502 CA GLY A 32 4.834 16.830 2.526 1.00 0.00 C ATOM 503 C GLY A 32 5.116 15.605 1.663 1.00 0.00 C ATOM 504 O GLY A 32 4.754 14.493 2.027 1.00 0.00 O ATOM 0 H GLY A 32 3.992 17.991 1.020 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.643 16.955 3.246 1.00 0.00 H new ATOM 0 HA3 GLY A 32 3.921 16.663 3.098 1.00 0.00 H new ATOM 508 N LYS A 33 5.765 15.814 0.520 1.00 0.00 N ATOM 509 CA LYS A 33 5.850 14.784 -0.520 1.00 0.00 C ATOM 510 C LYS A 33 6.883 13.713 -0.212 1.00 0.00 C ATOM 511 O LYS A 33 6.659 12.527 -0.440 1.00 0.00 O ATOM 512 CB LYS A 33 6.178 15.433 -1.860 1.00 0.00 C ATOM 513 CG LYS A 33 7.430 16.270 -1.834 1.00 0.00 C ATOM 514 CD LYS A 33 7.642 17.047 -3.124 1.00 0.00 C ATOM 515 CE LYS A 33 8.508 16.307 -4.132 1.00 0.00 C ATOM 516 NZ LYS A 33 7.864 15.068 -4.639 1.00 0.00 N ATOM 0 H LYS A 33 6.241 16.686 0.288 1.00 0.00 H new ATOM 0 HA LYS A 33 4.878 14.292 -0.558 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.287 14.654 -2.614 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.339 16.058 -2.166 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.379 16.968 -0.998 1.00 0.00 H new ATOM 0 HG3 LYS A 33 8.290 15.624 -1.658 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.673 17.262 -3.575 1.00 0.00 H new ATOM 0 HD3 LYS A 33 8.105 18.006 -2.891 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.727 16.967 -4.971 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.461 16.053 -3.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 8.049 14.973 -5.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 8.254 14.244 -4.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.838 15.118 -4.476 1.00 0.00 H new ATOM 530 N ASP A 34 8.006 14.130 0.328 1.00 0.00 N ATOM 531 CA ASP A 34 9.171 13.259 0.398 1.00 0.00 C ATOM 532 C ASP A 34 9.254 12.575 1.755 1.00 0.00 C ATOM 533 O ASP A 34 10.258 12.666 2.465 1.00 0.00 O ATOM 534 CB ASP A 34 10.444 14.059 0.117 1.00 0.00 C ATOM 535 CG ASP A 34 11.558 13.191 -0.424 1.00 0.00 C ATOM 536 OD1 ASP A 34 11.455 12.759 -1.590 1.00 0.00 O ATOM 537 OD2 ASP A 34 12.543 12.942 0.300 1.00 0.00 O ATOM 0 H ASP A 34 8.143 15.060 0.724 1.00 0.00 H new ATOM 0 HA ASP A 34 9.071 12.485 -0.363 1.00 0.00 H new ATOM 0 HB2 ASP A 34 10.223 14.851 -0.599 1.00 0.00 H new ATOM 0 HB3 ASP A 34 10.777 14.543 1.035 1.00 0.00 H new ATOM 542 N ILE A 35 8.172 11.911 2.114 1.00 0.00 N ATOM 543 CA ILE A 35 8.092 11.171 3.358 1.00 0.00 C ATOM 544 C ILE A 35 8.327 9.676 3.140 1.00 0.00 C ATOM 545 O ILE A 35 7.774 9.073 2.220 1.00 0.00 O ATOM 546 CB ILE A 35 6.721 11.377 4.019 1.00 0.00 C ATOM 547 CG1 ILE A 35 6.393 12.860 4.068 1.00 0.00 C ATOM 548 CG2 ILE A 35 6.720 10.814 5.430 1.00 0.00 C ATOM 549 CD1 ILE A 35 7.432 13.639 4.807 1.00 0.00 C ATOM 0 H ILE A 35 7.323 11.870 1.550 1.00 0.00 H new ATOM 0 HA ILE A 35 8.876 11.553 4.012 1.00 0.00 H new ATOM 0 HB ILE A 35 5.969 10.853 3.429 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.305 13.246 3.052 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.424 13.001 4.548 1.00 0.00 H new ATOM 0 HG21 ILE A 35 5.741 10.969 5.883 1.00 0.00 H new ATOM 0 HG22 ILE A 35 6.939 9.747 5.396 1.00 0.00 H new ATOM 0 HG23 ILE A 35 7.479 11.322 6.025 1.00 0.00 H new ATOM 0 HD11 ILE A 35 7.157 14.694 4.817 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.502 13.272 5.831 1.00 0.00 H new ATOM 0 HD13 ILE A 35 8.396 13.520 4.312 1.00 0.00 H new ATOM 561 N LYS A 36 9.171 9.096 3.981 1.00 0.00 N ATOM 562 CA LYS A 36 9.386 7.652 4.001 1.00 0.00 C ATOM 563 C LYS A 36 8.787 7.058 5.275 1.00 0.00 C ATOM 564 O LYS A 36 8.750 7.710 6.318 1.00 0.00 O ATOM 565 CB LYS A 36 10.880 7.313 3.867 1.00 0.00 C ATOM 566 CG LYS A 36 11.830 8.337 4.458 1.00 0.00 C ATOM 567 CD LYS A 36 11.794 8.349 5.970 1.00 0.00 C ATOM 568 CE LYS A 36 12.707 9.425 6.495 1.00 0.00 C ATOM 569 NZ LYS A 36 12.901 9.330 7.963 1.00 0.00 N ATOM 0 H LYS A 36 9.725 9.609 4.667 1.00 0.00 H new ATOM 0 HA LYS A 36 8.880 7.208 3.144 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.063 6.352 4.347 1.00 0.00 H new ATOM 0 HB3 LYS A 36 11.115 7.191 2.810 1.00 0.00 H new ATOM 0 HG2 LYS A 36 12.845 8.123 4.123 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.572 9.327 4.083 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.775 8.523 6.317 1.00 0.00 H new ATOM 0 HD3 LYS A 36 12.101 7.378 6.358 1.00 0.00 H new ATOM 0 HE2 LYS A 36 13.674 9.353 5.997 1.00 0.00 H new ATOM 0 HE3 LYS A 36 12.293 10.403 6.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.536 10.090 8.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.982 9.425 8.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.321 8.408 8.199 1.00 0.00 H new ATOM 583 N GLY A 37 8.290 5.837 5.179 1.00 0.00 N ATOM 584 CA GLY A 37 7.608 5.217 6.295 1.00 0.00 C ATOM 585 C GLY A 37 7.865 3.728 6.359 1.00 0.00 C ATOM 586 O GLY A 37 8.667 3.209 5.590 1.00 0.00 O ATOM 0 H GLY A 37 8.347 5.259 4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 37 7.937 5.682 7.224 1.00 0.00 H new ATOM 0 HA3 GLY A 37 6.536 5.397 6.210 1.00 0.00 H new ATOM 590 N VAL A 38 7.171 3.029 7.250 1.00 0.00 N ATOM 591 CA VAL A 38 7.441 1.614 7.482 1.00 0.00 C ATOM 592 C VAL A 38 6.182 0.784 7.274 1.00 0.00 C ATOM 593 O VAL A 38 5.086 1.238 7.586 1.00 0.00 O ATOM 594 CB VAL A 38 7.970 1.380 8.916 1.00 0.00 C ATOM 595 CG1 VAL A 38 8.292 -0.072 9.163 1.00 0.00 C ATOM 596 CG2 VAL A 38 9.172 2.250 9.189 1.00 0.00 C ATOM 0 H VAL A 38 6.420 3.416 7.822 1.00 0.00 H new ATOM 0 HA VAL A 38 8.201 1.304 6.765 1.00 0.00 H new ATOM 0 HB VAL A 38 7.176 1.659 9.608 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.661 -0.195 10.181 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.392 -0.672 9.028 1.00 0.00 H new ATOM 0 HG13 VAL A 38 9.056 -0.400 8.458 1.00 0.00 H new ATOM 0 HG21 VAL A 38 9.529 2.070 10.203 1.00 0.00 H new ATOM 0 HG22 VAL A 38 9.963 2.011 8.478 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.894 3.299 9.083 1.00 0.00 H new ATOM 606 N SER A 39 6.335 -0.414 6.729 1.00 0.00 N ATOM 607 CA SER A 39 5.217 -1.330 6.593 1.00 0.00 C ATOM 608 C SER A 39 5.530 -2.649 7.296 1.00 0.00 C ATOM 609 O SER A 39 6.493 -3.319 6.966 1.00 0.00 O ATOM 610 CB SER A 39 4.922 -1.583 5.112 1.00 0.00 C ATOM 611 OG SER A 39 4.797 -0.360 4.404 1.00 0.00 O ATOM 0 H SER A 39 7.222 -0.772 6.375 1.00 0.00 H new ATOM 0 HA SER A 39 4.338 -0.883 7.057 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.722 -2.181 4.675 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.003 -2.160 5.014 1.00 0.00 H new ATOM 0 HG SER A 39 4.610 -0.546 3.460 1.00 0.00 H new ATOM 617 N GLU A 40 4.713 -3.017 8.258 1.00 0.00 N ATOM 618 CA GLU A 40 4.890 -4.268 8.976 1.00 0.00 C ATOM 619 C GLU A 40 3.706 -5.170 8.723 1.00 0.00 C ATOM 620 O GLU A 40 2.569 -4.801 8.963 1.00 0.00 O ATOM 621 CB GLU A 40 5.023 -4.007 10.466 1.00 0.00 C ATOM 622 CG GLU A 40 6.315 -3.367 10.871 1.00 0.00 C ATOM 623 CD GLU A 40 6.246 -2.710 12.233 1.00 0.00 C ATOM 624 OE1 GLU A 40 5.617 -1.640 12.352 1.00 0.00 O ATOM 625 OE2 GLU A 40 6.821 -3.266 13.195 1.00 0.00 O ATOM 0 H GLU A 40 3.912 -2.465 8.566 1.00 0.00 H new ATOM 0 HA GLU A 40 5.800 -4.752 8.621 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.200 -3.368 10.785 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.918 -4.952 10.999 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.102 -4.121 10.877 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.594 -2.621 10.127 1.00 0.00 H new ATOM 632 N ILE A 41 3.982 -6.349 8.250 1.00 0.00 N ATOM 633 CA ILE A 41 2.935 -7.271 7.859 1.00 0.00 C ATOM 634 C ILE A 41 3.047 -8.599 8.589 1.00 0.00 C ATOM 635 O ILE A 41 4.133 -9.161 8.734 1.00 0.00 O ATOM 636 CB ILE A 41 2.946 -7.521 6.345 1.00 0.00 C ATOM 637 CG1 ILE A 41 2.591 -6.233 5.605 1.00 0.00 C ATOM 638 CG2 ILE A 41 1.969 -8.632 5.984 1.00 0.00 C ATOM 639 CD1 ILE A 41 2.856 -6.311 4.122 1.00 0.00 C ATOM 0 H ILE A 41 4.929 -6.705 8.121 1.00 0.00 H new ATOM 0 HA ILE A 41 1.992 -6.801 8.136 1.00 0.00 H new ATOM 0 HB ILE A 41 3.946 -7.835 6.044 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.538 -6.006 5.768 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.165 -5.408 6.028 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.988 -8.798 4.907 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.256 -9.550 6.497 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.963 -8.345 6.289 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.583 -5.365 3.653 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.914 -6.509 3.951 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.262 -7.115 3.688 1.00 0.00 H new ATOM 651 N VAL A 42 1.916 -9.067 9.073 1.00 0.00 N ATOM 652 CA VAL A 42 1.789 -10.399 9.618 1.00 0.00 C ATOM 653 C VAL A 42 0.924 -11.191 8.665 1.00 0.00 C ATOM 654 O VAL A 42 -0.249 -10.863 8.481 1.00 0.00 O ATOM 655 CB VAL A 42 1.161 -10.395 11.022 1.00 0.00 C ATOM 656 CG1 VAL A 42 0.984 -11.815 11.543 1.00 0.00 C ATOM 657 CG2 VAL A 42 2.031 -9.588 11.963 1.00 0.00 C ATOM 0 H VAL A 42 1.051 -8.527 9.099 1.00 0.00 H new ATOM 0 HA VAL A 42 2.779 -10.843 9.723 1.00 0.00 H new ATOM 0 HB VAL A 42 0.174 -9.937 10.964 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.538 -11.785 12.537 1.00 0.00 H new ATOM 0 HG12 VAL A 42 0.332 -12.371 10.870 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.955 -12.307 11.596 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.586 -9.585 12.958 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.025 -10.033 12.011 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.109 -8.564 11.598 1.00 0.00 H new ATOM 667 N HIS A 43 1.478 -12.196 8.028 1.00 0.00 N ATOM 668 CA HIS A 43 0.734 -12.874 6.999 1.00 0.00 C ATOM 669 C HIS A 43 0.448 -14.312 7.391 1.00 0.00 C ATOM 670 O HIS A 43 1.346 -15.146 7.500 1.00 0.00 O ATOM 671 CB HIS A 43 1.474 -12.813 5.661 1.00 0.00 C ATOM 672 CG HIS A 43 0.576 -12.896 4.476 1.00 0.00 C ATOM 673 ND1 HIS A 43 0.937 -12.436 3.230 1.00 0.00 N ATOM 674 CD2 HIS A 43 -0.664 -13.408 4.345 1.00 0.00 C ATOM 675 CE1 HIS A 43 -0.041 -12.671 2.379 1.00 0.00 C ATOM 676 NE2 HIS A 43 -1.025 -13.263 3.030 1.00 0.00 N ATOM 0 H HIS A 43 2.418 -12.554 8.199 1.00 0.00 H new ATOM 0 HA HIS A 43 -0.221 -12.361 6.883 1.00 0.00 H new ATOM 0 HB2 HIS A 43 2.041 -11.883 5.612 1.00 0.00 H new ATOM 0 HB3 HIS A 43 2.195 -13.629 5.617 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -1.261 -13.850 5.129 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -0.038 -12.422 1.328 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -1.910 -13.564 2.621 1.00 0.00 H new ATOM 685 N GLU A 44 -0.823 -14.568 7.587 1.00 0.00 N ATOM 686 CA GLU A 44 -1.349 -15.894 7.813 1.00 0.00 C ATOM 687 C GLU A 44 -2.163 -16.259 6.590 1.00 0.00 C ATOM 688 O GLU A 44 -2.720 -15.365 5.967 1.00 0.00 O ATOM 689 CB GLU A 44 -2.215 -15.918 9.069 1.00 0.00 C ATOM 690 CG GLU A 44 -2.746 -17.288 9.429 1.00 0.00 C ATOM 691 CD GLU A 44 -3.475 -17.302 10.756 1.00 0.00 C ATOM 692 OE1 GLU A 44 -2.814 -17.484 11.799 1.00 0.00 O ATOM 693 OE2 GLU A 44 -4.712 -17.125 10.768 1.00 0.00 O ATOM 0 H GLU A 44 -1.539 -13.842 7.594 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.544 -16.612 7.966 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.632 -15.535 9.906 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.057 -15.239 8.930 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -3.421 -17.629 8.644 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -1.918 -17.996 9.467 1.00 0.00 H new ATOM 700 N GLY A 45 -2.124 -17.522 6.176 1.00 0.00 N ATOM 701 CA GLY A 45 -2.948 -17.975 5.061 1.00 0.00 C ATOM 702 C GLY A 45 -4.302 -17.286 5.018 1.00 0.00 C ATOM 703 O GLY A 45 -5.156 -17.540 5.859 1.00 0.00 O ATOM 0 H GLY A 45 -1.536 -18.244 6.592 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.420 -17.790 4.125 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.095 -19.052 5.137 1.00 0.00 H new ATOM 707 N LYS A 46 -4.450 -16.403 4.024 1.00 0.00 N ATOM 708 CA LYS A 46 -5.624 -15.527 3.818 1.00 0.00 C ATOM 709 C LYS A 46 -5.567 -14.245 4.646 1.00 0.00 C ATOM 710 O LYS A 46 -5.897 -13.177 4.140 1.00 0.00 O ATOM 711 CB LYS A 46 -6.980 -16.195 4.038 1.00 0.00 C ATOM 712 CG LYS A 46 -7.073 -17.629 3.573 1.00 0.00 C ATOM 713 CD LYS A 46 -8.493 -18.142 3.686 1.00 0.00 C ATOM 714 CE LYS A 46 -9.022 -17.858 5.069 1.00 0.00 C ATOM 715 NZ LYS A 46 -10.162 -18.736 5.434 1.00 0.00 N ATOM 0 H LYS A 46 -3.733 -16.269 3.311 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.551 -15.283 2.758 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -7.217 -16.158 5.101 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -7.742 -15.612 3.521 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -6.737 -17.703 2.539 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -6.408 -18.253 4.170 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.125 -17.663 2.938 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -8.521 -19.213 3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -8.220 -17.989 5.795 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.337 -16.816 5.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.488 -18.501 6.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.940 -18.593 4.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -9.857 -19.730 5.406 1.00 0.00 H new ATOM 729 N LYS A 47 -5.123 -14.330 5.890 1.00 0.00 N ATOM 730 CA LYS A 47 -5.195 -13.180 6.796 1.00 0.00 C ATOM 731 C LYS A 47 -3.936 -12.335 6.689 1.00 0.00 C ATOM 732 O LYS A 47 -2.848 -12.763 7.075 1.00 0.00 O ATOM 733 CB LYS A 47 -5.361 -13.595 8.267 1.00 0.00 C ATOM 734 CG LYS A 47 -6.433 -14.617 8.549 1.00 0.00 C ATOM 735 CD LYS A 47 -6.007 -16.003 8.140 1.00 0.00 C ATOM 736 CE LYS A 47 -7.117 -16.984 8.391 1.00 0.00 C ATOM 737 NZ LYS A 47 -7.335 -17.186 9.848 1.00 0.00 N ATOM 0 H LYS A 47 -4.712 -15.170 6.298 1.00 0.00 H new ATOM 0 HA LYS A 47 -6.073 -12.611 6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.409 -13.989 8.622 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -5.575 -12.702 8.854 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.672 -14.609 9.613 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.344 -14.345 8.016 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.737 -16.011 7.084 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.119 -16.298 8.699 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -8.036 -16.623 7.929 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -6.877 -17.938 7.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -7.811 -18.097 10.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.418 -17.185 10.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.928 -16.417 10.220 1.00 0.00 H new ATOM 751 N VAL A 48 -4.085 -11.137 6.162 1.00 0.00 N ATOM 752 CA VAL A 48 -2.969 -10.228 6.032 1.00 0.00 C ATOM 753 C VAL A 48 -3.166 -9.003 6.918 1.00 0.00 C ATOM 754 O VAL A 48 -4.167 -8.295 6.806 1.00 0.00 O ATOM 755 CB VAL A 48 -2.805 -9.765 4.578 1.00 0.00 C ATOM 756 CG1 VAL A 48 -1.438 -9.114 4.373 1.00 0.00 C ATOM 757 CG2 VAL A 48 -3.006 -10.925 3.626 1.00 0.00 C ATOM 0 H VAL A 48 -4.972 -10.771 5.816 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.073 -10.765 6.344 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.568 -9.017 4.363 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.340 -8.792 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.344 -8.250 5.031 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.654 -9.834 4.605 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.886 -10.578 2.600 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.269 -11.700 3.836 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.008 -11.333 3.756 1.00 0.00 H new ATOM 767 N LYS A 49 -2.211 -8.760 7.800 1.00 0.00 N ATOM 768 CA LYS A 49 -2.223 -7.585 8.631 1.00 0.00 C ATOM 769 C LYS A 49 -1.057 -6.701 8.237 1.00 0.00 C ATOM 770 O LYS A 49 0.069 -7.172 8.125 1.00 0.00 O ATOM 771 CB LYS A 49 -2.095 -7.984 10.081 1.00 0.00 C ATOM 772 CG LYS A 49 -3.026 -9.107 10.492 1.00 0.00 C ATOM 773 CD LYS A 49 -2.649 -9.667 11.843 1.00 0.00 C ATOM 774 CE LYS A 49 -3.015 -8.693 12.933 1.00 0.00 C ATOM 775 NZ LYS A 49 -4.434 -8.843 13.363 1.00 0.00 N ATOM 0 H LYS A 49 -1.411 -9.374 7.954 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.160 -7.045 8.497 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.066 -8.288 10.275 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.293 -7.113 10.706 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -4.052 -8.739 10.522 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.994 -9.900 9.745 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.160 -10.616 12.007 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.579 -9.872 11.874 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.359 -8.845 13.790 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.849 -7.675 12.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.607 -8.253 14.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.064 -8.542 12.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.623 -9.839 13.596 1.00 0.00 H new ATOM 789 N LEU A 50 -1.336 -5.441 8.030 1.00 0.00 N ATOM 790 CA LEU A 50 -0.356 -4.493 7.534 1.00 0.00 C ATOM 791 C LEU A 50 -0.316 -3.297 8.452 1.00 0.00 C ATOM 792 O LEU A 50 -1.350 -2.746 8.815 1.00 0.00 O ATOM 793 CB LEU A 50 -0.736 -4.061 6.117 1.00 0.00 C ATOM 794 CG LEU A 50 0.405 -3.691 5.173 1.00 0.00 C ATOM 795 CD1 LEU A 50 -0.141 -3.288 3.825 1.00 0.00 C ATOM 796 CD2 LEU A 50 1.241 -2.591 5.751 1.00 0.00 C ATOM 0 H LEU A 50 -2.256 -5.034 8.200 1.00 0.00 H new ATOM 0 HA LEU A 50 0.630 -4.957 7.508 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.306 -4.869 5.658 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.404 -3.203 6.193 1.00 0.00 H new ATOM 0 HG LEU A 50 1.041 -4.567 5.045 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.684 -3.027 3.162 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.702 -4.119 3.397 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.799 -2.427 3.942 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.047 -2.345 5.060 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.621 -1.709 5.913 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.664 -2.917 6.701 1.00 0.00 H new ATOM 808 N THR A 51 0.866 -2.913 8.858 1.00 0.00 N ATOM 809 CA THR A 51 1.008 -1.703 9.602 1.00 0.00 C ATOM 810 C THR A 51 1.880 -0.760 8.812 1.00 0.00 C ATOM 811 O THR A 51 3.007 -1.088 8.478 1.00 0.00 O ATOM 812 CB THR A 51 1.641 -1.963 10.981 1.00 0.00 C ATOM 813 OG1 THR A 51 1.113 -3.179 11.529 1.00 0.00 O ATOM 814 CG2 THR A 51 1.347 -0.818 11.934 1.00 0.00 C ATOM 0 H THR A 51 1.734 -3.420 8.685 1.00 0.00 H new ATOM 0 HA THR A 51 0.022 -1.270 9.767 1.00 0.00 H new ATOM 0 HB THR A 51 2.720 -2.047 10.855 1.00 0.00 H new ATOM 0 HG1 THR A 51 1.517 -3.345 12.406 1.00 0.00 H new ATOM 0 HG21 THR A 51 1.804 -1.024 12.902 1.00 0.00 H new ATOM 0 HG22 THR A 51 1.757 0.107 11.529 1.00 0.00 H new ATOM 0 HG23 THR A 51 0.269 -0.714 12.057 1.00 0.00 H new ATOM 822 N ILE A 52 1.373 0.405 8.515 1.00 0.00 N ATOM 823 CA ILE A 52 2.093 1.343 7.714 1.00 0.00 C ATOM 824 C ILE A 52 2.204 2.652 8.467 1.00 0.00 C ATOM 825 O ILE A 52 1.217 3.260 8.838 1.00 0.00 O ATOM 826 CB ILE A 52 1.369 1.500 6.363 1.00 0.00 C ATOM 827 CG1 ILE A 52 1.932 0.546 5.326 1.00 0.00 C ATOM 828 CG2 ILE A 52 1.412 2.919 5.865 1.00 0.00 C ATOM 829 CD1 ILE A 52 1.278 0.711 3.980 1.00 0.00 C ATOM 0 H ILE A 52 0.454 0.725 8.822 1.00 0.00 H new ATOM 0 HA ILE A 52 3.106 0.995 7.510 1.00 0.00 H new ATOM 0 HB ILE A 52 0.322 1.244 6.529 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.005 0.712 5.228 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.798 -0.480 5.669 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.890 2.986 4.910 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.928 3.574 6.590 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.449 3.227 5.734 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.716 0.006 3.274 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.209 0.519 4.069 1.00 0.00 H new ATOM 0 HD13 ILE A 52 1.435 1.728 3.622 1.00 0.00 H new ATOM 841 N THR A 53 3.419 3.065 8.711 1.00 0.00 N ATOM 842 CA THR A 53 3.673 4.274 9.431 1.00 0.00 C ATOM 843 C THR A 53 4.068 5.356 8.446 1.00 0.00 C ATOM 844 O THR A 53 4.973 5.161 7.637 1.00 0.00 O ATOM 845 CB THR A 53 4.819 4.024 10.419 1.00 0.00 C ATOM 846 OG1 THR A 53 4.544 2.851 11.196 1.00 0.00 O ATOM 847 CG2 THR A 53 5.005 5.202 11.325 1.00 0.00 C ATOM 0 H THR A 53 4.259 2.568 8.414 1.00 0.00 H new ATOM 0 HA THR A 53 2.784 4.590 9.976 1.00 0.00 H new ATOM 0 HB THR A 53 5.738 3.876 9.852 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.280 2.695 11.824 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.823 5.003 12.017 1.00 0.00 H new ATOM 0 HG22 THR A 53 5.240 6.085 10.730 1.00 0.00 H new ATOM 0 HG23 THR A 53 4.088 5.377 11.887 1.00 0.00 H new ATOM 855 N TYR A 54 3.390 6.481 8.512 1.00 0.00 N ATOM 856 CA TYR A 54 3.695 7.596 7.654 1.00 0.00 C ATOM 857 C TYR A 54 4.040 8.803 8.503 1.00 0.00 C ATOM 858 O TYR A 54 3.163 9.397 9.131 1.00 0.00 O ATOM 859 CB TYR A 54 2.507 7.897 6.736 1.00 0.00 C ATOM 860 CG TYR A 54 2.664 9.171 5.943 1.00 0.00 C ATOM 861 CD1 TYR A 54 3.336 9.184 4.731 1.00 0.00 C ATOM 862 CD2 TYR A 54 2.140 10.363 6.419 1.00 0.00 C ATOM 863 CE1 TYR A 54 3.477 10.353 4.011 1.00 0.00 C ATOM 864 CE2 TYR A 54 2.279 11.535 5.710 1.00 0.00 C ATOM 865 CZ TYR A 54 2.948 11.526 4.505 1.00 0.00 C ATOM 866 OH TYR A 54 3.078 12.689 3.786 1.00 0.00 O ATOM 0 H TYR A 54 2.618 6.644 9.158 1.00 0.00 H new ATOM 0 HA TYR A 54 4.552 7.350 7.027 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.371 7.064 6.046 1.00 0.00 H new ATOM 0 HB3 TYR A 54 1.601 7.963 7.338 1.00 0.00 H new ATOM 0 HD1 TYR A 54 3.755 8.267 4.345 1.00 0.00 H new ATOM 0 HD2 TYR A 54 1.614 10.372 7.362 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.999 10.349 3.066 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.866 12.456 6.096 1.00 0.00 H new ATOM 0 HH TYR A 54 2.649 13.424 4.272 1.00 0.00 H new ATOM 876 N GLY A 55 5.314 9.152 8.519 1.00 0.00 N ATOM 877 CA GLY A 55 5.768 10.288 9.289 1.00 0.00 C ATOM 878 C GLY A 55 5.489 10.136 10.776 1.00 0.00 C ATOM 879 O GLY A 55 6.264 9.512 11.504 1.00 0.00 O ATOM 0 H GLY A 55 6.049 8.664 8.007 1.00 0.00 H new ATOM 0 HA2 GLY A 55 6.839 10.421 9.136 1.00 0.00 H new ATOM 0 HA3 GLY A 55 5.279 11.190 8.922 1.00 0.00 H new ATOM 883 N SER A 56 4.376 10.696 11.226 1.00 0.00 N ATOM 884 CA SER A 56 4.005 10.648 12.631 1.00 0.00 C ATOM 885 C SER A 56 2.833 9.700 12.860 1.00 0.00 C ATOM 886 O SER A 56 2.582 9.264 13.986 1.00 0.00 O ATOM 887 CB SER A 56 3.609 12.046 13.105 1.00 0.00 C ATOM 888 OG SER A 56 3.442 12.089 14.513 1.00 0.00 O ATOM 0 H SER A 56 3.710 11.192 10.633 1.00 0.00 H new ATOM 0 HA SER A 56 4.865 10.285 13.194 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.374 12.763 12.806 1.00 0.00 H new ATOM 0 HB3 SER A 56 2.682 12.347 12.618 1.00 0.00 H new ATOM 0 HG SER A 56 3.070 11.238 14.824 1.00 0.00 H new ATOM 894 N LYS A 57 2.114 9.381 11.798 1.00 0.00 N ATOM 895 CA LYS A 57 0.871 8.654 11.931 1.00 0.00 C ATOM 896 C LYS A 57 0.980 7.258 11.328 1.00 0.00 C ATOM 897 O LYS A 57 1.398 7.090 10.186 1.00 0.00 O ATOM 898 CB LYS A 57 -0.261 9.452 11.279 1.00 0.00 C ATOM 899 CG LYS A 57 -1.534 9.508 12.103 1.00 0.00 C ATOM 900 CD LYS A 57 -2.179 8.142 12.306 1.00 0.00 C ATOM 901 CE LYS A 57 -2.970 7.696 11.100 1.00 0.00 C ATOM 902 NZ LYS A 57 -3.804 6.495 11.396 1.00 0.00 N ATOM 0 H LYS A 57 2.371 9.614 10.839 1.00 0.00 H new ATOM 0 HA LYS A 57 0.649 8.528 12.991 1.00 0.00 H new ATOM 0 HB2 LYS A 57 0.085 10.469 11.095 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.489 9.012 10.308 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -1.310 9.945 13.076 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -2.248 10.170 11.613 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -1.405 7.406 12.522 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -2.836 8.179 13.175 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -3.612 8.511 10.765 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -2.287 7.471 10.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -4.455 6.321 10.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -3.187 5.668 11.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -4.351 6.658 12.265 1.00 0.00 H new ATOM 916 N VAL A 58 0.599 6.263 12.111 1.00 0.00 N ATOM 917 CA VAL A 58 0.584 4.889 11.663 1.00 0.00 C ATOM 918 C VAL A 58 -0.808 4.515 11.228 1.00 0.00 C ATOM 919 O VAL A 58 -1.787 4.672 11.961 1.00 0.00 O ATOM 920 CB VAL A 58 1.051 3.932 12.779 1.00 0.00 C ATOM 921 CG1 VAL A 58 1.174 2.510 12.256 1.00 0.00 C ATOM 922 CG2 VAL A 58 2.374 4.395 13.362 1.00 0.00 C ATOM 0 H VAL A 58 0.292 6.390 13.075 1.00 0.00 H new ATOM 0 HA VAL A 58 1.273 4.797 10.824 1.00 0.00 H new ATOM 0 HB VAL A 58 0.300 3.944 13.569 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.505 1.854 13.061 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.205 2.173 11.888 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.901 2.483 11.444 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.686 3.707 14.147 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.130 4.417 12.577 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.257 5.395 13.781 1.00 0.00 H new ATOM 932 N ILE A 59 -0.874 4.039 10.014 1.00 0.00 N ATOM 933 CA ILE A 59 -2.082 3.677 9.378 1.00 0.00 C ATOM 934 C ILE A 59 -2.058 2.169 9.149 1.00 0.00 C ATOM 935 O ILE A 59 -1.202 1.625 8.451 1.00 0.00 O ATOM 936 CB ILE A 59 -2.206 4.519 8.097 1.00 0.00 C ATOM 937 CG1 ILE A 59 -3.123 5.709 8.348 1.00 0.00 C ATOM 938 CG2 ILE A 59 -2.658 3.690 6.940 1.00 0.00 C ATOM 939 CD1 ILE A 59 -3.013 6.791 7.309 1.00 0.00 C ATOM 0 H ILE A 59 -0.050 3.893 9.431 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.969 3.884 9.976 1.00 0.00 H new ATOM 0 HB ILE A 59 -1.221 4.903 7.831 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -4.155 5.359 8.386 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -2.893 6.133 9.326 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -2.735 4.317 6.051 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.937 2.892 6.760 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.632 3.255 7.163 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -3.696 7.604 7.556 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.991 7.170 7.285 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -3.272 6.384 6.331 1.00 0.00 H new ATOM 951 N HIS A 60 -2.959 1.506 9.835 1.00 0.00 N ATOM 952 CA HIS A 60 -2.997 0.047 9.874 1.00 0.00 C ATOM 953 C HIS A 60 -4.005 -0.525 8.883 1.00 0.00 C ATOM 954 O HIS A 60 -5.065 0.057 8.649 1.00 0.00 O ATOM 955 CB HIS A 60 -3.313 -0.451 11.298 1.00 0.00 C ATOM 956 CG HIS A 60 -4.526 0.175 11.936 1.00 0.00 C ATOM 957 ND1 HIS A 60 -5.611 0.637 11.223 1.00 0.00 N ATOM 958 CD2 HIS A 60 -4.811 0.422 13.239 1.00 0.00 C ATOM 959 CE1 HIS A 60 -6.505 1.135 12.054 1.00 0.00 C ATOM 960 NE2 HIS A 60 -6.047 1.018 13.281 1.00 0.00 N ATOM 0 H HIS A 60 -3.691 1.955 10.385 1.00 0.00 H new ATOM 0 HA HIS A 60 -2.008 -0.307 9.583 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -3.454 -1.531 11.266 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -2.448 -0.261 11.934 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -5.708 0.599 10.208 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -4.182 0.192 14.086 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -7.455 1.567 11.774 1.00 0.00 H new ATOM 969 N ASN A 61 -3.670 -1.667 8.304 1.00 0.00 N ATOM 970 CA ASN A 61 -4.556 -2.352 7.383 1.00 0.00 C ATOM 971 C ASN A 61 -4.677 -3.797 7.831 1.00 0.00 C ATOM 972 O ASN A 61 -3.694 -4.392 8.255 1.00 0.00 O ATOM 973 CB ASN A 61 -4.007 -2.339 5.943 1.00 0.00 C ATOM 974 CG ASN A 61 -3.452 -0.998 5.475 1.00 0.00 C ATOM 975 OD1 ASN A 61 -2.548 -0.956 4.643 1.00 0.00 O ATOM 976 ND2 ASN A 61 -3.974 0.100 5.997 1.00 0.00 N ATOM 0 H ASN A 61 -2.780 -2.141 8.460 1.00 0.00 H new ATOM 0 HA ASN A 61 -5.519 -1.841 7.387 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -3.219 -3.088 5.864 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -4.804 -2.642 5.264 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -3.627 1.016 5.711 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.723 0.031 6.685 1.00 0.00 H new ATOM 983 N GLU A 62 -5.863 -4.358 7.781 1.00 0.00 N ATOM 984 CA GLU A 62 -6.020 -5.769 8.017 1.00 0.00 C ATOM 985 C GLU A 62 -7.130 -6.303 7.132 1.00 0.00 C ATOM 986 O GLU A 62 -8.252 -5.792 7.141 1.00 0.00 O ATOM 987 CB GLU A 62 -6.301 -6.022 9.497 1.00 0.00 C ATOM 988 CG GLU A 62 -6.959 -7.349 9.770 1.00 0.00 C ATOM 989 CD GLU A 62 -7.048 -7.656 11.249 1.00 0.00 C ATOM 990 OE1 GLU A 62 -7.684 -6.871 11.985 1.00 0.00 O ATOM 991 OE2 GLU A 62 -6.479 -8.678 11.682 1.00 0.00 O ATOM 0 H GLU A 62 -6.729 -3.858 7.579 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.100 -6.297 7.765 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.363 -5.971 10.050 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.939 -5.225 9.878 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.961 -7.350 9.341 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.398 -8.139 9.271 1.00 0.00 H new ATOM 998 N PHE A 63 -6.801 -7.315 6.351 1.00 0.00 N ATOM 999 CA PHE A 63 -7.725 -7.861 5.380 1.00 0.00 C ATOM 1000 C PHE A 63 -7.448 -9.332 5.132 1.00 0.00 C ATOM 1001 O PHE A 63 -6.324 -9.804 5.297 1.00 0.00 O ATOM 1002 CB PHE A 63 -7.654 -7.071 4.069 1.00 0.00 C ATOM 1003 CG PHE A 63 -6.262 -6.797 3.591 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -5.565 -7.734 2.851 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -5.658 -5.586 3.872 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -4.288 -7.469 2.402 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -4.384 -5.315 3.429 1.00 0.00 C ATOM 1008 CZ PHE A 63 -3.697 -6.256 2.691 1.00 0.00 C ATOM 0 H PHE A 63 -5.892 -7.777 6.373 1.00 0.00 H new ATOM 0 HA PHE A 63 -8.733 -7.772 5.785 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -8.189 -7.623 3.296 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -8.174 -6.122 4.201 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -6.025 -8.684 2.622 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -6.192 -4.844 4.446 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -3.752 -8.209 1.826 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -3.922 -4.366 3.659 1.00 0.00 H new ATOM 0 HZ PHE A 63 -2.698 -6.044 2.340 1.00 0.00 H new ATOM 1018 N THR A 64 -8.481 -10.052 4.757 1.00 0.00 N ATOM 1019 CA THR A 64 -8.359 -11.447 4.406 1.00 0.00 C ATOM 1020 C THR A 64 -8.526 -11.579 2.893 1.00 0.00 C ATOM 1021 O THR A 64 -9.403 -10.941 2.320 1.00 0.00 O ATOM 1022 CB THR A 64 -9.434 -12.271 5.145 1.00 0.00 C ATOM 1023 OG1 THR A 64 -9.522 -11.817 6.506 1.00 0.00 O ATOM 1024 CG2 THR A 64 -9.096 -13.753 5.142 1.00 0.00 C ATOM 0 H THR A 64 -9.430 -9.685 4.687 1.00 0.00 H new ATOM 0 HA THR A 64 -7.381 -11.827 4.701 1.00 0.00 H new ATOM 0 HB THR A 64 -10.384 -12.132 4.629 1.00 0.00 H new ATOM 0 HG1 THR A 64 -10.205 -12.336 6.980 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.873 -14.305 5.671 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.033 -14.110 4.114 1.00 0.00 H new ATOM 0 HG23 THR A 64 -8.139 -13.909 5.639 1.00 0.00 H new ATOM 1032 N LEU A 65 -7.627 -12.313 2.239 1.00 0.00 N ATOM 1033 CA LEU A 65 -7.761 -12.571 0.798 1.00 0.00 C ATOM 1034 C LEU A 65 -9.186 -12.973 0.414 1.00 0.00 C ATOM 1035 O LEU A 65 -9.897 -13.624 1.185 1.00 0.00 O ATOM 1036 CB LEU A 65 -6.754 -13.635 0.307 1.00 0.00 C ATOM 1037 CG LEU A 65 -6.839 -15.047 0.906 1.00 0.00 C ATOM 1038 CD1 LEU A 65 -8.075 -15.760 0.435 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -5.616 -15.854 0.529 1.00 0.00 C ATOM 0 H LEU A 65 -6.807 -12.737 2.673 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.532 -11.629 0.299 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -6.865 -13.725 -0.774 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.750 -13.254 0.494 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.886 -14.946 1.990 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -8.110 -16.757 0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -8.958 -15.198 0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.055 -15.843 -0.652 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.691 -16.852 0.961 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -5.552 -15.932 -0.556 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -4.722 -15.360 0.910 1.00 0.00 H new ATOM 1051 N GLY A 66 -9.587 -12.564 -0.781 1.00 0.00 N ATOM 1052 CA GLY A 66 -10.893 -12.908 -1.302 1.00 0.00 C ATOM 1053 C GLY A 66 -12.009 -12.201 -0.572 1.00 0.00 C ATOM 1054 O GLY A 66 -13.183 -12.533 -0.748 1.00 0.00 O ATOM 0 H GLY A 66 -9.021 -11.991 -1.407 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -10.937 -12.654 -2.361 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -11.039 -13.986 -1.227 1.00 0.00 H new ATOM 1058 N GLU A 67 -11.645 -11.204 0.218 1.00 0.00 N ATOM 1059 CA GLU A 67 -12.599 -10.517 1.066 1.00 0.00 C ATOM 1060 C GLU A 67 -12.572 -9.032 0.789 1.00 0.00 C ATOM 1061 O GLU A 67 -11.516 -8.465 0.494 1.00 0.00 O ATOM 1062 CB GLU A 67 -12.294 -10.763 2.536 1.00 0.00 C ATOM 1063 CG GLU A 67 -12.612 -12.168 2.996 1.00 0.00 C ATOM 1064 CD GLU A 67 -14.062 -12.540 2.765 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -14.948 -11.798 3.241 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -14.326 -13.583 2.132 1.00 0.00 O ATOM 0 H GLU A 67 -10.690 -10.853 0.288 1.00 0.00 H new ATOM 0 HA GLU A 67 -13.591 -10.910 0.842 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -11.238 -10.561 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -12.863 -10.055 3.139 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -11.971 -12.874 2.468 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -12.381 -12.260 4.057 1.00 0.00 H new ATOM 1073 N GLU A 68 -13.730 -8.410 0.848 1.00 0.00 N ATOM 1074 CA GLU A 68 -13.801 -6.972 0.769 1.00 0.00 C ATOM 1075 C GLU A 68 -13.569 -6.418 2.161 1.00 0.00 C ATOM 1076 O GLU A 68 -14.346 -6.676 3.081 1.00 0.00 O ATOM 1077 CB GLU A 68 -15.167 -6.537 0.264 1.00 0.00 C ATOM 1078 CG GLU A 68 -15.207 -5.138 -0.323 1.00 0.00 C ATOM 1079 CD GLU A 68 -16.601 -4.751 -0.756 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -16.968 -5.039 -1.909 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -17.340 -4.167 0.062 1.00 0.00 O ATOM 0 H GLU A 68 -14.631 -8.878 0.950 1.00 0.00 H new ATOM 0 HA GLU A 68 -13.048 -6.598 0.076 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -15.502 -7.245 -0.494 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.879 -6.592 1.088 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -14.844 -4.423 0.416 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -14.533 -5.083 -1.178 1.00 0.00 H new ATOM 1088 N CYS A 69 -12.508 -5.675 2.313 1.00 0.00 N ATOM 1089 CA CYS A 69 -12.131 -5.150 3.610 1.00 0.00 C ATOM 1090 C CYS A 69 -11.773 -3.696 3.499 1.00 0.00 C ATOM 1091 O CYS A 69 -11.438 -3.206 2.419 1.00 0.00 O ATOM 1092 CB CYS A 69 -10.969 -5.943 4.205 1.00 0.00 C ATOM 1093 SG CYS A 69 -11.287 -7.717 4.378 1.00 0.00 S ATOM 0 H CYS A 69 -11.880 -5.414 1.553 1.00 0.00 H new ATOM 0 HA CYS A 69 -12.985 -5.250 4.280 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -10.090 -5.803 3.576 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -10.728 -5.532 5.185 1.00 0.00 H new ATOM 0 HG CYS A 69 -10.983 -8.097 5.584 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.836 -3.009 4.616 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.645 -1.588 4.612 1.00 0.00 C ATOM 1101 C GLU A 70 -10.219 -1.218 4.917 1.00 0.00 C ATOM 1102 O GLU A 70 -9.659 -1.531 5.968 1.00 0.00 O ATOM 1103 CB GLU A 70 -12.627 -0.904 5.535 1.00 0.00 C ATOM 1104 CG GLU A 70 -13.789 -0.372 4.752 1.00 0.00 C ATOM 1105 CD GLU A 70 -15.024 -0.130 5.588 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -15.749 -1.106 5.872 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -15.288 1.035 5.948 1.00 0.00 O ATOM 0 H GLU A 70 -12.018 -3.415 5.534 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.849 -1.227 3.604 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.979 -1.608 6.289 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -12.133 -0.090 6.065 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.496 0.562 4.273 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.032 -1.076 3.956 1.00 0.00 H new ATOM 1114 N LEU A 71 -9.665 -0.541 3.945 1.00 0.00 N ATOM 1115 CA LEU A 71 -8.264 -0.240 3.880 1.00 0.00 C ATOM 1116 C LEU A 71 -8.001 1.183 4.325 1.00 0.00 C ATOM 1117 O LEU A 71 -8.622 2.110 3.814 1.00 0.00 O ATOM 1118 CB LEU A 71 -7.824 -0.402 2.428 1.00 0.00 C ATOM 1119 CG LEU A 71 -8.280 -1.694 1.757 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.888 -1.715 0.293 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.662 -2.853 2.480 1.00 0.00 C ATOM 0 H LEU A 71 -10.195 -0.174 3.154 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.711 -0.910 4.538 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.204 0.442 1.853 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.736 -0.353 2.386 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.367 -1.761 1.806 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.225 -2.647 -0.161 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.352 -0.873 -0.220 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.804 -1.640 0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.979 -3.785 2.012 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.576 -2.774 2.433 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.981 -2.844 3.522 1.00 0.00 H new ATOM 1133 N GLU A 72 -7.079 1.360 5.250 1.00 0.00 N ATOM 1134 CA GLU A 72 -6.673 2.696 5.633 1.00 0.00 C ATOM 1135 C GLU A 72 -5.599 3.133 4.674 1.00 0.00 C ATOM 1136 O GLU A 72 -4.572 2.473 4.525 1.00 0.00 O ATOM 1137 CB GLU A 72 -6.143 2.739 7.072 1.00 0.00 C ATOM 1138 CG GLU A 72 -6.434 4.045 7.803 1.00 0.00 C ATOM 1139 CD GLU A 72 -5.899 4.056 9.230 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -5.501 2.987 9.733 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -5.868 5.145 9.852 1.00 0.00 O ATOM 0 H GLU A 72 -6.602 0.606 5.745 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.534 3.364 5.593 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.582 1.915 7.634 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -5.065 2.576 7.056 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.992 4.873 7.248 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.511 4.213 7.822 1.00 0.00 H new ATOM 1148 N THR A 73 -5.847 4.230 4.006 1.00 0.00 N ATOM 1149 CA THR A 73 -4.940 4.693 2.991 1.00 0.00 C ATOM 1150 C THR A 73 -3.858 5.526 3.633 1.00 0.00 C ATOM 1151 O THR A 73 -4.027 5.947 4.766 1.00 0.00 O ATOM 1152 CB THR A 73 -5.673 5.522 1.926 1.00 0.00 C ATOM 1153 OG1 THR A 73 -6.561 6.454 2.562 1.00 0.00 O ATOM 1154 CG2 THR A 73 -6.455 4.623 0.987 1.00 0.00 C ATOM 0 H THR A 73 -6.669 4.818 4.147 1.00 0.00 H new ATOM 0 HA THR A 73 -4.500 3.826 2.498 1.00 0.00 H new ATOM 0 HB THR A 73 -4.932 6.068 1.342 1.00 0.00 H new ATOM 0 HG1 THR A 73 -7.309 5.968 2.968 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.966 5.232 0.241 1.00 0.00 H new ATOM 0 HG22 THR A 73 -5.772 3.936 0.488 1.00 0.00 H new ATOM 0 HG23 THR A 73 -7.190 4.054 1.556 1.00 0.00 H new ATOM 1162 N MET A 74 -2.765 5.783 2.929 1.00 0.00 N ATOM 1163 CA MET A 74 -1.691 6.594 3.495 1.00 0.00 C ATOM 1164 C MET A 74 -2.213 7.981 3.861 1.00 0.00 C ATOM 1165 O MET A 74 -1.639 8.673 4.699 1.00 0.00 O ATOM 1166 CB MET A 74 -0.505 6.734 2.525 1.00 0.00 C ATOM 1167 CG MET A 74 -0.869 7.258 1.142 1.00 0.00 C ATOM 1168 SD MET A 74 -1.822 6.076 0.169 1.00 0.00 S ATOM 1169 CE MET A 74 -1.944 6.950 -1.386 1.00 0.00 C ATOM 0 H MET A 74 -2.597 5.449 1.980 1.00 0.00 H new ATOM 0 HA MET A 74 -1.338 6.083 4.391 1.00 0.00 H new ATOM 0 HB2 MET A 74 0.232 7.403 2.969 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.027 5.761 2.415 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.442 8.179 1.248 1.00 0.00 H new ATOM 0 HG3 MET A 74 0.044 7.511 0.603 1.00 0.00 H new ATOM 0 HE1 MET A 74 -2.036 6.232 -2.201 1.00 0.00 H new ATOM 0 HE2 MET A 74 -2.821 7.597 -1.372 1.00 0.00 H new ATOM 0 HE3 MET A 74 -1.049 7.555 -1.535 1.00 0.00 H new ATOM 1179 N THR A 75 -3.307 8.376 3.220 1.00 0.00 N ATOM 1180 CA THR A 75 -3.929 9.654 3.491 1.00 0.00 C ATOM 1181 C THR A 75 -4.702 9.612 4.811 1.00 0.00 C ATOM 1182 O THR A 75 -4.655 10.563 5.594 1.00 0.00 O ATOM 1183 CB THR A 75 -4.875 10.046 2.356 1.00 0.00 C ATOM 1184 OG1 THR A 75 -4.403 9.490 1.119 1.00 0.00 O ATOM 1185 CG2 THR A 75 -4.953 11.558 2.235 1.00 0.00 C ATOM 0 H THR A 75 -3.779 7.821 2.506 1.00 0.00 H new ATOM 0 HA THR A 75 -3.138 10.400 3.568 1.00 0.00 H new ATOM 0 HB THR A 75 -5.869 9.656 2.576 1.00 0.00 H new ATOM 0 HG1 THR A 75 -5.012 9.741 0.394 1.00 0.00 H new ATOM 0 HG21 THR A 75 -5.630 11.824 1.423 1.00 0.00 H new ATOM 0 HG22 THR A 75 -5.324 11.979 3.169 1.00 0.00 H new ATOM 0 HG23 THR A 75 -3.961 11.958 2.026 1.00 0.00 H new ATOM 1193 N GLY A 76 -5.409 8.510 5.058 1.00 0.00 N ATOM 1194 CA GLY A 76 -6.103 8.356 6.321 1.00 0.00 C ATOM 1195 C GLY A 76 -7.477 7.719 6.206 1.00 0.00 C ATOM 1196 O GLY A 76 -7.990 7.181 7.188 1.00 0.00 O ATOM 0 H GLY A 76 -5.511 7.729 4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.489 7.750 6.988 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.208 9.336 6.786 1.00 0.00 H new ATOM 1200 N GLU A 77 -8.083 7.771 5.025 1.00 0.00 N ATOM 1201 CA GLU A 77 -9.425 7.233 4.846 1.00 0.00 C ATOM 1202 C GLU A 77 -9.406 5.713 4.739 1.00 0.00 C ATOM 1203 O GLU A 77 -8.517 5.142 4.106 1.00 0.00 O ATOM 1204 CB GLU A 77 -10.087 7.819 3.605 1.00 0.00 C ATOM 1205 CG GLU A 77 -11.495 7.293 3.385 1.00 0.00 C ATOM 1206 CD GLU A 77 -12.159 7.833 2.137 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -12.809 8.895 2.220 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -12.061 7.186 1.078 1.00 0.00 O ATOM 0 H GLU A 77 -7.670 8.176 4.185 1.00 0.00 H new ATOM 0 HA GLU A 77 -10.002 7.515 5.727 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.120 8.905 3.695 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -9.478 7.589 2.731 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -11.462 6.205 3.326 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.107 7.547 4.250 1.00 0.00 H new ATOM 1215 N LYS A 78 -10.381 5.068 5.373 1.00 0.00 N ATOM 1216 CA LYS A 78 -10.566 3.631 5.232 1.00 0.00 C ATOM 1217 C LYS A 78 -11.653 3.340 4.200 1.00 0.00 C ATOM 1218 O LYS A 78 -12.781 3.822 4.325 1.00 0.00 O ATOM 1219 CB LYS A 78 -10.903 2.947 6.569 1.00 0.00 C ATOM 1220 CG LYS A 78 -11.620 3.822 7.576 1.00 0.00 C ATOM 1221 CD LYS A 78 -10.647 4.730 8.314 1.00 0.00 C ATOM 1222 CE LYS A 78 -9.730 3.944 9.246 1.00 0.00 C ATOM 1223 NZ LYS A 78 -10.488 3.141 10.245 1.00 0.00 N ATOM 0 H LYS A 78 -11.055 5.521 5.990 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.618 3.216 4.890 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -11.521 2.072 6.366 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.978 2.586 7.018 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -12.370 4.427 7.066 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.150 3.195 8.293 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -10.045 5.280 7.591 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.205 5.467 8.891 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -9.098 3.281 8.655 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -9.067 4.635 9.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -9.857 2.876 11.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -11.280 3.705 10.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -10.857 2.281 9.791 1.00 0.00 H new ATOM 1237 N VAL A 79 -11.305 2.567 3.177 1.00 0.00 N ATOM 1238 CA VAL A 79 -12.216 2.273 2.081 1.00 0.00 C ATOM 1239 C VAL A 79 -12.165 0.793 1.755 1.00 0.00 C ATOM 1240 O VAL A 79 -11.114 0.169 1.856 1.00 0.00 O ATOM 1241 CB VAL A 79 -11.900 3.130 0.825 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -10.545 3.812 0.941 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -11.958 2.308 -0.446 1.00 0.00 C ATOM 0 H VAL A 79 -10.388 2.129 3.086 1.00 0.00 H new ATOM 0 HA VAL A 79 -13.226 2.533 2.398 1.00 0.00 H new ATOM 0 HB VAL A 79 -12.671 3.898 0.770 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.357 4.403 0.045 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.540 4.465 1.814 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.766 3.057 1.048 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -11.731 2.944 -1.301 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.228 1.500 -0.391 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.957 1.887 -0.562 1.00 0.00 H new ATOM 1253 N LYS A 80 -13.298 0.236 1.376 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.378 -1.190 1.133 1.00 0.00 C ATOM 1255 C LYS A 80 -12.907 -1.555 -0.261 1.00 0.00 C ATOM 1256 O LYS A 80 -13.223 -0.880 -1.242 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.773 -1.723 1.389 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.876 -0.971 0.697 1.00 0.00 C ATOM 1259 CD LYS A 80 -16.073 -1.407 -0.743 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.211 -0.656 -1.390 1.00 0.00 C ATOM 1261 NZ LYS A 80 -18.520 -0.992 -0.772 1.00 0.00 N ATOM 0 H LYS A 80 -14.170 0.745 1.231 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.702 -1.667 1.843 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.811 -2.766 1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.961 -1.707 2.463 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.807 -1.115 1.246 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.653 0.096 0.721 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.155 -1.237 -1.306 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.274 -2.478 -0.777 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.034 0.416 -1.304 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.241 -0.890 -2.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -19.290 -0.665 -1.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.590 -2.022 -0.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.597 -0.524 0.154 1.00 0.00 H new ATOM 1275 N ALA A 81 -12.118 -2.603 -0.328 1.00 0.00 N ATOM 1276 CA ALA A 81 -11.681 -3.160 -1.587 1.00 0.00 C ATOM 1277 C ALA A 81 -11.519 -4.660 -1.435 1.00 0.00 C ATOM 1278 O ALA A 81 -11.263 -5.147 -0.332 1.00 0.00 O ATOM 1279 CB ALA A 81 -10.383 -2.512 -2.036 1.00 0.00 C ATOM 0 H ALA A 81 -11.761 -3.094 0.491 1.00 0.00 H new ATOM 0 HA ALA A 81 -12.429 -2.959 -2.354 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.070 -2.945 -2.986 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.535 -1.440 -2.158 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.611 -2.686 -1.286 1.00 0.00 H new ATOM 1285 N VAL A 82 -11.678 -5.394 -2.522 1.00 0.00 N ATOM 1286 CA VAL A 82 -11.513 -6.835 -2.471 1.00 0.00 C ATOM 1287 C VAL A 82 -10.110 -7.206 -2.893 1.00 0.00 C ATOM 1288 O VAL A 82 -9.731 -7.040 -4.056 1.00 0.00 O ATOM 1289 CB VAL A 82 -12.527 -7.567 -3.364 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -12.229 -9.063 -3.412 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -13.923 -7.321 -2.848 1.00 0.00 C ATOM 0 H VAL A 82 -11.918 -5.021 -3.441 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.691 -7.147 -1.442 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.447 -7.179 -4.379 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -12.960 -9.559 -4.050 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.229 -9.222 -3.815 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.285 -9.478 -2.406 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.642 -7.840 -3.482 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.004 -7.693 -1.827 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.133 -6.252 -2.862 1.00 0.00 H new ATOM 1301 N VAL A 83 -9.347 -7.709 -1.943 1.00 0.00 N ATOM 1302 CA VAL A 83 -7.978 -8.111 -2.211 1.00 0.00 C ATOM 1303 C VAL A 83 -7.903 -9.616 -2.396 1.00 0.00 C ATOM 1304 O VAL A 83 -8.497 -10.375 -1.638 1.00 0.00 O ATOM 1305 CB VAL A 83 -6.988 -7.651 -1.088 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -7.734 -7.074 0.102 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -6.058 -8.775 -0.641 1.00 0.00 C ATOM 0 H VAL A 83 -9.650 -7.850 -0.979 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.669 -7.615 -3.131 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.368 -6.866 -1.522 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -7.019 -6.764 0.864 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -8.319 -6.212 -0.219 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -8.400 -7.831 0.516 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.391 -8.407 0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.650 -9.603 -0.251 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.468 -9.119 -1.491 1.00 0.00 H new ATOM 1317 N LYS A 84 -7.201 -10.033 -3.425 1.00 0.00 N ATOM 1318 CA LYS A 84 -6.945 -11.425 -3.677 1.00 0.00 C ATOM 1319 C LYS A 84 -5.527 -11.746 -3.271 1.00 0.00 C ATOM 1320 O LYS A 84 -4.667 -10.868 -3.319 1.00 0.00 O ATOM 1321 CB LYS A 84 -7.088 -11.690 -5.155 1.00 0.00 C ATOM 1322 CG LYS A 84 -8.499 -11.523 -5.687 1.00 0.00 C ATOM 1323 CD LYS A 84 -9.392 -12.699 -5.365 1.00 0.00 C ATOM 1324 CE LYS A 84 -10.801 -12.406 -5.837 1.00 0.00 C ATOM 1325 NZ LYS A 84 -11.754 -13.501 -5.517 1.00 0.00 N ATOM 0 H LYS A 84 -6.789 -9.405 -4.115 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.648 -12.037 -3.112 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -6.426 -11.016 -5.698 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -6.751 -12.705 -5.364 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -8.935 -10.616 -5.267 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -8.461 -11.388 -6.768 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -9.014 -13.600 -5.849 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -9.389 -12.889 -4.292 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.149 -11.481 -5.376 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -10.792 -12.242 -6.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -12.702 -13.248 -5.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -11.441 -14.379 -5.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -11.787 -13.643 -4.487 1.00 0.00 H new ATOM 1339 N MET A 85 -5.257 -12.976 -2.875 1.00 0.00 N ATOM 1340 CA MET A 85 -3.894 -13.309 -2.525 1.00 0.00 C ATOM 1341 C MET A 85 -3.391 -14.549 -3.223 1.00 0.00 C ATOM 1342 O MET A 85 -4.047 -15.588 -3.281 1.00 0.00 O ATOM 1343 CB MET A 85 -3.701 -13.437 -1.007 1.00 0.00 C ATOM 1344 CG MET A 85 -2.247 -13.630 -0.569 1.00 0.00 C ATOM 1345 SD MET A 85 -2.063 -14.871 0.732 1.00 0.00 S ATOM 1346 CE MET A 85 -2.309 -16.384 -0.199 1.00 0.00 C ATOM 0 H MET A 85 -5.935 -13.733 -2.790 1.00 0.00 H new ATOM 0 HA MET A 85 -3.293 -12.471 -2.878 1.00 0.00 H new ATOM 0 HB2 MET A 85 -4.097 -12.543 -0.526 1.00 0.00 H new ATOM 0 HB3 MET A 85 -4.291 -14.280 -0.648 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.649 -13.924 -1.432 1.00 0.00 H new ATOM 0 HG3 MET A 85 -1.850 -12.678 -0.215 1.00 0.00 H new ATOM 0 HE1 MET A 85 -2.384 -17.226 0.489 1.00 0.00 H new ATOM 0 HE2 MET A 85 -3.227 -16.308 -0.781 1.00 0.00 H new ATOM 0 HE3 MET A 85 -1.465 -16.539 -0.871 1.00 0.00 H new ATOM 1356 N GLU A 86 -2.205 -14.379 -3.746 1.00 0.00 N ATOM 1357 CA GLU A 86 -1.424 -15.418 -4.349 1.00 0.00 C ATOM 1358 C GLU A 86 -0.379 -15.874 -3.344 1.00 0.00 C ATOM 1359 O GLU A 86 0.187 -15.064 -2.604 1.00 0.00 O ATOM 1360 CB GLU A 86 -0.776 -14.829 -5.581 1.00 0.00 C ATOM 1361 CG GLU A 86 0.035 -15.804 -6.403 1.00 0.00 C ATOM 1362 CD GLU A 86 -0.703 -17.091 -6.690 1.00 0.00 C ATOM 1363 OE1 GLU A 86 -1.410 -17.159 -7.718 1.00 0.00 O ATOM 1364 OE2 GLU A 86 -0.592 -18.039 -5.887 1.00 0.00 O ATOM 0 H GLU A 86 -1.740 -13.471 -3.762 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.028 -16.280 -4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.554 -14.402 -6.214 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.128 -14.008 -5.275 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.313 -15.333 -7.346 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.961 -16.033 -5.876 1.00 0.00 H new ATOM 1371 N GLY A 87 -0.151 -17.185 -3.328 1.00 0.00 N ATOM 1372 CA GLY A 87 0.600 -17.830 -2.265 1.00 0.00 C ATOM 1373 C GLY A 87 1.975 -17.239 -2.038 1.00 0.00 C ATOM 1374 O GLY A 87 2.421 -17.139 -0.899 1.00 0.00 O ATOM 0 H GLY A 87 -0.482 -17.824 -4.051 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.029 -17.763 -1.339 1.00 0.00 H new ATOM 0 HA3 GLY A 87 0.705 -18.889 -2.499 1.00 0.00 H new ATOM 1378 N ASP A 88 2.641 -16.832 -3.109 1.00 0.00 N ATOM 1379 CA ASP A 88 3.979 -16.263 -2.997 1.00 0.00 C ATOM 1380 C ASP A 88 3.890 -14.755 -2.761 1.00 0.00 C ATOM 1381 O ASP A 88 4.477 -13.952 -3.480 1.00 0.00 O ATOM 1382 CB ASP A 88 4.803 -16.584 -4.243 1.00 0.00 C ATOM 1383 CG ASP A 88 6.297 -16.520 -3.982 1.00 0.00 C ATOM 1384 OD1 ASP A 88 6.719 -16.751 -2.826 1.00 0.00 O ATOM 1385 OD2 ASP A 88 7.059 -16.258 -4.934 1.00 0.00 O ATOM 0 H ASP A 88 2.280 -16.884 -4.062 1.00 0.00 H new ATOM 0 HA ASP A 88 4.485 -16.711 -2.142 1.00 0.00 H new ATOM 0 HB2 ASP A 88 4.542 -17.580 -4.601 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.545 -15.882 -5.036 1.00 0.00 H new ATOM 1390 N ASN A 89 3.119 -14.416 -1.724 1.00 0.00 N ATOM 1391 CA ASN A 89 2.945 -13.056 -1.200 1.00 0.00 C ATOM 1392 C ASN A 89 2.625 -12.050 -2.278 1.00 0.00 C ATOM 1393 O ASN A 89 3.226 -10.983 -2.367 1.00 0.00 O ATOM 1394 CB ASN A 89 4.062 -12.530 -0.257 1.00 0.00 C ATOM 1395 CG ASN A 89 5.462 -13.135 -0.354 1.00 0.00 C ATOM 1396 OD1 ASN A 89 6.446 -12.458 -0.081 1.00 0.00 O ATOM 1397 ND2 ASN A 89 5.570 -14.409 -0.642 1.00 0.00 N ATOM 0 H ASN A 89 2.577 -15.107 -1.205 1.00 0.00 H new ATOM 0 HA ASN A 89 2.074 -13.166 -0.553 1.00 0.00 H new ATOM 0 HB2 ASN A 89 4.155 -11.457 -0.425 1.00 0.00 H new ATOM 0 HB3 ASN A 89 3.717 -12.664 0.768 1.00 0.00 H new ATOM 0 HD21 ASN A 89 6.487 -14.856 -0.642 1.00 0.00 H new ATOM 0 HD22 ASN A 89 4.737 -14.954 -0.866 1.00 0.00 H new ATOM 1404 N LYS A 90 1.648 -12.401 -3.082 1.00 0.00 N ATOM 1405 CA LYS A 90 1.085 -11.481 -4.036 1.00 0.00 C ATOM 1406 C LYS A 90 -0.336 -11.169 -3.615 1.00 0.00 C ATOM 1407 O LYS A 90 -1.148 -12.067 -3.462 1.00 0.00 O ATOM 1408 CB LYS A 90 1.104 -12.114 -5.422 1.00 0.00 C ATOM 1409 CG LYS A 90 2.427 -12.777 -5.737 1.00 0.00 C ATOM 1410 CD LYS A 90 2.416 -13.487 -7.066 1.00 0.00 C ATOM 1411 CE LYS A 90 3.831 -13.720 -7.544 1.00 0.00 C ATOM 1412 NZ LYS A 90 3.877 -14.365 -8.883 1.00 0.00 N ATOM 0 H LYS A 90 1.224 -13.329 -3.091 1.00 0.00 H new ATOM 0 HA LYS A 90 1.666 -10.559 -4.070 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.305 -12.852 -5.492 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.897 -11.349 -6.170 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.216 -12.024 -5.738 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.668 -13.491 -4.950 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.894 -14.439 -6.974 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.870 -12.894 -7.799 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.360 -12.768 -7.584 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.357 -14.347 -6.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.868 -14.504 -9.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.396 -15.286 -8.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.399 -13.756 -9.578 1.00 0.00 H new ATOM 1426 N MET A 91 -0.636 -9.912 -3.399 1.00 0.00 N ATOM 1427 CA MET A 91 -1.971 -9.524 -2.996 1.00 0.00 C ATOM 1428 C MET A 91 -2.455 -8.417 -3.896 1.00 0.00 C ATOM 1429 O MET A 91 -1.885 -7.327 -3.933 1.00 0.00 O ATOM 1430 CB MET A 91 -2.017 -9.066 -1.546 1.00 0.00 C ATOM 1431 CG MET A 91 -0.961 -9.713 -0.665 1.00 0.00 C ATOM 1432 SD MET A 91 -1.070 -9.198 1.056 1.00 0.00 S ATOM 1433 CE MET A 91 -0.884 -7.423 0.890 1.00 0.00 C ATOM 0 H MET A 91 0.023 -9.139 -3.494 1.00 0.00 H new ATOM 0 HA MET A 91 -2.619 -10.396 -3.084 1.00 0.00 H new ATOM 0 HB2 MET A 91 -1.892 -7.984 -1.512 1.00 0.00 H new ATOM 0 HB3 MET A 91 -3.003 -9.286 -1.136 1.00 0.00 H new ATOM 0 HG2 MET A 91 -1.063 -10.797 -0.721 1.00 0.00 H new ATOM 0 HG3 MET A 91 0.028 -9.465 -1.051 1.00 0.00 H new ATOM 0 HE1 MET A 91 -0.458 -7.014 1.807 1.00 0.00 H new ATOM 0 HE2 MET A 91 -0.221 -7.203 0.053 1.00 0.00 H new ATOM 0 HE3 MET A 91 -1.859 -6.970 0.709 1.00 0.00 H new ATOM 1443 N VAL A 92 -3.503 -8.702 -4.618 1.00 0.00 N ATOM 1444 CA VAL A 92 -3.990 -7.792 -5.625 1.00 0.00 C ATOM 1445 C VAL A 92 -5.435 -7.431 -5.321 1.00 0.00 C ATOM 1446 O VAL A 92 -6.300 -8.303 -5.280 1.00 0.00 O ATOM 1447 CB VAL A 92 -3.891 -8.412 -7.037 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -3.663 -7.333 -8.075 1.00 0.00 C ATOM 1449 CG2 VAL A 92 -2.796 -9.482 -7.105 1.00 0.00 C ATOM 0 H VAL A 92 -4.042 -9.563 -4.529 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.371 -6.895 -5.608 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.839 -8.904 -7.255 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.596 -7.787 -9.063 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.494 -6.628 -8.056 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.735 -6.806 -7.854 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.754 -9.897 -8.112 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.834 -9.034 -6.857 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.020 -10.277 -6.394 1.00 0.00 H new ATOM 1459 N THR A 93 -5.693 -6.156 -5.090 1.00 0.00 N ATOM 1460 CA THR A 93 -7.030 -5.713 -4.739 1.00 0.00 C ATOM 1461 C THR A 93 -7.502 -4.602 -5.651 1.00 0.00 C ATOM 1462 O THR A 93 -6.736 -3.716 -6.040 1.00 0.00 O ATOM 1463 CB THR A 93 -7.152 -5.269 -3.261 1.00 0.00 C ATOM 1464 OG1 THR A 93 -8.170 -4.277 -3.119 1.00 0.00 O ATOM 1465 CG2 THR A 93 -5.836 -4.740 -2.708 1.00 0.00 C ATOM 0 H THR A 93 -4.997 -5.412 -5.139 1.00 0.00 H new ATOM 0 HA THR A 93 -7.674 -6.582 -4.873 1.00 0.00 H new ATOM 0 HB THR A 93 -7.422 -6.154 -2.684 1.00 0.00 H new ATOM 0 HG1 THR A 93 -8.032 -3.784 -2.284 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.972 -4.441 -1.669 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.077 -5.521 -2.765 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.515 -3.879 -3.294 1.00 0.00 H new ATOM 1473 N THR A 94 -8.765 -4.678 -5.999 1.00 0.00 N ATOM 1474 CA THR A 94 -9.370 -3.703 -6.887 1.00 0.00 C ATOM 1475 C THR A 94 -10.650 -3.117 -6.296 1.00 0.00 C ATOM 1476 O THR A 94 -11.460 -3.834 -5.699 1.00 0.00 O ATOM 1477 CB THR A 94 -9.662 -4.307 -8.276 1.00 0.00 C ATOM 1478 OG1 THR A 94 -10.522 -3.440 -9.031 1.00 0.00 O ATOM 1479 CG2 THR A 94 -10.293 -5.673 -8.127 1.00 0.00 C ATOM 0 H THR A 94 -9.401 -5.409 -5.680 1.00 0.00 H new ATOM 0 HA THR A 94 -8.646 -2.897 -7.004 1.00 0.00 H new ATOM 0 HB THR A 94 -8.720 -4.412 -8.815 1.00 0.00 H new ATOM 0 HG1 THR A 94 -10.696 -3.837 -9.910 1.00 0.00 H new ATOM 0 HG21 THR A 94 -10.495 -6.090 -9.114 1.00 0.00 H new ATOM 0 HG22 THR A 94 -9.612 -6.331 -7.587 1.00 0.00 H new ATOM 0 HG23 THR A 94 -11.227 -5.584 -7.573 1.00 0.00 H new ATOM 1487 N PHE A 95 -10.826 -1.813 -6.457 1.00 0.00 N ATOM 1488 CA PHE A 95 -12.089 -1.171 -6.132 1.00 0.00 C ATOM 1489 C PHE A 95 -12.447 -0.165 -7.222 1.00 0.00 C ATOM 1490 O PHE A 95 -11.652 0.717 -7.553 1.00 0.00 O ATOM 1491 CB PHE A 95 -12.067 -0.515 -4.738 1.00 0.00 C ATOM 1492 CG PHE A 95 -11.011 0.537 -4.524 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -9.705 0.180 -4.228 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -11.334 1.883 -4.590 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -8.741 1.145 -4.006 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -10.373 2.852 -4.372 1.00 0.00 C ATOM 1497 CZ PHE A 95 -9.076 2.483 -4.079 1.00 0.00 C ATOM 0 H PHE A 95 -10.109 -1.180 -6.811 1.00 0.00 H new ATOM 0 HA PHE A 95 -12.862 -1.938 -6.092 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.043 -0.066 -4.553 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -11.930 -1.297 -3.991 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -9.437 -0.865 -4.170 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -12.348 2.178 -4.814 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -7.727 0.853 -3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -10.637 3.898 -4.431 1.00 0.00 H new ATOM 0 HZ PHE A 95 -8.324 3.239 -3.907 1.00 0.00 H new ATOM 1507 N LYS A 96 -13.634 -0.336 -7.797 1.00 0.00 N ATOM 1508 CA LYS A 96 -14.090 0.471 -8.927 1.00 0.00 C ATOM 1509 C LYS A 96 -13.162 0.304 -10.130 1.00 0.00 C ATOM 1510 O LYS A 96 -13.222 -0.704 -10.838 1.00 0.00 O ATOM 1511 CB LYS A 96 -14.216 1.957 -8.558 1.00 0.00 C ATOM 1512 CG LYS A 96 -15.382 2.272 -7.639 1.00 0.00 C ATOM 1513 CD LYS A 96 -15.464 3.761 -7.348 1.00 0.00 C ATOM 1514 CE LYS A 96 -15.621 4.561 -8.630 1.00 0.00 C ATOM 1515 NZ LYS A 96 -15.878 6.001 -8.368 1.00 0.00 N ATOM 0 H LYS A 96 -14.308 -1.038 -7.493 1.00 0.00 H new ATOM 0 HA LYS A 96 -15.082 0.108 -9.195 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.292 2.281 -8.079 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.321 2.540 -9.473 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -16.312 1.937 -8.098 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.271 1.722 -6.705 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.307 3.959 -6.686 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.564 4.082 -6.823 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.718 4.459 -9.232 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.443 4.148 -9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.978 6.506 -9.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -16.754 6.103 -7.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.083 6.404 -7.833 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.300 1.283 -10.347 1.00 0.00 N ATOM 1530 CA GLY A 97 -11.348 1.218 -11.423 1.00 0.00 C ATOM 1531 C GLY A 97 -9.944 1.460 -10.924 1.00 0.00 C ATOM 1532 O GLY A 97 -9.027 1.715 -11.706 1.00 0.00 O ATOM 0 H GLY A 97 -12.247 2.132 -9.785 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -11.403 0.241 -11.902 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -11.600 1.960 -12.181 1.00 0.00 H new ATOM 1536 N ILE A 98 -9.782 1.366 -9.613 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.505 1.602 -8.981 1.00 0.00 C ATOM 1538 C ILE A 98 -7.836 0.281 -8.708 1.00 0.00 C ATOM 1539 O ILE A 98 -8.325 -0.530 -7.917 1.00 0.00 O ATOM 1540 CB ILE A 98 -8.635 2.397 -7.683 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -9.237 3.758 -7.992 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -7.272 2.547 -7.011 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -8.493 4.523 -9.045 1.00 0.00 C ATOM 0 H ILE A 98 -10.532 1.125 -8.965 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.901 2.200 -9.663 1.00 0.00 H new ATOM 0 HB ILE A 98 -9.290 1.864 -6.993 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -10.269 3.624 -8.315 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -9.264 4.350 -7.077 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.382 3.116 -6.088 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.868 1.561 -6.784 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.592 3.072 -7.681 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -8.982 5.483 -9.211 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -7.467 4.690 -8.717 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -8.488 3.953 -9.974 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.735 0.057 -9.378 1.00 0.00 N ATOM 1556 CA LYS A 99 -6.097 -1.230 -9.340 1.00 0.00 C ATOM 1557 C LYS A 99 -4.861 -1.185 -8.461 1.00 0.00 C ATOM 1558 O LYS A 99 -3.936 -0.419 -8.722 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.738 -1.642 -10.751 1.00 0.00 C ATOM 1560 CG LYS A 99 -5.713 -3.136 -10.957 1.00 0.00 C ATOM 1561 CD LYS A 99 -5.283 -3.478 -12.371 1.00 0.00 C ATOM 1562 CE LYS A 99 -5.146 -4.975 -12.577 1.00 0.00 C ATOM 1563 NZ LYS A 99 -4.660 -5.292 -13.944 1.00 0.00 N ATOM 0 H LYS A 99 -6.262 0.751 -9.957 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.780 -1.964 -8.913 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.455 -1.200 -11.443 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.759 -1.233 -11.002 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -5.029 -3.595 -10.243 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -6.702 -3.551 -10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -6.011 -3.080 -13.078 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.331 -2.994 -12.588 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.455 -5.383 -11.840 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.110 -5.456 -12.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -4.577 -6.323 -14.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.333 -4.923 -14.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.729 -4.852 -14.092 1.00 0.00 H new ATOM 1577 N SER A 100 -4.860 -1.982 -7.405 1.00 0.00 N ATOM 1578 CA SER A 100 -3.714 -2.052 -6.522 1.00 0.00 C ATOM 1579 C SER A 100 -3.096 -3.444 -6.567 1.00 0.00 C ATOM 1580 O SER A 100 -3.740 -4.436 -6.225 1.00 0.00 O ATOM 1581 CB SER A 100 -4.134 -1.705 -5.095 1.00 0.00 C ATOM 1582 OG SER A 100 -4.780 -0.445 -5.053 1.00 0.00 O ATOM 0 H SER A 100 -5.638 -2.586 -7.141 1.00 0.00 H new ATOM 0 HA SER A 100 -2.968 -1.331 -6.855 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.803 -2.475 -4.711 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.258 -1.691 -4.446 1.00 0.00 H new ATOM 0 HG SER A 100 -5.042 -0.242 -4.131 1.00 0.00 H new ATOM 1588 N VAL A 101 -1.846 -3.505 -6.983 1.00 0.00 N ATOM 1589 CA VAL A 101 -1.124 -4.755 -7.065 1.00 0.00 C ATOM 1590 C VAL A 101 0.005 -4.751 -6.049 1.00 0.00 C ATOM 1591 O VAL A 101 0.859 -3.871 -6.072 1.00 0.00 O ATOM 1592 CB VAL A 101 -0.527 -4.956 -8.473 1.00 0.00 C ATOM 1593 CG1 VAL A 101 0.304 -6.224 -8.525 1.00 0.00 C ATOM 1594 CG2 VAL A 101 -1.626 -4.985 -9.521 1.00 0.00 C ATOM 0 H VAL A 101 -1.305 -2.690 -7.273 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.820 -5.568 -6.859 1.00 0.00 H new ATOM 0 HB VAL A 101 0.128 -4.113 -8.692 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.716 -6.348 -9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.118 -6.155 -7.803 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.324 -7.081 -8.283 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.185 -5.128 -10.507 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.311 -5.806 -9.308 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.173 -4.042 -9.501 1.00 0.00 H new ATOM 1604 N THR A 102 -0.009 -5.695 -5.134 1.00 0.00 N ATOM 1605 CA THR A 102 1.086 -5.840 -4.202 1.00 0.00 C ATOM 1606 C THR A 102 1.764 -7.196 -4.389 1.00 0.00 C ATOM 1607 O THR A 102 1.126 -8.232 -4.254 1.00 0.00 O ATOM 1608 CB THR A 102 0.600 -5.681 -2.747 1.00 0.00 C ATOM 1609 OG1 THR A 102 -0.729 -5.142 -2.738 1.00 0.00 O ATOM 1610 CG2 THR A 102 1.522 -4.753 -1.970 1.00 0.00 C ATOM 0 H THR A 102 -0.764 -6.371 -5.016 1.00 0.00 H new ATOM 0 HA THR A 102 1.811 -5.052 -4.405 1.00 0.00 H new ATOM 0 HB THR A 102 0.606 -6.662 -2.273 1.00 0.00 H new ATOM 0 HG1 THR A 102 -1.358 -5.817 -3.068 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.161 -4.655 -0.946 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.531 -5.166 -1.961 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.536 -3.772 -2.445 1.00 0.00 H new ATOM 1618 N GLU A 103 3.040 -7.186 -4.716 1.00 0.00 N ATOM 1619 CA GLU A 103 3.793 -8.419 -4.908 1.00 0.00 C ATOM 1620 C GLU A 103 5.081 -8.376 -4.106 1.00 0.00 C ATOM 1621 O GLU A 103 5.897 -7.473 -4.304 1.00 0.00 O ATOM 1622 CB GLU A 103 4.118 -8.598 -6.388 1.00 0.00 C ATOM 1623 CG GLU A 103 4.890 -9.835 -6.710 1.00 0.00 C ATOM 1624 CD GLU A 103 4.843 -10.171 -8.184 1.00 0.00 C ATOM 1625 OE1 GLU A 103 5.714 -9.689 -8.938 1.00 0.00 O ATOM 1626 OE2 GLU A 103 3.928 -10.903 -8.604 1.00 0.00 O ATOM 0 H GLU A 103 3.584 -6.335 -4.856 1.00 0.00 H new ATOM 0 HA GLU A 103 3.189 -9.259 -4.564 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.186 -8.610 -6.952 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.686 -7.732 -6.729 1.00 0.00 H new ATOM 0 HG2 GLU A 103 5.927 -9.704 -6.402 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.490 -10.671 -6.136 1.00 0.00 H new ATOM 1633 N PHE A 104 5.271 -9.306 -3.180 1.00 0.00 N ATOM 1634 CA PHE A 104 6.514 -9.348 -2.458 1.00 0.00 C ATOM 1635 C PHE A 104 7.282 -10.610 -2.788 1.00 0.00 C ATOM 1636 O PHE A 104 6.786 -11.728 -2.623 1.00 0.00 O ATOM 1637 CB PHE A 104 6.297 -9.265 -0.958 1.00 0.00 C ATOM 1638 CG PHE A 104 4.944 -8.781 -0.525 1.00 0.00 C ATOM 1639 CD1 PHE A 104 4.332 -7.676 -1.088 1.00 0.00 C ATOM 1640 CD2 PHE A 104 4.308 -9.436 0.483 1.00 0.00 C ATOM 1641 CE1 PHE A 104 3.098 -7.252 -0.644 1.00 0.00 C ATOM 1642 CE2 PHE A 104 3.079 -9.018 0.941 1.00 0.00 C ATOM 1643 CZ PHE A 104 2.472 -7.925 0.376 1.00 0.00 C ATOM 0 H PHE A 104 4.592 -10.022 -2.922 1.00 0.00 H new ATOM 0 HA PHE A 104 7.094 -8.479 -2.769 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.464 -10.253 -0.529 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.053 -8.603 -0.536 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.826 -7.139 -1.884 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.776 -10.300 0.932 1.00 0.00 H new ATOM 0 HE1 PHE A 104 2.625 -6.393 -1.097 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.593 -9.550 1.745 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.507 -7.596 0.732 1.00 0.00 H new ATOM 1653 N ASN A 105 8.458 -10.418 -3.332 1.00 0.00 N ATOM 1654 CA ASN A 105 9.396 -11.503 -3.522 1.00 0.00 C ATOM 1655 C ASN A 105 10.769 -11.115 -3.002 1.00 0.00 C ATOM 1656 O ASN A 105 11.207 -9.982 -3.199 1.00 0.00 O ATOM 1657 CB ASN A 105 9.471 -11.922 -4.987 1.00 0.00 C ATOM 1658 CG ASN A 105 9.137 -13.392 -5.158 1.00 0.00 C ATOM 1659 OD1 ASN A 105 9.692 -14.075 -6.023 1.00 0.00 O ATOM 1660 ND2 ASN A 105 8.212 -13.883 -4.339 1.00 0.00 N ATOM 0 H ASN A 105 8.794 -9.511 -3.655 1.00 0.00 H new ATOM 0 HA ASN A 105 9.038 -12.360 -2.951 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.780 -11.319 -5.576 1.00 0.00 H new ATOM 0 HB3 ASN A 105 10.472 -11.727 -5.372 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.935 -14.862 -4.411 1.00 0.00 H new ATOM 0 HD22 ASN A 105 7.780 -13.281 -3.638 1.00 0.00 H new ATOM 1667 N GLY A 106 11.432 -12.039 -2.322 1.00 0.00 N ATOM 1668 CA GLY A 106 12.810 -11.826 -1.915 1.00 0.00 C ATOM 1669 C GLY A 106 13.002 -10.609 -1.032 1.00 0.00 C ATOM 1670 O GLY A 106 13.934 -9.833 -1.241 1.00 0.00 O ATOM 0 H GLY A 106 11.039 -12.938 -2.043 1.00 0.00 H new ATOM 0 HA2 GLY A 106 13.163 -12.709 -1.383 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.430 -11.720 -2.805 1.00 0.00 H new ATOM 1674 N ASP A 107 12.107 -10.434 -0.063 1.00 0.00 N ATOM 1675 CA ASP A 107 12.199 -9.342 0.915 1.00 0.00 C ATOM 1676 C ASP A 107 11.923 -7.983 0.284 1.00 0.00 C ATOM 1677 O ASP A 107 12.059 -6.951 0.943 1.00 0.00 O ATOM 1678 CB ASP A 107 13.566 -9.308 1.614 1.00 0.00 C ATOM 1679 CG ASP A 107 13.797 -10.503 2.508 1.00 0.00 C ATOM 1680 OD1 ASP A 107 13.209 -10.552 3.611 1.00 0.00 O ATOM 1681 OD2 ASP A 107 14.565 -11.401 2.110 1.00 0.00 O ATOM 0 H ASP A 107 11.298 -11.041 0.070 1.00 0.00 H new ATOM 0 HA ASP A 107 11.429 -9.545 1.659 1.00 0.00 H new ATOM 0 HB2 ASP A 107 14.353 -9.266 0.861 1.00 0.00 H new ATOM 0 HB3 ASP A 107 13.643 -8.396 2.207 1.00 0.00 H new ATOM 1686 N THR A 108 11.549 -7.968 -0.983 1.00 0.00 N ATOM 1687 CA THR A 108 11.136 -6.727 -1.608 1.00 0.00 C ATOM 1688 C THR A 108 9.651 -6.730 -1.912 1.00 0.00 C ATOM 1689 O THR A 108 9.135 -7.608 -2.606 1.00 0.00 O ATOM 1690 CB THR A 108 11.945 -6.404 -2.880 1.00 0.00 C ATOM 1691 OG1 THR A 108 12.303 -7.611 -3.570 1.00 0.00 O ATOM 1692 CG2 THR A 108 13.199 -5.618 -2.539 1.00 0.00 C ATOM 0 H THR A 108 11.523 -8.787 -1.590 1.00 0.00 H new ATOM 0 HA THR A 108 11.343 -5.938 -0.885 1.00 0.00 H new ATOM 0 HB THR A 108 11.316 -5.795 -3.530 1.00 0.00 H new ATOM 0 HG1 THR A 108 11.599 -8.281 -3.445 1.00 0.00 H new ATOM 0 HG21 THR A 108 13.753 -5.402 -3.453 1.00 0.00 H new ATOM 0 HG22 THR A 108 12.921 -4.682 -2.053 1.00 0.00 H new ATOM 0 HG23 THR A 108 13.824 -6.204 -1.866 1.00 0.00 H new ATOM 1700 N ILE A 109 8.980 -5.731 -1.372 1.00 0.00 N ATOM 1701 CA ILE A 109 7.553 -5.576 -1.505 1.00 0.00 C ATOM 1702 C ILE A 109 7.240 -4.518 -2.544 1.00 0.00 C ATOM 1703 O ILE A 109 7.711 -3.384 -2.458 1.00 0.00 O ATOM 1704 CB ILE A 109 6.927 -5.171 -0.157 1.00 0.00 C ATOM 1705 CG1 ILE A 109 7.182 -6.276 0.870 1.00 0.00 C ATOM 1706 CG2 ILE A 109 5.439 -4.905 -0.301 1.00 0.00 C ATOM 1707 CD1 ILE A 109 6.037 -6.477 1.846 1.00 0.00 C ATOM 0 H ILE A 109 9.422 -4.995 -0.821 1.00 0.00 H new ATOM 0 HA ILE A 109 7.131 -6.530 -1.820 1.00 0.00 H new ATOM 0 HB ILE A 109 7.392 -4.246 0.184 1.00 0.00 H new ATOM 0 HG12 ILE A 109 7.368 -7.213 0.344 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.087 -6.039 1.429 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.025 -4.621 0.667 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.281 -4.096 -1.014 1.00 0.00 H new ATOM 0 HG23 ILE A 109 4.941 -5.806 -0.659 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.289 -7.276 2.543 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.864 -5.554 2.399 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.134 -6.746 1.297 1.00 0.00 H new ATOM 1719 N THR A 110 6.454 -4.893 -3.525 1.00 0.00 N ATOM 1720 CA THR A 110 6.114 -3.989 -4.598 1.00 0.00 C ATOM 1721 C THR A 110 4.628 -3.677 -4.587 1.00 0.00 C ATOM 1722 O THR A 110 3.800 -4.582 -4.668 1.00 0.00 O ATOM 1723 CB THR A 110 6.491 -4.587 -5.963 1.00 0.00 C ATOM 1724 OG1 THR A 110 7.845 -5.065 -5.921 1.00 0.00 O ATOM 1725 CG2 THR A 110 6.353 -3.539 -7.053 1.00 0.00 C ATOM 0 H THR A 110 6.037 -5.821 -3.602 1.00 0.00 H new ATOM 0 HA THR A 110 6.679 -3.070 -4.442 1.00 0.00 H new ATOM 0 HB THR A 110 5.818 -5.415 -6.184 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.084 -5.448 -6.791 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.623 -3.976 -8.014 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.322 -3.187 -7.091 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.015 -2.700 -6.837 1.00 0.00 H new ATOM 1733 N ASN A 111 4.293 -2.408 -4.455 1.00 0.00 N ATOM 1734 CA ASN A 111 2.901 -1.986 -4.566 1.00 0.00 C ATOM 1735 C ASN A 111 2.720 -1.070 -5.762 1.00 0.00 C ATOM 1736 O ASN A 111 3.365 -0.026 -5.862 1.00 0.00 O ATOM 1737 CB ASN A 111 2.445 -1.283 -3.284 1.00 0.00 C ATOM 1738 CG ASN A 111 0.983 -0.870 -3.320 1.00 0.00 C ATOM 1739 OD1 ASN A 111 0.606 0.149 -2.743 1.00 0.00 O ATOM 1740 ND2 ASN A 111 0.146 -1.663 -3.972 1.00 0.00 N ATOM 0 H ASN A 111 4.955 -1.654 -4.272 1.00 0.00 H new ATOM 0 HA ASN A 111 2.285 -2.873 -4.709 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.608 -1.947 -2.435 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.062 -0.399 -3.122 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.848 -1.437 -4.007 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.495 -2.500 -4.439 1.00 0.00 H new ATOM 1747 N THR A 112 1.852 -1.478 -6.672 1.00 0.00 N ATOM 1748 CA THR A 112 1.559 -0.697 -7.856 1.00 0.00 C ATOM 1749 C THR A 112 0.069 -0.342 -7.924 1.00 0.00 C ATOM 1750 O THR A 112 -0.787 -1.222 -7.981 1.00 0.00 O ATOM 1751 CB THR A 112 1.954 -1.471 -9.127 1.00 0.00 C ATOM 1752 OG1 THR A 112 2.812 -2.569 -8.781 1.00 0.00 O ATOM 1753 CG2 THR A 112 2.675 -0.562 -10.104 1.00 0.00 C ATOM 0 H THR A 112 1.335 -2.355 -6.610 1.00 0.00 H new ATOM 0 HA THR A 112 2.141 0.223 -7.797 1.00 0.00 H new ATOM 0 HB THR A 112 1.045 -1.846 -9.597 1.00 0.00 H new ATOM 0 HG1 THR A 112 3.059 -3.059 -9.593 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.946 -1.128 -10.995 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.021 0.264 -10.383 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.577 -0.168 -9.636 1.00 0.00 H new ATOM 1761 N MET A 113 -0.229 0.947 -7.889 1.00 0.00 N ATOM 1762 CA MET A 113 -1.589 1.442 -8.024 1.00 0.00 C ATOM 1763 C MET A 113 -1.750 2.194 -9.336 1.00 0.00 C ATOM 1764 O MET A 113 -0.794 2.754 -9.859 1.00 0.00 O ATOM 1765 CB MET A 113 -1.956 2.362 -6.864 1.00 0.00 C ATOM 1766 CG MET A 113 -2.119 1.630 -5.549 1.00 0.00 C ATOM 1767 SD MET A 113 -2.602 2.720 -4.197 1.00 0.00 S ATOM 1768 CE MET A 113 -2.696 1.550 -2.845 1.00 0.00 C ATOM 0 H MET A 113 0.468 1.681 -7.766 1.00 0.00 H new ATOM 0 HA MET A 113 -2.258 0.582 -8.013 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.184 3.124 -6.755 1.00 0.00 H new ATOM 0 HB3 MET A 113 -2.885 2.881 -7.101 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.869 0.848 -5.665 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.181 1.137 -5.294 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.232 2.001 -2.010 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.224 0.655 -3.174 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.689 1.281 -2.526 1.00 0.00 H new ATOM 1778 N THR A 114 -2.947 2.184 -9.877 1.00 0.00 N ATOM 1779 CA THR A 114 -3.234 2.924 -11.082 1.00 0.00 C ATOM 1780 C THR A 114 -4.457 3.807 -10.852 1.00 0.00 C ATOM 1781 O THR A 114 -5.524 3.309 -10.490 1.00 0.00 O ATOM 1782 CB THR A 114 -3.488 1.977 -12.274 1.00 0.00 C ATOM 1783 OG1 THR A 114 -2.422 1.019 -12.367 1.00 0.00 O ATOM 1784 CG2 THR A 114 -3.588 2.755 -13.577 1.00 0.00 C ATOM 0 H THR A 114 -3.741 1.668 -9.498 1.00 0.00 H new ATOM 0 HA THR A 114 -2.369 3.542 -11.323 1.00 0.00 H new ATOM 0 HB THR A 114 -4.434 1.462 -12.106 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.587 0.418 -13.124 1.00 0.00 H new ATOM 0 HG21 THR A 114 -3.767 2.064 -14.401 1.00 0.00 H new ATOM 0 HG22 THR A 114 -4.412 3.466 -13.514 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.657 3.294 -13.751 1.00 0.00 H new ATOM 1792 N LEU A 115 -4.299 5.111 -11.031 1.00 0.00 N ATOM 1793 CA LEU A 115 -5.398 6.039 -10.818 1.00 0.00 C ATOM 1794 C LEU A 115 -5.658 6.819 -12.093 1.00 0.00 C ATOM 1795 O LEU A 115 -4.837 7.629 -12.494 1.00 0.00 O ATOM 1796 CB LEU A 115 -5.059 7.004 -9.682 1.00 0.00 C ATOM 1797 CG LEU A 115 -6.237 7.386 -8.799 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -5.802 8.328 -7.710 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -7.301 8.044 -9.634 1.00 0.00 C ATOM 0 H LEU A 115 -3.424 5.548 -11.322 1.00 0.00 H new ATOM 0 HA LEU A 115 -6.292 5.477 -10.548 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -4.287 6.553 -9.059 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -4.634 7.912 -10.110 1.00 0.00 H new ATOM 0 HG LEU A 115 -6.634 6.480 -8.340 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -6.660 8.589 -7.090 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.042 7.846 -7.094 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -5.388 9.233 -8.155 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -8.144 8.317 -9.000 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -6.894 8.940 -10.102 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -7.637 7.352 -10.406 1.00 0.00 H new ATOM 1811 N GLY A 116 -6.816 6.606 -12.700 1.00 0.00 N ATOM 1812 CA GLY A 116 -7.089 7.220 -13.985 1.00 0.00 C ATOM 1813 C GLY A 116 -6.099 6.752 -15.027 1.00 0.00 C ATOM 1814 O GLY A 116 -6.295 5.712 -15.659 1.00 0.00 O ATOM 0 H GLY A 116 -7.567 6.024 -12.330 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.102 6.973 -14.303 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.040 8.305 -13.892 1.00 0.00 H new ATOM 1818 N ASP A 117 -5.031 7.517 -15.194 1.00 0.00 N ATOM 1819 CA ASP A 117 -3.913 7.101 -16.023 1.00 0.00 C ATOM 1820 C ASP A 117 -2.589 7.402 -15.312 1.00 0.00 C ATOM 1821 O ASP A 117 -1.520 7.415 -15.926 1.00 0.00 O ATOM 1822 CB ASP A 117 -3.967 7.778 -17.398 1.00 0.00 C ATOM 1823 CG ASP A 117 -2.940 7.217 -18.366 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -2.837 5.979 -18.480 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -2.229 8.017 -19.013 1.00 0.00 O ATOM 0 H ASP A 117 -4.916 8.434 -14.763 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.982 6.025 -16.184 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.964 7.655 -17.821 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.801 8.849 -17.278 1.00 0.00 H new ATOM 1830 N ILE A 118 -2.656 7.632 -14.000 1.00 0.00 N ATOM 1831 CA ILE A 118 -1.458 7.769 -13.204 1.00 0.00 C ATOM 1832 C ILE A 118 -0.985 6.380 -12.773 1.00 0.00 C ATOM 1833 O ILE A 118 -1.800 5.525 -12.410 1.00 0.00 O ATOM 1834 CB ILE A 118 -1.698 8.664 -11.951 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -2.223 7.868 -10.753 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -2.687 9.764 -12.259 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -1.122 7.414 -9.831 1.00 0.00 C ATOM 0 H ILE A 118 -3.527 7.725 -13.478 1.00 0.00 H new ATOM 0 HA ILE A 118 -0.694 8.255 -13.811 1.00 0.00 H new ATOM 0 HB ILE A 118 -0.727 9.086 -11.691 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -2.929 8.483 -10.195 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.773 6.998 -11.112 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.839 10.376 -11.370 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -2.300 10.386 -13.066 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.637 9.325 -12.564 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -1.551 6.855 -9.000 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -0.429 6.775 -10.379 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.588 8.283 -9.447 1.00 0.00 H new ATOM 1849 N VAL A 119 0.315 6.137 -12.841 1.00 0.00 N ATOM 1850 CA VAL A 119 0.855 4.872 -12.385 1.00 0.00 C ATOM 1851 C VAL A 119 1.672 5.052 -11.107 1.00 0.00 C ATOM 1852 O VAL A 119 2.723 5.685 -11.098 1.00 0.00 O ATOM 1853 CB VAL A 119 1.705 4.201 -13.479 1.00 0.00 C ATOM 1854 CG1 VAL A 119 2.754 5.163 -13.985 1.00 0.00 C ATOM 1855 CG2 VAL A 119 2.335 2.913 -12.966 1.00 0.00 C ATOM 0 H VAL A 119 1.007 6.793 -13.204 1.00 0.00 H new ATOM 0 HA VAL A 119 0.012 4.217 -12.162 1.00 0.00 H new ATOM 0 HB VAL A 119 1.055 3.936 -14.313 1.00 0.00 H new ATOM 0 HG11 VAL A 119 3.350 4.678 -14.758 1.00 0.00 H new ATOM 0 HG12 VAL A 119 2.268 6.045 -14.401 1.00 0.00 H new ATOM 0 HG13 VAL A 119 3.402 5.461 -13.161 1.00 0.00 H new ATOM 0 HG21 VAL A 119 2.930 2.459 -13.758 1.00 0.00 H new ATOM 0 HG22 VAL A 119 2.976 3.136 -12.113 1.00 0.00 H new ATOM 0 HG23 VAL A 119 1.550 2.221 -12.659 1.00 0.00 H new ATOM 1865 N TYR A 120 1.185 4.468 -10.031 1.00 0.00 N ATOM 1866 CA TYR A 120 1.842 4.561 -8.740 1.00 0.00 C ATOM 1867 C TYR A 120 2.578 3.271 -8.449 1.00 0.00 C ATOM 1868 O TYR A 120 1.980 2.209 -8.382 1.00 0.00 O ATOM 1869 CB TYR A 120 0.801 4.853 -7.650 1.00 0.00 C ATOM 1870 CG TYR A 120 1.286 4.628 -6.225 1.00 0.00 C ATOM 1871 CD1 TYR A 120 2.024 5.593 -5.552 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.988 3.448 -5.550 1.00 0.00 C ATOM 1873 CE1 TYR A 120 2.451 5.389 -4.252 1.00 0.00 C ATOM 1874 CE2 TYR A 120 1.412 3.237 -4.252 1.00 0.00 C ATOM 1875 CZ TYR A 120 2.144 4.210 -3.609 1.00 0.00 C ATOM 1876 OH TYR A 120 2.568 4.005 -2.313 1.00 0.00 O ATOM 0 H TYR A 120 0.326 3.917 -10.025 1.00 0.00 H new ATOM 0 HA TYR A 120 2.565 5.376 -8.754 1.00 0.00 H new ATOM 0 HB2 TYR A 120 0.474 5.888 -7.748 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.073 4.225 -7.825 1.00 0.00 H new ATOM 0 HD1 TYR A 120 2.269 6.518 -6.052 1.00 0.00 H new ATOM 0 HD2 TYR A 120 0.414 2.682 -6.051 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.023 6.151 -3.743 1.00 0.00 H new ATOM 0 HE2 TYR A 120 1.171 2.315 -3.745 1.00 0.00 H new ATOM 0 HH TYR A 120 1.812 3.710 -1.764 1.00 0.00 H new ATOM 1886 N LYS A 121 3.875 3.366 -8.292 1.00 0.00 N ATOM 1887 CA LYS A 121 4.674 2.209 -7.959 1.00 0.00 C ATOM 1888 C LYS A 121 5.532 2.548 -6.764 1.00 0.00 C ATOM 1889 O LYS A 121 6.171 3.584 -6.737 1.00 0.00 O ATOM 1890 CB LYS A 121 5.541 1.800 -9.153 1.00 0.00 C ATOM 1891 CG LYS A 121 5.910 0.332 -9.184 1.00 0.00 C ATOM 1892 CD LYS A 121 6.824 -0.063 -8.060 1.00 0.00 C ATOM 1893 CE LYS A 121 8.171 0.639 -8.141 1.00 0.00 C ATOM 1894 NZ LYS A 121 8.948 0.239 -9.342 1.00 0.00 N ATOM 0 H LYS A 121 4.402 4.234 -8.389 1.00 0.00 H new ATOM 0 HA LYS A 121 4.027 1.366 -7.716 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.012 2.049 -10.073 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.456 2.392 -9.142 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.001 -0.267 -9.134 1.00 0.00 H new ATOM 0 HG3 LYS A 121 6.391 0.103 -10.135 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.349 0.174 -7.108 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.977 -1.142 -8.080 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.015 1.718 -8.156 1.00 0.00 H new ATOM 0 HE3 LYS A 121 8.750 0.413 -7.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.917 0.608 -9.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.977 -0.799 -9.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.495 0.627 -10.194 1.00 0.00 H new ATOM 1908 N ARG A 122 5.543 1.702 -5.768 1.00 0.00 N ATOM 1909 CA ARG A 122 6.351 1.995 -4.599 1.00 0.00 C ATOM 1910 C ARG A 122 7.322 0.873 -4.296 1.00 0.00 C ATOM 1911 O ARG A 122 7.011 -0.308 -4.489 1.00 0.00 O ATOM 1912 CB ARG A 122 5.478 2.288 -3.380 1.00 0.00 C ATOM 1913 CG ARG A 122 5.017 1.064 -2.611 1.00 0.00 C ATOM 1914 CD ARG A 122 4.274 1.476 -1.355 1.00 0.00 C ATOM 1915 NE ARG A 122 4.158 0.388 -0.382 1.00 0.00 N ATOM 1916 CZ ARG A 122 3.025 0.069 0.244 1.00 0.00 C ATOM 1917 NH1 ARG A 122 1.887 0.673 -0.088 1.00 0.00 N ATOM 1918 NH2 ARG A 122 3.033 -0.858 1.195 1.00 0.00 N ATOM 0 H ARG A 122 5.020 0.827 -5.734 1.00 0.00 H new ATOM 0 HA ARG A 122 6.931 2.889 -4.828 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.033 2.936 -2.702 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.600 2.845 -3.706 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.369 0.454 -3.241 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.876 0.448 -2.347 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.790 2.317 -0.893 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.277 1.823 -1.626 1.00 0.00 H new ATOM 0 HE ARG A 122 4.993 -0.158 -0.171 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.881 1.381 -0.822 1.00 0.00 H new ATOM 0 HH12 ARG A 122 1.021 0.428 0.392 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.905 -1.324 1.445 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.167 -1.104 1.675 1.00 0.00 H new ATOM 1932 N VAL A 123 8.500 1.250 -3.823 1.00 0.00 N ATOM 1933 CA VAL A 123 9.476 0.286 -3.370 1.00 0.00 C ATOM 1934 C VAL A 123 9.447 0.210 -1.854 1.00 0.00 C ATOM 1935 O VAL A 123 9.663 1.195 -1.144 1.00 0.00 O ATOM 1936 CB VAL A 123 10.908 0.601 -3.869 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.413 1.928 -3.360 1.00 0.00 C ATOM 1938 CG2 VAL A 123 11.844 -0.523 -3.473 1.00 0.00 C ATOM 0 H VAL A 123 8.799 2.222 -3.745 1.00 0.00 H new ATOM 0 HA VAL A 123 9.205 -0.680 -3.797 1.00 0.00 H new ATOM 0 HB VAL A 123 10.875 0.678 -4.956 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.421 2.103 -3.737 1.00 0.00 H new ATOM 0 HG12 VAL A 123 10.753 2.725 -3.704 1.00 0.00 H new ATOM 0 HG13 VAL A 123 11.431 1.917 -2.270 1.00 0.00 H new ATOM 0 HG21 VAL A 123 12.851 -0.299 -3.825 1.00 0.00 H new ATOM 0 HG22 VAL A 123 11.853 -0.624 -2.388 1.00 0.00 H new ATOM 0 HG23 VAL A 123 11.502 -1.456 -3.921 1.00 0.00 H new ATOM 1948 N SER A 124 9.108 -0.960 -1.374 1.00 0.00 N ATOM 1949 CA SER A 124 9.118 -1.247 0.035 1.00 0.00 C ATOM 1950 C SER A 124 10.015 -2.455 0.280 1.00 0.00 C ATOM 1951 O SER A 124 9.786 -3.515 -0.284 1.00 0.00 O ATOM 1952 CB SER A 124 7.681 -1.528 0.488 1.00 0.00 C ATOM 1953 OG SER A 124 6.876 -0.366 0.376 1.00 0.00 O ATOM 0 H SER A 124 8.815 -1.745 -1.956 1.00 0.00 H new ATOM 0 HA SER A 124 9.505 -0.402 0.605 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.256 -2.329 -0.116 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.683 -1.875 1.521 1.00 0.00 H new ATOM 0 HG SER A 124 6.395 -0.219 1.217 1.00 0.00 H new ATOM 1959 N LYS A 125 11.044 -2.306 1.095 1.00 0.00 N ATOM 1960 CA LYS A 125 11.977 -3.406 1.305 1.00 0.00 C ATOM 1961 C LYS A 125 12.271 -3.616 2.783 1.00 0.00 C ATOM 1962 O LYS A 125 12.256 -2.675 3.576 1.00 0.00 O ATOM 1963 CB LYS A 125 13.265 -3.222 0.484 1.00 0.00 C ATOM 1964 CG LYS A 125 13.784 -1.816 0.382 1.00 0.00 C ATOM 1965 CD LYS A 125 14.468 -1.371 1.651 1.00 0.00 C ATOM 1966 CE LYS A 125 15.700 -2.209 1.885 1.00 0.00 C ATOM 1967 NZ LYS A 125 15.953 -2.456 3.330 1.00 0.00 N ATOM 0 H LYS A 125 11.255 -1.454 1.614 1.00 0.00 H new ATOM 0 HA LYS A 125 11.495 -4.314 0.943 1.00 0.00 H new ATOM 0 HB2 LYS A 125 14.044 -3.845 0.923 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.087 -3.597 -0.524 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.485 -1.748 -0.450 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.958 -1.140 0.159 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.741 -0.318 1.579 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.786 -1.466 2.496 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.590 -3.163 1.370 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.564 -1.709 1.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 16.952 -2.709 3.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.735 -1.596 3.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.349 -3.236 3.660 1.00 0.00 H new ATOM 1981 N ARG A 126 12.542 -4.865 3.133 1.00 0.00 N ATOM 1982 CA ARG A 126 12.571 -5.300 4.523 1.00 0.00 C ATOM 1983 C ARG A 126 13.756 -4.737 5.288 1.00 0.00 C ATOM 1984 O ARG A 126 14.833 -4.526 4.734 1.00 0.00 O ATOM 1985 CB ARG A 126 12.608 -6.825 4.591 1.00 0.00 C ATOM 1986 CG ARG A 126 12.423 -7.377 5.997 1.00 0.00 C ATOM 1987 CD ARG A 126 12.998 -8.773 6.136 1.00 0.00 C ATOM 1988 NE ARG A 126 14.352 -8.765 6.692 1.00 0.00 N ATOM 1989 CZ ARG A 126 15.259 -9.714 6.458 1.00 0.00 C ATOM 1990 NH1 ARG A 126 15.025 -10.652 5.547 1.00 0.00 N ATOM 1991 NH2 ARG A 126 16.415 -9.703 7.110 1.00 0.00 N ATOM 0 H ARG A 126 12.748 -5.605 2.462 1.00 0.00 H new ATOM 0 HA ARG A 126 11.664 -4.919 4.992 1.00 0.00 H new ATOM 0 HB2 ARG A 126 11.827 -7.228 3.946 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.561 -7.175 4.195 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.905 -6.713 6.714 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.361 -7.395 6.243 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.348 -9.369 6.777 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.012 -9.256 5.159 1.00 0.00 H new ATOM 0 HE ARG A 126 14.618 -7.986 7.295 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.149 -10.648 5.024 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.721 -11.376 5.371 1.00 0.00 H new ATOM 0 HH21 ARG A 126 16.610 -8.968 7.790 1.00 0.00 H new ATOM 0 HH22 ARG A 126 17.109 -10.429 6.931 1.00 0.00 H new ATOM 2005 N ILE A 127 13.528 -4.484 6.564 1.00 0.00 N ATOM 2006 CA ILE A 127 14.576 -4.101 7.478 1.00 0.00 C ATOM 2007 C ILE A 127 14.969 -5.287 8.350 1.00 0.00 C ATOM 2008 O ILE A 127 15.714 -6.163 7.860 1.00 0.00 O ATOM 2009 CB ILE A 127 14.152 -2.919 8.375 1.00 0.00 C ATOM 2010 CG1 ILE A 127 12.684 -2.608 8.224 1.00 0.00 C ATOM 2011 CG2 ILE A 127 14.930 -1.696 8.016 1.00 0.00 C ATOM 2012 CD1 ILE A 127 11.824 -3.602 8.926 1.00 0.00 C ATOM 2013 OXT ILE A 127 14.515 -5.356 9.511 1.00 0.00 O ATOM 0 H ILE A 127 12.604 -4.540 6.993 1.00 0.00 H new ATOM 0 HA ILE A 127 15.430 -3.782 6.881 1.00 0.00 H new ATOM 0 HB ILE A 127 14.351 -3.209 9.407 1.00 0.00 H new ATOM 0 HG12 ILE A 127 12.483 -1.612 8.619 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.425 -2.589 7.165 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.622 -0.868 8.655 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.994 -1.887 8.157 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.742 -1.438 6.974 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.776 -3.337 8.789 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.004 -4.595 8.513 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.062 -3.603 9.990 1.00 0.00 H new