USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 521 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 Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 160:sc= -0.049 (180deg=-0.575) USER MOD Single : A 85 ASN : amide:sc= -0.0238 K(o=-0.024,f=-1.3) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 92 GLN : amide:sc= -2.79! C(o=-2.8!,f=-3.1!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -17:sc= 0.162 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.501 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.017 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc=-0.00182 X(o=-0.0018,f=-0.23) USER MOD Single : A 113 THR OG1 : rot -11:sc= 0.438 USER MOD Single : A 115 THR OG1 : rot -152:sc= -2.13! USER MOD Single : A 116 SER OG : rot -90:sc= -0.633 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 43:sc= 0.0493 USER MOD Single : A 131 LYS NZ :NH3+ 158:sc= -0.0728 (180deg=-0.698) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 161:sc= -0.0473 (180deg=-0.514) USER MOD Single : A 138 MET CE :methyl 135:sc= -0.111 (180deg=-0.91) USER MOD Single : A 139 SER OG : rot 80:sc= -2.48! USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -109:sc= 0 (180deg=-0.0734) USER MOD Single : A 147 SER OG : rot 160:sc= -0.411! USER MOD Single : A 149 LYS NZ :NH3+ -133:sc= 1.43 (180deg=-0.103) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.605 -0.425 -6.756 1.00 0.00 N ATOM 17 CA ALA A 82 35.351 -1.738 -6.196 1.00 0.00 C ATOM 18 C ALA A 82 33.876 -1.874 -5.859 1.00 0.00 C ATOM 19 O ALA A 82 33.426 -1.445 -4.796 1.00 0.00 O ATOM 20 CB ALA A 82 36.192 -1.940 -4.938 1.00 0.00 C ATOM 0 HA ALA A 82 35.623 -2.498 -6.929 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.995 -2.929 -4.524 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.249 -1.856 -5.190 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.933 -1.180 -4.201 1.00 0.00 H new ATOM 26 N TYR A 83 33.139 -2.477 -6.773 1.00 0.00 N ATOM 27 CA TYR A 83 31.710 -2.689 -6.590 1.00 0.00 C ATOM 28 C TYR A 83 31.456 -3.280 -5.212 1.00 0.00 C ATOM 29 O TYR A 83 30.333 -3.270 -4.712 1.00 0.00 O ATOM 30 CB TYR A 83 31.172 -3.636 -7.674 1.00 0.00 C ATOM 31 CG TYR A 83 31.856 -3.351 -8.997 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.943 -2.036 -9.474 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.409 -4.402 -9.745 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.580 -1.774 -10.694 1.00 0.00 C ATOM 35 CE2 TYR A 83 33.045 -4.137 -10.965 1.00 0.00 C ATOM 36 CZ TYR A 83 33.131 -2.823 -11.437 1.00 0.00 C ATOM 37 OH TYR A 83 33.759 -2.562 -12.638 1.00 0.00 O ATOM 0 H TYR A 83 33.507 -2.832 -7.656 1.00 0.00 H new ATOM 0 HA TYR A 83 31.193 -1.733 -6.673 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.344 -4.672 -7.382 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.094 -3.509 -7.777 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.519 -1.225 -8.901 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.344 -5.416 -9.380 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.646 -0.760 -11.061 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.469 -4.947 -11.541 1.00 0.00 H new ATOM 0 HH TYR A 83 34.086 -3.401 -13.025 1.00 0.00 H new ATOM 47 N LYS A 84 32.518 -3.795 -4.608 1.00 0.00 N ATOM 48 CA LYS A 84 32.407 -4.391 -3.287 1.00 0.00 C ATOM 49 C LYS A 84 31.998 -3.332 -2.274 1.00 0.00 C ATOM 50 O LYS A 84 31.151 -3.573 -1.413 1.00 0.00 O ATOM 51 CB LYS A 84 33.737 -5.023 -2.875 1.00 0.00 C ATOM 52 CG LYS A 84 34.042 -6.203 -3.799 1.00 0.00 C ATOM 53 CD LYS A 84 35.366 -6.848 -3.389 1.00 0.00 C ATOM 54 CE LYS A 84 35.646 -8.051 -4.290 1.00 0.00 C ATOM 55 NZ LYS A 84 35.766 -7.594 -5.705 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.456 -3.812 -5.008 1.00 0.00 H new ATOM 0 HA LYS A 84 31.645 -5.170 -3.317 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.537 -4.285 -2.932 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.688 -5.360 -1.840 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.237 -6.936 -3.746 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.097 -5.863 -4.833 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.176 -6.123 -3.469 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.322 -7.163 -2.346 1.00 0.00 H new ATOM 0 HE2 LYS A 84 36.565 -8.547 -3.977 1.00 0.00 H new ATOM 0 HE3 LYS A 84 34.842 -8.782 -4.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 36.276 -8.311 -6.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 34.817 -7.456 -6.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 36.289 -6.695 -5.736 1.00 0.00 H new ATOM 69 N ASN A 85 32.621 -2.163 -2.380 1.00 0.00 N ATOM 70 CA ASN A 85 32.326 -1.074 -1.451 1.00 0.00 C ATOM 71 C ASN A 85 30.877 -0.627 -1.588 1.00 0.00 C ATOM 72 O ASN A 85 30.192 -0.401 -0.593 1.00 0.00 O ATOM 73 CB ASN A 85 33.254 0.113 -1.710 1.00 0.00 C ATOM 74 CG ASN A 85 32.934 1.247 -0.741 1.00 0.00 C ATOM 75 OD1 ASN A 85 32.452 1.001 0.366 1.00 0.00 O ATOM 76 ND2 ASN A 85 33.172 2.482 -1.092 1.00 0.00 N ATOM 0 H ASN A 85 33.323 -1.945 -3.087 1.00 0.00 H new ATOM 0 HA ASN A 85 32.488 -1.442 -0.438 1.00 0.00 H new ATOM 0 HB2 ASN A 85 34.293 -0.195 -1.592 1.00 0.00 H new ATOM 0 HB3 ASN A 85 33.138 0.458 -2.737 1.00 0.00 H new ATOM 0 HD21 ASN A 85 32.959 3.245 -0.449 1.00 0.00 H new ATOM 0 HD22 ASN A 85 33.571 2.684 -2.009 1.00 0.00 H new ATOM 83 N LEU A 86 30.420 -0.489 -2.825 1.00 0.00 N ATOM 84 CA LEU A 86 29.052 -0.054 -3.081 1.00 0.00 C ATOM 85 C LEU A 86 28.051 -1.039 -2.503 1.00 0.00 C ATOM 86 O LEU A 86 27.040 -0.642 -1.921 1.00 0.00 O ATOM 87 CB LEU A 86 28.834 0.069 -4.586 1.00 0.00 C ATOM 88 CG LEU A 86 27.374 0.504 -4.899 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.359 1.532 -6.039 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.537 -0.713 -5.326 1.00 0.00 C ATOM 0 H LEU A 86 30.972 -0.671 -3.663 1.00 0.00 H new ATOM 0 HA LEU A 86 28.900 0.913 -2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.532 0.796 -5.001 1.00 0.00 H new ATOM 0 HB3 LEU A 86 29.045 -0.886 -5.068 1.00 0.00 H new ATOM 0 HG LEU A 86 26.951 0.946 -3.997 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.331 1.828 -6.248 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.937 2.409 -5.746 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.798 1.090 -6.933 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.517 -0.395 -5.542 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.975 -1.161 -6.218 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.525 -1.447 -4.520 1.00 0.00 H new ATOM 102 N LEU A 87 28.334 -2.324 -2.666 1.00 0.00 N ATOM 103 CA LEU A 87 27.442 -3.355 -2.160 1.00 0.00 C ATOM 104 C LEU A 87 27.251 -3.175 -0.661 1.00 0.00 C ATOM 105 O LEU A 87 26.164 -3.393 -0.126 1.00 0.00 O ATOM 106 CB LEU A 87 28.012 -4.743 -2.461 1.00 0.00 C ATOM 107 CG LEU A 87 27.869 -5.053 -3.960 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.732 -6.275 -4.308 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.395 -5.338 -4.320 1.00 0.00 C ATOM 0 H LEU A 87 29.166 -2.674 -3.140 1.00 0.00 H new ATOM 0 HA LEU A 87 26.475 -3.265 -2.655 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.062 -4.786 -2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.488 -5.496 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 87 28.202 -4.188 -4.533 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.634 -6.499 -5.370 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.776 -6.061 -4.077 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.400 -7.133 -3.724 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.316 -5.555 -5.385 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.040 -6.195 -3.748 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.787 -4.465 -4.081 1.00 0.00 H new ATOM 121 N GLN A 88 28.312 -2.768 0.016 1.00 0.00 N ATOM 122 CA GLN A 88 28.239 -2.542 1.448 1.00 0.00 C ATOM 123 C GLN A 88 27.398 -1.304 1.753 1.00 0.00 C ATOM 124 O GLN A 88 26.694 -1.258 2.761 1.00 0.00 O ATOM 125 CB GLN A 88 29.643 -2.361 2.018 1.00 0.00 C ATOM 126 CG GLN A 88 30.402 -3.684 1.913 1.00 0.00 C ATOM 127 CD GLN A 88 31.844 -3.491 2.363 1.00 0.00 C ATOM 128 OE1 GLN A 88 32.230 -2.391 2.758 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.666 -4.503 2.328 1.00 0.00 N ATOM 0 H GLN A 88 29.226 -2.589 -0.399 1.00 0.00 H new ATOM 0 HA GLN A 88 27.768 -3.409 1.911 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.172 -1.580 1.472 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.588 -2.041 3.059 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.918 -4.441 2.530 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.378 -4.047 0.885 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.341 -5.413 2.000 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.633 -4.385 2.629 1.00 0.00 H new ATOM 138 N GLU A 89 27.490 -0.289 0.889 1.00 0.00 N ATOM 139 CA GLU A 89 26.739 0.946 1.107 1.00 0.00 C ATOM 140 C GLU A 89 25.235 0.700 1.065 1.00 0.00 C ATOM 141 O GLU A 89 24.500 1.143 1.943 1.00 0.00 O ATOM 142 CB GLU A 89 27.111 1.974 0.037 1.00 0.00 C ATOM 143 CG GLU A 89 28.563 2.422 0.225 1.00 0.00 C ATOM 144 CD GLU A 89 28.708 3.211 1.523 1.00 0.00 C ATOM 145 OE1 GLU A 89 27.706 3.722 1.997 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.816 3.290 2.025 1.00 0.00 O1- ATOM 0 H GLU A 89 28.066 -0.298 0.048 1.00 0.00 H new ATOM 0 HA GLU A 89 26.998 1.323 2.096 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.980 1.542 -0.955 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.445 2.835 0.100 1.00 0.00 H new ATOM 0 HG2 GLU A 89 29.220 1.552 0.244 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.874 3.037 -0.620 1.00 0.00 H new ATOM 153 N ILE A 90 24.780 -0.006 0.040 1.00 0.00 N ATOM 154 CA ILE A 90 23.357 -0.294 -0.097 1.00 0.00 C ATOM 155 C ILE A 90 22.873 -1.160 1.063 1.00 0.00 C ATOM 156 O ILE A 90 21.807 -0.916 1.627 1.00 0.00 O ATOM 157 CB ILE A 90 23.099 -1.000 -1.435 1.00 0.00 C ATOM 158 CG1 ILE A 90 24.022 -2.214 -1.559 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.387 -0.033 -2.584 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.815 -2.893 -2.911 1.00 0.00 C ATOM 0 H ILE A 90 25.367 -0.387 -0.702 1.00 0.00 H new ATOM 0 HA ILE A 90 22.802 0.644 -0.077 1.00 0.00 H new ATOM 0 HB ILE A 90 22.059 -1.324 -1.478 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.061 -1.903 -1.455 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.818 -2.920 -0.754 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.204 -0.533 -3.535 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.735 0.836 -2.500 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.428 0.288 -2.537 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.476 -3.756 -2.990 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.779 -3.221 -2.999 1.00 0.00 H new ATOM 0 HD13 ILE A 90 24.042 -2.188 -3.711 1.00 0.00 H new ATOM 172 N ALA A 91 23.658 -2.173 1.412 1.00 0.00 N ATOM 173 CA ALA A 91 23.288 -3.067 2.501 1.00 0.00 C ATOM 174 C ALA A 91 23.243 -2.317 3.825 1.00 0.00 C ATOM 175 O ALA A 91 22.286 -2.447 4.587 1.00 0.00 O ATOM 176 CB ALA A 91 24.286 -4.219 2.604 1.00 0.00 C ATOM 0 H ALA A 91 24.546 -2.394 0.961 1.00 0.00 H new ATOM 0 HA ALA A 91 22.296 -3.465 2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 91 23.997 -4.879 3.422 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.292 -4.780 1.670 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.283 -3.821 2.794 1.00 0.00 H new ATOM 182 N GLN A 92 24.284 -1.538 4.096 1.00 0.00 N ATOM 183 CA GLN A 92 24.352 -0.781 5.339 1.00 0.00 C ATOM 184 C GLN A 92 23.259 0.284 5.386 1.00 0.00 C ATOM 185 O GLN A 92 22.571 0.436 6.397 1.00 0.00 O ATOM 186 CB GLN A 92 25.731 -0.117 5.470 1.00 0.00 C ATOM 187 CG GLN A 92 26.026 0.187 6.943 1.00 0.00 C ATOM 188 CD GLN A 92 24.995 1.168 7.490 1.00 0.00 C ATOM 189 OE1 GLN A 92 24.800 2.244 6.924 1.00 0.00 O ATOM 190 NE2 GLN A 92 24.316 0.858 8.560 1.00 0.00 N ATOM 0 H GLN A 92 25.086 -1.415 3.477 1.00 0.00 H new ATOM 0 HA GLN A 92 24.200 -1.469 6.170 1.00 0.00 H new ATOM 0 HB2 GLN A 92 26.500 -0.774 5.064 1.00 0.00 H new ATOM 0 HB3 GLN A 92 25.758 0.804 4.887 1.00 0.00 H new ATOM 0 HG2 GLN A 92 26.007 -0.735 7.524 1.00 0.00 H new ATOM 0 HG3 GLN A 92 27.027 0.606 7.043 1.00 0.00 H new ATOM 0 HE21 GLN A 92 24.479 -0.034 9.027 1.00 0.00 H new ATOM 0 HE22 GLN A 92 23.622 1.508 8.929 1.00 0.00 H new ATOM 199 N LYS A 93 23.110 1.021 4.292 1.00 0.00 N ATOM 200 CA LYS A 93 22.101 2.072 4.225 1.00 0.00 C ATOM 201 C LYS A 93 20.701 1.490 4.369 1.00 0.00 C ATOM 202 O LYS A 93 19.868 2.025 5.101 1.00 0.00 O ATOM 203 CB LYS A 93 22.215 2.813 2.891 1.00 0.00 C ATOM 204 CG LYS A 93 23.463 3.701 2.899 1.00 0.00 C ATOM 205 CD LYS A 93 23.677 4.307 1.505 1.00 0.00 C ATOM 206 CE LYS A 93 22.674 5.442 1.258 1.00 0.00 C ATOM 207 NZ LYS A 93 23.077 6.198 0.036 1.00 0.00 N1+ ATOM 0 H LYS A 93 23.669 0.912 3.446 1.00 0.00 H new ATOM 0 HA LYS A 93 22.273 2.767 5.047 1.00 0.00 H new ATOM 0 HB2 LYS A 93 22.271 2.098 2.070 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.326 3.421 2.724 1.00 0.00 H new ATOM 0 HG2 LYS A 93 23.351 4.495 3.638 1.00 0.00 H new ATOM 0 HG3 LYS A 93 24.335 3.116 3.189 1.00 0.00 H new ATOM 0 HD2 LYS A 93 24.695 4.687 1.419 1.00 0.00 H new ATOM 0 HD3 LYS A 93 23.559 3.536 0.744 1.00 0.00 H new ATOM 0 HE2 LYS A 93 21.670 5.035 1.134 1.00 0.00 H new ATOM 0 HE3 LYS A 93 22.643 6.110 2.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 22.399 6.968 -0.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 24.028 6.597 0.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 23.085 5.556 -0.782 1.00 0.00 H new ATOM 221 N GLU A 94 20.446 0.392 3.663 1.00 0.00 N ATOM 222 CA GLU A 94 19.136 -0.253 3.714 1.00 0.00 C ATOM 223 C GLU A 94 19.117 -1.322 4.800 1.00 0.00 C ATOM 224 O GLU A 94 18.104 -1.988 5.010 1.00 0.00 O ATOM 225 CB GLU A 94 18.813 -0.891 2.362 1.00 0.00 C ATOM 226 CG GLU A 94 18.676 0.208 1.305 1.00 0.00 C ATOM 227 CD GLU A 94 18.412 -0.412 -0.063 1.00 0.00 C ATOM 228 OE1 GLU A 94 18.318 -1.627 -0.133 1.00 0.00 O ATOM 229 OE2 GLU A 94 18.306 0.337 -1.020 1.00 0.00 O1- ATOM 0 H GLU A 94 21.123 -0.067 3.053 1.00 0.00 H new ATOM 0 HA GLU A 94 18.385 0.503 3.944 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.601 -1.588 2.078 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.889 -1.465 2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.861 0.881 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.586 0.807 1.272 1.00 0.00 H new ATOM 236 N SER A 95 20.249 -1.489 5.484 1.00 0.00 N ATOM 237 CA SER A 95 20.351 -2.490 6.544 1.00 0.00 C ATOM 238 C SER A 95 19.657 -3.782 6.128 1.00 0.00 C ATOM 239 O SER A 95 18.511 -4.032 6.505 1.00 0.00 O ATOM 240 CB SER A 95 19.707 -1.960 7.825 1.00 0.00 C ATOM 241 OG SER A 95 20.218 -0.664 8.105 1.00 0.00 O ATOM 0 H SER A 95 21.100 -0.950 5.325 1.00 0.00 H new ATOM 0 HA SER A 95 21.406 -2.695 6.723 1.00 0.00 H new ATOM 0 HB2 SER A 95 18.624 -1.920 7.712 1.00 0.00 H new ATOM 0 HB3 SER A 95 19.916 -2.633 8.656 1.00 0.00 H new ATOM 0 HG SER A 95 21.039 -0.518 7.590 1.00 0.00 H new ATOM 247 N SER A 96 20.358 -4.596 5.343 1.00 0.00 N ATOM 248 CA SER A 96 19.802 -5.862 4.867 1.00 0.00 C ATOM 249 C SER A 96 20.854 -6.960 4.901 1.00 0.00 C ATOM 250 O SER A 96 20.885 -7.826 4.025 1.00 0.00 O ATOM 251 CB SER A 96 19.285 -5.703 3.438 1.00 0.00 C ATOM 252 OG SER A 96 20.350 -5.276 2.601 1.00 0.00 O ATOM 0 H SER A 96 21.308 -4.404 5.024 1.00 0.00 H new ATOM 0 HA SER A 96 18.979 -6.140 5.526 1.00 0.00 H new ATOM 0 HB2 SER A 96 18.880 -6.649 3.078 1.00 0.00 H new ATOM 0 HB3 SER A 96 18.472 -4.977 3.411 1.00 0.00 H new ATOM 0 HG SER A 96 20.024 -5.174 1.683 1.00 0.00 H new ATOM 258 N LEU A 97 21.716 -6.925 5.913 1.00 0.00 N ATOM 259 CA LEU A 97 22.767 -7.926 6.058 1.00 0.00 C ATOM 260 C LEU A 97 23.940 -7.617 5.133 1.00 0.00 C ATOM 261 O LEU A 97 23.945 -8.007 3.965 1.00 0.00 O ATOM 262 CB LEU A 97 22.208 -9.332 5.767 1.00 0.00 C ATOM 263 CG LEU A 97 22.970 -10.395 6.584 1.00 0.00 C ATOM 264 CD1 LEU A 97 24.471 -10.275 6.284 1.00 0.00 C ATOM 265 CD2 LEU A 97 22.703 -10.212 8.104 1.00 0.00 C ATOM 0 H LEU A 97 21.707 -6.214 6.644 1.00 0.00 H new ATOM 0 HA LEU A 97 23.128 -7.899 7.086 1.00 0.00 H new ATOM 0 HB2 LEU A 97 21.147 -9.366 6.014 1.00 0.00 H new ATOM 0 HB3 LEU A 97 22.295 -9.551 4.703 1.00 0.00 H new ATOM 0 HG LEU A 97 22.620 -11.388 6.300 1.00 0.00 H new ATOM 0 HD11 LEU A 97 25.018 -11.023 6.858 1.00 0.00 H new ATOM 0 HD12 LEU A 97 24.643 -10.436 5.220 1.00 0.00 H new ATOM 0 HD13 LEU A 97 24.819 -9.280 6.561 1.00 0.00 H new ATOM 0 HD21 LEU A 97 23.249 -10.971 8.663 1.00 0.00 H new ATOM 0 HD22 LEU A 97 23.036 -9.222 8.415 1.00 0.00 H new ATOM 0 HD23 LEU A 97 21.636 -10.314 8.301 1.00 0.00 H new ATOM 277 N LEU A 98 24.933 -6.912 5.665 1.00 0.00 N ATOM 278 CA LEU A 98 26.106 -6.554 4.885 1.00 0.00 C ATOM 279 C LEU A 98 26.611 -7.768 4.097 1.00 0.00 C ATOM 280 O LEU A 98 26.485 -8.906 4.552 1.00 0.00 O ATOM 281 CB LEU A 98 27.215 -6.033 5.812 1.00 0.00 C ATOM 282 CG LEU A 98 26.936 -4.573 6.177 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.602 -4.474 6.922 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.066 -4.048 7.065 1.00 0.00 C ATOM 0 H LEU A 98 24.947 -6.580 6.629 1.00 0.00 H new ATOM 0 HA LEU A 98 25.832 -5.768 4.181 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.263 -6.641 6.715 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.184 -6.116 5.319 1.00 0.00 H new ATOM 0 HG LEU A 98 26.882 -3.974 5.268 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.406 -3.433 7.181 1.00 0.00 H new ATOM 0 HD12 LEU A 98 24.800 -4.847 6.284 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.649 -5.072 7.832 1.00 0.00 H new ATOM 0 HD21 LEU A 98 27.870 -3.008 7.327 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.122 -4.647 7.974 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.012 -4.115 6.528 1.00 0.00 H new ATOM 296 N PRO A 99 27.170 -7.550 2.934 1.00 0.00 N ATOM 297 CA PRO A 99 27.698 -8.652 2.072 1.00 0.00 C ATOM 298 C PRO A 99 28.930 -9.313 2.686 1.00 0.00 C ATOM 299 O PRO A 99 29.782 -8.637 3.263 1.00 0.00 O ATOM 300 CB PRO A 99 28.031 -7.942 0.749 1.00 0.00 C ATOM 301 CG PRO A 99 28.304 -6.524 1.135 1.00 0.00 C ATOM 302 CD PRO A 99 27.376 -6.230 2.312 1.00 0.00 C ATOM 0 HA PRO A 99 26.985 -9.467 1.946 1.00 0.00 H new ATOM 0 HB2 PRO A 99 28.897 -8.394 0.265 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.201 -8.008 0.045 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.348 -6.389 1.417 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.108 -5.847 0.303 1.00 0.00 H new ATOM 0 HD2 PRO A 99 27.826 -5.524 3.010 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.434 -5.793 1.980 1.00 0.00 H new ATOM 310 N PHE A 100 29.029 -10.636 2.563 1.00 0.00 N ATOM 311 CA PHE A 100 30.162 -11.373 3.105 1.00 0.00 C ATOM 312 C PHE A 100 30.756 -12.216 2.000 1.00 0.00 C ATOM 313 O PHE A 100 30.036 -12.927 1.298 1.00 0.00 O ATOM 314 CB PHE A 100 29.707 -12.269 4.258 1.00 0.00 C ATOM 315 CG PHE A 100 30.879 -13.084 4.748 1.00 0.00 C ATOM 316 CD1 PHE A 100 31.884 -12.471 5.502 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.964 -14.449 4.443 1.00 0.00 C ATOM 318 CE1 PHE A 100 32.977 -13.220 5.950 1.00 0.00 C ATOM 319 CE2 PHE A 100 32.056 -15.198 4.893 1.00 0.00 C ATOM 320 CZ PHE A 100 33.063 -14.584 5.647 1.00 0.00 C ATOM 0 H PHE A 100 28.336 -11.217 2.092 1.00 0.00 H new ATOM 0 HA PHE A 100 30.908 -10.676 3.487 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.307 -11.662 5.070 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.904 -12.928 3.927 1.00 0.00 H new ATOM 0 HD1 PHE A 100 31.816 -11.419 5.739 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.187 -14.922 3.861 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.755 -12.746 6.530 1.00 0.00 H new ATOM 0 HE2 PHE A 100 32.122 -16.250 4.659 1.00 0.00 H new ATOM 0 HZ PHE A 100 33.906 -15.162 5.995 1.00 0.00 H new ATOM 330 N TYR A 101 32.064 -12.127 1.828 1.00 0.00 N ATOM 331 CA TYR A 101 32.728 -12.881 0.777 1.00 0.00 C ATOM 332 C TYR A 101 33.326 -14.164 1.342 1.00 0.00 C ATOM 333 O TYR A 101 33.820 -14.178 2.468 1.00 0.00 O ATOM 334 CB TYR A 101 33.844 -12.035 0.160 1.00 0.00 C ATOM 335 CG TYR A 101 33.256 -10.782 -0.439 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.739 -10.803 -1.740 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.225 -9.599 0.309 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.191 -9.641 -2.292 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.676 -8.438 -0.243 1.00 0.00 C ATOM 340 CZ TYR A 101 32.158 -8.458 -1.543 1.00 0.00 C ATOM 341 OH TYR A 101 31.613 -7.313 -2.085 1.00 0.00 O ATOM 0 H TYR A 101 32.682 -11.547 2.395 1.00 0.00 H new ATOM 0 HA TYR A 101 31.993 -13.135 0.014 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.581 -11.776 0.921 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.366 -12.607 -0.607 1.00 0.00 H new ATOM 0 HD1 TYR A 101 32.763 -11.716 -2.317 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.625 -9.583 1.312 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.793 -9.656 -3.296 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.652 -7.525 0.334 1.00 0.00 H new ATOM 0 HH TYR A 101 31.669 -6.584 -1.433 1.00 0.00 H new ATOM 351 N ALA A 102 33.283 -15.236 0.555 1.00 0.00 N ATOM 352 CA ALA A 102 33.833 -16.523 0.984 1.00 0.00 C ATOM 353 C ALA A 102 34.494 -17.225 -0.194 1.00 0.00 C ATOM 354 O ALA A 102 34.021 -17.128 -1.324 1.00 0.00 O ATOM 355 CB ALA A 102 32.718 -17.407 1.547 1.00 0.00 C ATOM 0 H ALA A 102 32.875 -15.241 -0.380 1.00 0.00 H new ATOM 0 HA ALA A 102 34.577 -16.346 1.760 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.136 -18.362 1.864 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.257 -16.911 2.402 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.965 -17.578 0.777 1.00 0.00 H new ATOM 361 N THR A 103 35.591 -17.936 0.077 1.00 0.00 N ATOM 362 CA THR A 103 36.322 -18.659 -0.968 1.00 0.00 C ATOM 363 C THR A 103 36.456 -20.138 -0.601 1.00 0.00 C ATOM 364 O THR A 103 36.875 -20.473 0.506 1.00 0.00 O ATOM 365 CB THR A 103 37.718 -18.057 -1.136 1.00 0.00 C ATOM 366 OG1 THR A 103 37.603 -16.685 -1.487 1.00 0.00 O ATOM 367 CG2 THR A 103 38.473 -18.806 -2.237 1.00 0.00 C ATOM 0 H THR A 103 35.993 -18.027 1.010 1.00 0.00 H new ATOM 0 HA THR A 103 35.766 -18.570 -1.902 1.00 0.00 H new ATOM 0 HB THR A 103 38.266 -18.148 -0.198 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.497 -16.298 -1.593 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.467 -18.375 -2.354 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.563 -19.858 -1.965 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.927 -18.719 -3.176 1.00 0.00 H new ATOM 375 N ALA A 104 36.108 -21.020 -1.541 1.00 0.00 N ATOM 376 CA ALA A 104 36.201 -22.467 -1.317 1.00 0.00 C ATOM 377 C ALA A 104 37.158 -23.088 -2.331 1.00 0.00 C ATOM 378 O ALA A 104 37.247 -22.628 -3.467 1.00 0.00 O ATOM 379 CB ALA A 104 34.816 -23.101 -1.462 1.00 0.00 C ATOM 0 H ALA A 104 35.760 -20.759 -2.464 1.00 0.00 H new ATOM 0 HA ALA A 104 36.578 -22.649 -0.311 1.00 0.00 H new ATOM 0 HB1 ALA A 104 34.889 -24.176 -1.295 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.138 -22.665 -0.729 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.434 -22.915 -2.466 1.00 0.00 H new ATOM 385 N THR A 105 37.872 -24.138 -1.920 1.00 0.00 N ATOM 386 CA THR A 105 38.817 -24.813 -2.794 1.00 0.00 C ATOM 387 C THR A 105 38.298 -26.199 -3.159 1.00 0.00 C ATOM 388 O THR A 105 37.768 -26.914 -2.310 1.00 0.00 O ATOM 389 CB THR A 105 40.151 -24.946 -2.071 1.00 0.00 C ATOM 390 OG1 THR A 105 40.019 -25.875 -1.003 1.00 0.00 O ATOM 391 CG2 THR A 105 40.583 -23.587 -1.518 1.00 0.00 C ATOM 0 H THR A 105 37.809 -24.536 -0.983 1.00 0.00 H new ATOM 0 HA THR A 105 38.942 -24.232 -3.708 1.00 0.00 H new ATOM 0 HB THR A 105 40.906 -25.301 -2.773 1.00 0.00 H new ATOM 0 HG1 THR A 105 40.877 -25.963 -0.538 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.538 -23.691 -1.002 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.689 -22.877 -2.338 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.831 -23.223 -0.818 1.00 0.00 H new ATOM 399 N SER A 106 38.456 -26.576 -4.421 1.00 0.00 N ATOM 400 CA SER A 106 38.000 -27.879 -4.874 1.00 0.00 C ATOM 401 C SER A 106 38.569 -28.180 -6.248 1.00 0.00 C ATOM 402 O SER A 106 38.879 -27.263 -7.010 1.00 0.00 O ATOM 403 CB SER A 106 36.473 -27.911 -4.935 1.00 0.00 C ATOM 404 OG SER A 106 36.051 -29.180 -5.414 1.00 0.00 O ATOM 0 H SER A 106 38.893 -26.002 -5.142 1.00 0.00 H new ATOM 0 HA SER A 106 38.346 -28.634 -4.168 1.00 0.00 H new ATOM 0 HB2 SER A 106 36.054 -27.724 -3.946 1.00 0.00 H new ATOM 0 HB3 SER A 106 36.107 -27.121 -5.591 1.00 0.00 H new ATOM 0 HG SER A 106 35.072 -29.206 -5.453 1.00 0.00 H new ATOM 410 N GLY A 107 38.701 -29.467 -6.568 1.00 0.00 N ATOM 411 CA GLY A 107 39.230 -29.878 -7.871 1.00 0.00 C ATOM 412 C GLY A 107 40.410 -30.837 -7.714 1.00 0.00 C ATOM 413 O GLY A 107 40.755 -31.229 -6.599 1.00 0.00 O ATOM 0 H GLY A 107 38.452 -30.239 -5.949 1.00 0.00 H new ATOM 0 HA2 GLY A 107 38.442 -30.359 -8.450 1.00 0.00 H new ATOM 0 HA3 GLY A 107 39.546 -28.998 -8.432 1.00 0.00 H new ATOM 417 N PRO A 108 41.032 -31.215 -8.807 1.00 0.00 N ATOM 418 CA PRO A 108 42.201 -32.147 -8.787 1.00 0.00 C ATOM 419 C PRO A 108 43.380 -31.582 -8.003 1.00 0.00 C ATOM 420 O PRO A 108 43.550 -30.367 -7.899 1.00 0.00 O ATOM 421 CB PRO A 108 42.573 -32.332 -10.275 1.00 0.00 C ATOM 422 CG PRO A 108 41.916 -31.206 -10.999 1.00 0.00 C ATOM 423 CD PRO A 108 40.687 -30.807 -10.181 1.00 0.00 C ATOM 0 HA PRO A 108 41.952 -33.085 -8.291 1.00 0.00 H new ATOM 0 HB2 PRO A 108 43.654 -32.309 -10.414 1.00 0.00 H new ATOM 0 HB3 PRO A 108 42.224 -33.294 -10.649 1.00 0.00 H new ATOM 0 HG2 PRO A 108 42.600 -30.364 -11.104 1.00 0.00 H new ATOM 0 HG3 PRO A 108 41.628 -31.510 -12.005 1.00 0.00 H new ATOM 0 HD2 PRO A 108 40.495 -29.736 -10.244 1.00 0.00 H new ATOM 0 HD3 PRO A 108 39.789 -31.313 -10.535 1.00 0.00 H new ATOM 431 N SER A 109 44.195 -32.479 -7.466 1.00 0.00 N ATOM 432 CA SER A 109 45.364 -32.070 -6.710 1.00 0.00 C ATOM 433 C SER A 109 46.373 -31.403 -7.635 1.00 0.00 C ATOM 434 O SER A 109 47.289 -30.716 -7.177 1.00 0.00 O ATOM 435 CB SER A 109 46.014 -33.285 -6.047 1.00 0.00 C ATOM 436 OG SER A 109 46.471 -34.180 -7.053 1.00 0.00 O ATOM 0 H SER A 109 44.067 -33.488 -7.540 1.00 0.00 H new ATOM 0 HA SER A 109 45.052 -31.363 -5.941 1.00 0.00 H new ATOM 0 HB2 SER A 109 46.847 -32.969 -5.419 1.00 0.00 H new ATOM 0 HB3 SER A 109 45.297 -33.786 -5.397 1.00 0.00 H new ATOM 0 HG SER A 109 46.890 -34.959 -6.632 1.00 0.00 H new ATOM 442 N HIS A 110 46.205 -31.606 -8.945 1.00 0.00 N ATOM 443 CA HIS A 110 47.114 -31.016 -9.927 1.00 0.00 C ATOM 444 C HIS A 110 46.589 -29.665 -10.387 1.00 0.00 C ATOM 445 O HIS A 110 47.348 -28.704 -10.522 1.00 0.00 O ATOM 446 CB HIS A 110 47.272 -31.946 -11.131 1.00 0.00 C ATOM 447 CG HIS A 110 48.424 -31.474 -11.981 1.00 0.00 C ATOM 448 ND1 HIS A 110 48.260 -30.559 -13.008 1.00 0.00 N ATOM 449 CD2 HIS A 110 49.762 -31.782 -11.964 1.00 0.00 C ATOM 450 CE1 HIS A 110 49.468 -30.348 -13.562 1.00 0.00 C ATOM 451 NE2 HIS A 110 50.420 -31.071 -12.963 1.00 0.00 N ATOM 0 H HIS A 110 45.455 -32.169 -9.346 1.00 0.00 H new ATOM 0 HA HIS A 110 48.087 -30.877 -9.456 1.00 0.00 H new ATOM 0 HB2 HIS A 110 47.449 -32.968 -10.795 1.00 0.00 H new ATOM 0 HB3 HIS A 110 46.354 -31.958 -11.718 1.00 0.00 H new ATOM 0 HD2 HIS A 110 50.233 -32.472 -11.279 1.00 0.00 H new ATOM 0 HE1 HIS A 110 49.647 -29.677 -14.389 1.00 0.00 H new ATOM 0 HE2 HIS A 110 51.414 -31.096 -13.189 1.00 0.00 H new ATOM 459 N ALA A 111 45.277 -29.597 -10.616 1.00 0.00 N ATOM 460 CA ALA A 111 44.637 -28.355 -11.050 1.00 0.00 C ATOM 461 C ALA A 111 43.509 -27.973 -10.082 1.00 0.00 C ATOM 462 O ALA A 111 42.332 -28.204 -10.361 1.00 0.00 O ATOM 463 CB ALA A 111 44.101 -28.510 -12.493 1.00 0.00 C ATOM 0 H ALA A 111 44.638 -30.385 -10.509 1.00 0.00 H new ATOM 0 HA ALA A 111 45.375 -27.553 -11.044 1.00 0.00 H new ATOM 0 HB1 ALA A 111 43.626 -27.580 -12.807 1.00 0.00 H new ATOM 0 HB2 ALA A 111 44.927 -28.740 -13.165 1.00 0.00 H new ATOM 0 HB3 ALA A 111 43.371 -29.319 -12.525 1.00 0.00 H new ATOM 469 N PRO A 112 43.847 -27.388 -8.953 1.00 0.00 N ATOM 470 CA PRO A 112 42.845 -26.968 -7.932 1.00 0.00 C ATOM 471 C PRO A 112 42.228 -25.608 -8.253 1.00 0.00 C ATOM 472 O PRO A 112 42.937 -24.611 -8.394 1.00 0.00 O ATOM 473 CB PRO A 112 43.666 -26.921 -6.636 1.00 0.00 C ATOM 474 CG PRO A 112 45.062 -26.576 -7.066 1.00 0.00 C ATOM 475 CD PRO A 112 45.221 -27.058 -8.524 1.00 0.00 C ATOM 0 HA PRO A 112 41.993 -27.646 -7.878 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.271 -26.175 -5.946 1.00 0.00 H new ATOM 0 HB3 PRO A 112 43.639 -27.880 -6.118 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.232 -25.502 -6.995 1.00 0.00 H new ATOM 0 HG3 PRO A 112 45.795 -27.058 -6.419 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.659 -26.283 -9.153 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.876 -27.927 -8.586 1.00 0.00 H new ATOM 483 N THR A 113 40.901 -25.579 -8.370 1.00 0.00 N ATOM 484 CA THR A 113 40.181 -24.347 -8.672 1.00 0.00 C ATOM 485 C THR A 113 39.538 -23.801 -7.414 1.00 0.00 C ATOM 486 O THR A 113 39.462 -24.490 -6.395 1.00 0.00 O ATOM 487 CB THR A 113 39.106 -24.612 -9.734 1.00 0.00 C ATOM 488 OG1 THR A 113 38.153 -25.531 -9.220 1.00 0.00 O ATOM 489 CG2 THR A 113 39.754 -25.193 -10.991 1.00 0.00 C ATOM 0 H THR A 113 40.303 -26.398 -8.260 1.00 0.00 H new ATOM 0 HA THR A 113 40.887 -23.612 -9.058 1.00 0.00 H new ATOM 0 HB THR A 113 38.609 -23.676 -9.988 1.00 0.00 H new ATOM 0 HG1 THR A 113 38.492 -25.923 -8.388 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.987 -25.380 -11.743 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.483 -24.485 -11.385 1.00 0.00 H new ATOM 0 HG23 THR A 113 40.254 -26.129 -10.743 1.00 0.00 H new ATOM 497 N PHE A 114 39.076 -22.560 -7.488 1.00 0.00 N ATOM 498 CA PHE A 114 38.436 -21.918 -6.342 1.00 0.00 C ATOM 499 C PHE A 114 37.112 -21.288 -6.765 1.00 0.00 C ATOM 500 O PHE A 114 36.989 -20.766 -7.874 1.00 0.00 O ATOM 501 CB PHE A 114 39.368 -20.838 -5.773 1.00 0.00 C ATOM 502 CG PHE A 114 40.801 -21.235 -6.033 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.390 -22.272 -5.303 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.541 -20.563 -7.011 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.719 -22.634 -5.549 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.863 -20.923 -7.254 1.00 0.00 C ATOM 507 CZ PHE A 114 43.456 -21.957 -6.524 1.00 0.00 C ATOM 0 H PHE A 114 39.131 -21.978 -8.324 1.00 0.00 H new ATOM 0 HA PHE A 114 38.240 -22.668 -5.576 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.155 -19.875 -6.237 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.199 -20.721 -4.703 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.819 -22.794 -4.549 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.086 -19.764 -7.578 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.174 -23.435 -4.986 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.433 -20.402 -8.009 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.483 -22.232 -6.713 1.00 0.00 H new ATOM 517 N THR A 115 36.129 -21.331 -5.871 1.00 0.00 N ATOM 518 CA THR A 115 34.817 -20.751 -6.150 1.00 0.00 C ATOM 519 C THR A 115 34.469 -19.733 -5.076 1.00 0.00 C ATOM 520 O THR A 115 34.397 -20.068 -3.894 1.00 0.00 O ATOM 521 CB THR A 115 33.755 -21.850 -6.166 1.00 0.00 C ATOM 522 OG1 THR A 115 34.136 -22.858 -7.090 1.00 0.00 O ATOM 523 CG2 THR A 115 32.412 -21.253 -6.587 1.00 0.00 C ATOM 0 H THR A 115 36.214 -21.760 -4.949 1.00 0.00 H new ATOM 0 HA THR A 115 34.846 -20.261 -7.123 1.00 0.00 H new ATOM 0 HB THR A 115 33.663 -22.284 -5.170 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.335 -23.298 -7.443 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.654 -22.036 -6.599 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.121 -20.477 -5.879 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.502 -20.820 -7.583 1.00 0.00 H new ATOM 531 N SER A 116 34.256 -18.486 -5.486 1.00 0.00 N ATOM 532 CA SER A 116 33.920 -17.431 -4.540 1.00 0.00 C ATOM 533 C SER A 116 32.408 -17.255 -4.462 1.00 0.00 C ATOM 534 O SER A 116 31.754 -16.980 -5.468 1.00 0.00 O ATOM 535 CB SER A 116 34.551 -16.111 -4.989 1.00 0.00 C ATOM 536 OG SER A 116 34.166 -15.073 -4.095 1.00 0.00 O ATOM 0 H SER A 116 34.310 -18.185 -6.459 1.00 0.00 H new ATOM 0 HA SER A 116 34.304 -17.710 -3.559 1.00 0.00 H new ATOM 0 HB2 SER A 116 35.637 -16.203 -5.010 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.232 -15.869 -6.003 1.00 0.00 H new ATOM 0 HG SER A 116 33.338 -14.657 -4.414 1.00 0.00 H new ATOM 542 N THR A 117 31.856 -17.420 -3.261 1.00 0.00 N ATOM 543 CA THR A 117 30.415 -17.281 -3.050 1.00 0.00 C ATOM 544 C THR A 117 30.137 -16.104 -2.125 1.00 0.00 C ATOM 545 O THR A 117 30.733 -15.988 -1.054 1.00 0.00 O ATOM 546 CB THR A 117 29.857 -18.563 -2.427 1.00 0.00 C ATOM 547 OG1 THR A 117 30.033 -19.643 -3.331 1.00 0.00 O ATOM 548 CG2 THR A 117 28.369 -18.382 -2.131 1.00 0.00 C ATOM 0 H THR A 117 32.384 -17.650 -2.419 1.00 0.00 H new ATOM 0 HA THR A 117 29.932 -17.105 -4.011 1.00 0.00 H new ATOM 0 HB THR A 117 30.387 -18.776 -1.499 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.678 -20.465 -2.932 1.00 0.00 H new ATOM 0 HG21 THR A 117 27.973 -19.295 -1.687 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.234 -17.553 -1.436 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.837 -18.168 -3.058 1.00 0.00 H new ATOM 556 N VAL A 118 29.225 -15.229 -2.548 1.00 0.00 N ATOM 557 CA VAL A 118 28.866 -14.049 -1.759 1.00 0.00 C ATOM 558 C VAL A 118 27.425 -14.155 -1.283 1.00 0.00 C ATOM 559 O VAL A 118 26.567 -14.697 -1.981 1.00 0.00 O ATOM 560 CB VAL A 118 29.031 -12.784 -2.603 1.00 0.00 C ATOM 561 CG1 VAL A 118 28.025 -12.800 -3.755 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.785 -11.556 -1.723 1.00 0.00 C ATOM 0 H VAL A 118 28.722 -15.314 -3.431 1.00 0.00 H new ATOM 0 HA VAL A 118 29.527 -13.995 -0.894 1.00 0.00 H new ATOM 0 HB VAL A 118 30.041 -12.746 -3.010 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.144 -11.898 -4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.200 -13.676 -4.379 1.00 0.00 H new ATOM 0 HG13 VAL A 118 27.012 -12.837 -3.353 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.901 -10.651 -2.320 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.774 -11.596 -1.318 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.504 -11.545 -0.904 1.00 0.00 H new ATOM 572 N GLU A 119 27.163 -13.633 -0.086 1.00 0.00 N ATOM 573 CA GLU A 119 25.818 -13.669 0.488 1.00 0.00 C ATOM 574 C GLU A 119 25.381 -12.276 0.914 1.00 0.00 C ATOM 575 O GLU A 119 26.128 -11.555 1.571 1.00 0.00 O ATOM 576 CB GLU A 119 25.793 -14.607 1.695 1.00 0.00 C ATOM 577 CG GLU A 119 24.356 -14.749 2.204 1.00 0.00 C ATOM 578 CD GLU A 119 24.315 -15.709 3.387 1.00 0.00 C ATOM 579 OE1 GLU A 119 24.483 -15.249 4.505 1.00 0.00 O1- ATOM 580 OE2 GLU A 119 24.116 -16.891 3.159 1.00 0.00 O ATOM 0 H GLU A 119 27.862 -13.181 0.504 1.00 0.00 H new ATOM 0 HA GLU A 119 25.127 -14.036 -0.271 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.190 -15.584 1.418 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.433 -14.216 2.486 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.969 -13.775 2.502 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.713 -15.116 1.404 1.00 0.00 H new ATOM 587 N PHE A 120 24.159 -11.914 0.548 1.00 0.00 N ATOM 588 CA PHE A 120 23.625 -10.608 0.915 1.00 0.00 C ATOM 589 C PHE A 120 22.114 -10.561 0.680 1.00 0.00 C ATOM 590 O PHE A 120 21.578 -11.348 -0.095 1.00 0.00 O ATOM 591 CB PHE A 120 24.305 -9.512 0.098 1.00 0.00 C ATOM 592 CG PHE A 120 23.919 -9.650 -1.352 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.775 -9.004 -1.829 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.705 -10.416 -2.216 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.414 -9.127 -3.175 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.346 -10.541 -3.561 1.00 0.00 C ATOM 597 CZ PHE A 120 23.200 -9.894 -4.041 1.00 0.00 C ATOM 0 H PHE A 120 23.524 -12.498 0.003 1.00 0.00 H new ATOM 0 HA PHE A 120 23.823 -10.442 1.974 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.011 -8.531 0.471 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.387 -9.583 0.205 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.170 -8.411 -1.159 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.590 -10.912 -1.845 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.529 -8.630 -3.545 1.00 0.00 H new ATOM 0 HE2 PHE A 120 24.951 -11.136 -4.229 1.00 0.00 H new ATOM 0 HZ PHE A 120 22.923 -9.988 -5.081 1.00 0.00 H new ATOM 607 N ALA A 121 21.434 -9.623 1.334 1.00 0.00 N ATOM 608 CA ALA A 121 19.988 -9.487 1.168 1.00 0.00 C ATOM 609 C ALA A 121 19.287 -10.820 1.417 1.00 0.00 C ATOM 610 O ALA A 121 18.146 -11.019 0.996 1.00 0.00 O ATOM 611 CB ALA A 121 19.664 -8.999 -0.247 1.00 0.00 C ATOM 0 H ALA A 121 21.854 -8.952 1.977 1.00 0.00 H new ATOM 0 HA ALA A 121 19.630 -8.759 1.896 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.584 -8.901 -0.360 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.136 -8.031 -0.415 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.041 -9.717 -0.975 1.00 0.00 H new ATOM 617 N GLY A 122 19.973 -11.727 2.101 1.00 0.00 N ATOM 618 CA GLY A 122 19.402 -13.037 2.404 1.00 0.00 C ATOM 619 C GLY A 122 19.447 -13.955 1.186 1.00 0.00 C ATOM 620 O GLY A 122 18.699 -14.930 1.100 1.00 0.00 O ATOM 0 H GLY A 122 20.919 -11.583 2.455 1.00 0.00 H new ATOM 0 HA2 GLY A 122 19.951 -13.494 3.227 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.370 -12.919 2.735 1.00 0.00 H new ATOM 624 N LYS A 123 20.336 -13.636 0.250 1.00 0.00 N ATOM 625 CA LYS A 123 20.498 -14.425 -0.971 1.00 0.00 C ATOM 626 C LYS A 123 21.971 -14.722 -1.213 1.00 0.00 C ATOM 627 O LYS A 123 22.843 -13.957 -0.800 1.00 0.00 O ATOM 628 CB LYS A 123 19.922 -13.666 -2.167 1.00 0.00 C ATOM 629 CG LYS A 123 18.400 -13.631 -2.057 1.00 0.00 C ATOM 630 CD LYS A 123 17.819 -12.876 -3.254 1.00 0.00 C ATOM 631 CE LYS A 123 16.294 -12.858 -3.151 1.00 0.00 C ATOM 632 NZ LYS A 123 15.728 -12.113 -4.311 1.00 0.00 N1+ ATOM 0 H LYS A 123 20.960 -12.832 0.313 1.00 0.00 H new ATOM 0 HA LYS A 123 19.960 -15.366 -0.852 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.320 -12.651 -2.194 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.220 -14.150 -3.097 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.004 -14.646 -2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.103 -13.145 -1.128 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.205 -11.857 -3.277 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.126 -13.355 -4.184 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.908 -13.877 -3.136 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.987 -12.387 -2.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.690 -12.100 -4.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.088 -11.137 -4.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.010 -12.581 -5.196 1.00 0.00 H new ATOM 646 N VAL A 124 22.242 -15.847 -1.877 1.00 0.00 N ATOM 647 CA VAL A 124 23.616 -16.256 -2.166 1.00 0.00 C ATOM 648 C VAL A 124 23.831 -16.394 -3.670 1.00 0.00 C ATOM 649 O VAL A 124 23.077 -17.080 -4.360 1.00 0.00 O ATOM 650 CB VAL A 124 23.909 -17.603 -1.492 1.00 0.00 C ATOM 651 CG1 VAL A 124 22.877 -18.644 -1.940 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.312 -18.078 -1.881 1.00 0.00 C ATOM 0 H VAL A 124 21.529 -16.489 -2.224 1.00 0.00 H new ATOM 0 HA VAL A 124 24.290 -15.492 -1.779 1.00 0.00 H new ATOM 0 HB VAL A 124 23.852 -17.481 -0.410 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.090 -19.598 -1.458 1.00 0.00 H new ATOM 0 HG12 VAL A 124 21.878 -18.311 -1.659 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.928 -18.764 -3.022 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.518 -19.035 -1.401 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.370 -18.195 -2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.048 -17.343 -1.556 1.00 0.00 H new ATOM 662 N PHE A 125 24.871 -15.730 -4.169 1.00 0.00 N ATOM 663 CA PHE A 125 25.208 -15.765 -5.592 1.00 0.00 C ATOM 664 C PHE A 125 26.487 -16.565 -5.796 1.00 0.00 C ATOM 665 O PHE A 125 27.319 -16.668 -4.889 1.00 0.00 O ATOM 666 CB PHE A 125 25.390 -14.340 -6.121 1.00 0.00 C ATOM 667 CG PHE A 125 24.070 -13.609 -6.041 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.564 -13.232 -4.793 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.352 -13.308 -7.206 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.343 -12.557 -4.707 1.00 0.00 C ATOM 671 CE2 PHE A 125 22.131 -12.632 -7.118 1.00 0.00 C ATOM 672 CZ PHE A 125 21.624 -12.258 -5.869 1.00 0.00 C ATOM 0 H PHE A 125 25.499 -15.157 -3.605 1.00 0.00 H new ATOM 0 HA PHE A 125 24.397 -16.243 -6.141 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.146 -13.816 -5.536 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.744 -14.364 -7.152 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.117 -13.463 -3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.741 -13.598 -8.171 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.954 -12.266 -3.742 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.578 -12.398 -8.016 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.679 -11.739 -5.802 1.00 0.00 H new ATOM 682 N SER A 126 26.642 -17.128 -6.992 1.00 0.00 N ATOM 683 CA SER A 126 27.826 -17.924 -7.320 1.00 0.00 C ATOM 684 C SER A 126 28.603 -17.284 -8.464 1.00 0.00 C ATOM 685 O SER A 126 28.028 -16.899 -9.480 1.00 0.00 O ATOM 686 CB SER A 126 27.398 -19.335 -7.723 1.00 0.00 C ATOM 687 OG SER A 126 26.428 -19.251 -8.760 1.00 0.00 O ATOM 0 H SER A 126 25.964 -17.049 -7.750 1.00 0.00 H new ATOM 0 HA SER A 126 28.470 -17.969 -6.441 1.00 0.00 H new ATOM 0 HB2 SER A 126 28.262 -19.907 -8.062 1.00 0.00 H new ATOM 0 HB3 SER A 126 26.984 -19.862 -6.863 1.00 0.00 H new ATOM 0 HG SER A 126 26.707 -18.577 -9.415 1.00 0.00 H new ATOM 693 N GLY A 127 29.917 -17.182 -8.288 1.00 0.00 N ATOM 694 CA GLY A 127 30.777 -16.596 -9.308 1.00 0.00 C ATOM 695 C GLY A 127 31.148 -17.633 -10.356 1.00 0.00 C ATOM 696 O GLY A 127 30.580 -18.726 -10.390 1.00 0.00 O ATOM 0 H GLY A 127 30.407 -17.497 -7.451 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.268 -15.757 -9.783 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.681 -16.199 -8.845 1.00 0.00 H new ATOM 700 N GLU A 128 32.096 -17.284 -11.225 1.00 0.00 N ATOM 701 CA GLU A 128 32.526 -18.191 -12.284 1.00 0.00 C ATOM 702 C GLU A 128 33.753 -18.995 -11.853 1.00 0.00 C ATOM 703 O GLU A 128 34.749 -18.426 -11.409 1.00 0.00 O ATOM 704 CB GLU A 128 32.841 -17.396 -13.567 1.00 0.00 C ATOM 705 CG GLU A 128 34.259 -16.817 -13.507 1.00 0.00 C ATOM 706 CD GLU A 128 34.429 -15.734 -14.571 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.492 -14.981 -14.779 1.00 0.00 O ATOM 708 OE2 GLU A 128 35.493 -15.678 -15.165 1.00 0.00 O1- ATOM 0 H GLU A 128 32.577 -16.385 -11.216 1.00 0.00 H new ATOM 0 HA GLU A 128 31.713 -18.889 -12.484 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.744 -18.045 -14.437 1.00 0.00 H new ATOM 0 HB3 GLU A 128 32.118 -16.590 -13.689 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.448 -16.399 -12.518 1.00 0.00 H new ATOM 0 HG3 GLU A 128 34.991 -17.610 -13.663 1.00 0.00 H new ATOM 715 N GLU A 129 33.684 -20.313 -11.980 1.00 0.00 N ATOM 716 CA GLU A 129 34.810 -21.151 -11.596 1.00 0.00 C ATOM 717 C GLU A 129 36.079 -20.685 -12.303 1.00 0.00 C ATOM 718 O GLU A 129 36.040 -20.259 -13.457 1.00 0.00 O ATOM 719 CB GLU A 129 34.519 -22.606 -11.963 1.00 0.00 C ATOM 720 CG GLU A 129 33.299 -23.094 -11.182 1.00 0.00 C ATOM 721 CD GLU A 129 33.603 -23.114 -9.688 1.00 0.00 C ATOM 722 OE1 GLU A 129 34.774 -23.115 -9.345 1.00 0.00 O ATOM 723 OE2 GLU A 129 32.663 -23.130 -8.912 1.00 0.00 O1- ATOM 0 H GLU A 129 32.874 -20.818 -12.340 1.00 0.00 H new ATOM 0 HA GLU A 129 34.957 -21.072 -10.519 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.337 -22.693 -13.034 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.383 -23.230 -11.735 1.00 0.00 H new ATOM 0 HG2 GLU A 129 32.448 -22.442 -11.379 1.00 0.00 H new ATOM 0 HG3 GLU A 129 33.019 -24.093 -11.517 1.00 0.00 H new ATOM 730 N ALA A 130 37.203 -20.771 -11.599 1.00 0.00 N ATOM 731 CA ALA A 130 38.483 -20.358 -12.161 1.00 0.00 C ATOM 732 C ALA A 130 39.635 -20.791 -11.259 1.00 0.00 C ATOM 733 O ALA A 130 39.436 -21.083 -10.080 1.00 0.00 O ATOM 734 CB ALA A 130 38.516 -18.840 -12.345 1.00 0.00 C ATOM 0 H ALA A 130 37.253 -21.121 -10.642 1.00 0.00 H new ATOM 0 HA ALA A 130 38.598 -20.840 -13.132 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.478 -18.545 -12.765 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.716 -18.538 -13.021 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.378 -18.353 -11.380 1.00 0.00 H new ATOM 740 N LYS A 131 40.839 -20.817 -11.824 1.00 0.00 N ATOM 741 CA LYS A 131 42.033 -21.205 -11.076 1.00 0.00 C ATOM 742 C LYS A 131 42.653 -19.992 -10.400 1.00 0.00 C ATOM 743 O LYS A 131 43.873 -19.903 -10.257 1.00 0.00 O ATOM 744 CB LYS A 131 43.058 -21.857 -12.004 1.00 0.00 C ATOM 745 CG LYS A 131 43.463 -20.871 -13.098 1.00 0.00 C ATOM 746 CD LYS A 131 44.426 -21.558 -14.065 1.00 0.00 C ATOM 747 CE LYS A 131 44.805 -20.578 -15.176 1.00 0.00 C ATOM 748 NZ LYS A 131 45.472 -19.387 -14.579 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.015 -20.574 -12.799 1.00 0.00 H new ATOM 0 HA LYS A 131 41.738 -21.925 -10.313 1.00 0.00 H new ATOM 0 HB2 LYS A 131 43.935 -22.163 -11.434 1.00 0.00 H new ATOM 0 HB3 LYS A 131 42.637 -22.758 -12.451 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.580 -20.521 -13.633 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.937 -19.994 -12.656 1.00 0.00 H new ATOM 0 HD2 LYS A 131 45.319 -21.889 -13.535 1.00 0.00 H new ATOM 0 HD3 LYS A 131 43.961 -22.447 -14.491 1.00 0.00 H new ATOM 0 HE2 LYS A 131 45.471 -21.061 -15.891 1.00 0.00 H new ATOM 0 HE3 LYS A 131 43.915 -20.273 -15.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 46.049 -18.913 -15.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.751 -18.727 -14.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 46.082 -19.689 -13.793 1.00 0.00 H new ATOM 762 N THR A 132 41.805 -19.064 -9.977 1.00 0.00 N ATOM 763 CA THR A 132 42.280 -17.859 -9.303 1.00 0.00 C ATOM 764 C THR A 132 41.192 -17.286 -8.394 1.00 0.00 C ATOM 765 O THR A 132 40.001 -17.394 -8.688 1.00 0.00 O ATOM 766 CB THR A 132 42.686 -16.813 -10.339 1.00 0.00 C ATOM 767 OG1 THR A 132 43.046 -15.607 -9.678 1.00 0.00 O ATOM 768 CG2 THR A 132 41.512 -16.550 -11.275 1.00 0.00 C ATOM 0 H THR A 132 40.792 -19.119 -10.086 1.00 0.00 H new ATOM 0 HA THR A 132 43.144 -18.122 -8.692 1.00 0.00 H new ATOM 0 HB THR A 132 43.537 -17.178 -10.914 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.308 -14.936 -10.342 1.00 0.00 H new ATOM 0 HG21 THR A 132 41.798 -15.804 -12.016 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.235 -17.475 -11.780 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.663 -16.183 -10.699 1.00 0.00 H new ATOM 776 N LYS A 133 41.616 -16.673 -7.294 1.00 0.00 N ATOM 777 CA LYS A 133 40.678 -16.076 -6.347 1.00 0.00 C ATOM 778 C LYS A 133 40.204 -14.713 -6.838 1.00 0.00 C ATOM 779 O LYS A 133 39.071 -14.310 -6.579 1.00 0.00 O ATOM 780 CB LYS A 133 41.341 -15.922 -4.977 1.00 0.00 C ATOM 781 CG LYS A 133 41.651 -17.307 -4.409 1.00 0.00 C ATOM 782 CD LYS A 133 42.325 -17.160 -3.045 1.00 0.00 C ATOM 783 CE LYS A 133 42.659 -18.546 -2.487 1.00 0.00 C ATOM 784 NZ LYS A 133 43.338 -18.400 -1.167 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.598 -16.576 -7.036 1.00 0.00 H new ATOM 0 HA LYS A 133 39.815 -16.737 -6.262 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.258 -15.339 -5.067 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.682 -15.378 -4.300 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.732 -17.886 -4.312 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.302 -17.854 -5.091 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.234 -16.566 -3.139 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.667 -16.629 -2.358 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.748 -19.134 -2.376 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.304 -19.084 -3.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.565 -19.341 -0.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 44.215 -17.854 -1.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.708 -17.903 -0.506 1.00 0.00 H new ATOM 798 N LYS A 134 41.088 -13.995 -7.527 1.00 0.00 N ATOM 799 CA LYS A 134 40.747 -12.665 -8.022 1.00 0.00 C ATOM 800 C LYS A 134 39.554 -12.723 -8.970 1.00 0.00 C ATOM 801 O LYS A 134 38.559 -12.031 -8.765 1.00 0.00 O ATOM 802 CB LYS A 134 41.947 -12.061 -8.754 1.00 0.00 C ATOM 803 CG LYS A 134 43.056 -11.750 -7.748 1.00 0.00 C ATOM 804 CD LYS A 134 44.251 -11.134 -8.479 1.00 0.00 C ATOM 805 CE LYS A 134 45.331 -10.757 -7.464 1.00 0.00 C ATOM 806 NZ LYS A 134 45.794 -11.983 -6.754 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.033 -14.307 -7.753 1.00 0.00 H new ATOM 0 HA LYS A 134 40.482 -12.042 -7.167 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.312 -12.756 -9.510 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.648 -11.151 -9.275 1.00 0.00 H new ATOM 0 HG2 LYS A 134 42.688 -11.062 -6.986 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.361 -12.661 -7.234 1.00 0.00 H new ATOM 0 HD2 LYS A 134 44.651 -11.842 -9.205 1.00 0.00 H new ATOM 0 HD3 LYS A 134 43.935 -10.251 -9.035 1.00 0.00 H new ATOM 0 HE2 LYS A 134 46.169 -10.278 -7.970 1.00 0.00 H new ATOM 0 HE3 LYS A 134 44.937 -10.036 -6.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 46.719 -11.801 -6.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 45.105 -12.239 -6.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 45.881 -12.766 -7.433 1.00 0.00 H new ATOM 820 N LEU A 135 39.649 -13.548 -10.005 1.00 0.00 N ATOM 821 CA LEU A 135 38.562 -13.672 -10.961 1.00 0.00 C ATOM 822 C LEU A 135 37.326 -14.258 -10.287 1.00 0.00 C ATOM 823 O LEU A 135 36.199 -13.854 -10.572 1.00 0.00 O ATOM 824 CB LEU A 135 38.989 -14.576 -12.132 1.00 0.00 C ATOM 825 CG LEU A 135 38.209 -14.198 -13.406 1.00 0.00 C ATOM 826 CD1 LEU A 135 38.922 -13.033 -14.111 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.135 -15.407 -14.350 1.00 0.00 C ATOM 0 H LEU A 135 40.460 -14.135 -10.201 1.00 0.00 H new ATOM 0 HA LEU A 135 38.321 -12.679 -11.341 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.060 -14.474 -12.308 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.805 -15.621 -11.881 1.00 0.00 H new ATOM 0 HG LEU A 135 37.197 -13.897 -13.135 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.373 -12.763 -15.013 1.00 0.00 H new ATOM 0 HD12 LEU A 135 38.965 -12.174 -13.441 1.00 0.00 H new ATOM 0 HD13 LEU A 135 39.934 -13.335 -14.379 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.582 -15.134 -15.249 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.143 -15.717 -14.624 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.627 -16.230 -13.848 1.00 0.00 H new ATOM 839 N ALA A 136 37.548 -15.219 -9.400 1.00 0.00 N ATOM 840 CA ALA A 136 36.446 -15.863 -8.702 1.00 0.00 C ATOM 841 C ALA A 136 35.611 -14.833 -7.956 1.00 0.00 C ATOM 842 O ALA A 136 34.395 -14.761 -8.136 1.00 0.00 O ATOM 843 CB ALA A 136 36.996 -16.885 -7.710 1.00 0.00 C ATOM 0 H ALA A 136 38.473 -15.567 -9.149 1.00 0.00 H new ATOM 0 HA ALA A 136 35.814 -16.363 -9.436 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.169 -17.367 -7.188 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.574 -17.638 -8.246 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.638 -16.381 -6.987 1.00 0.00 H new ATOM 849 N GLU A 137 36.262 -14.049 -7.105 1.00 0.00 N ATOM 850 CA GLU A 137 35.563 -13.038 -6.323 1.00 0.00 C ATOM 851 C GLU A 137 34.958 -11.974 -7.234 1.00 0.00 C ATOM 852 O GLU A 137 33.836 -11.520 -7.012 1.00 0.00 O ATOM 853 CB GLU A 137 36.543 -12.381 -5.352 1.00 0.00 C ATOM 854 CG GLU A 137 37.014 -13.414 -4.324 1.00 0.00 C ATOM 855 CD GLU A 137 38.044 -12.784 -3.392 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.360 -11.622 -3.590 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.501 -13.471 -2.493 1.00 0.00 O1- ATOM 0 H GLU A 137 37.268 -14.094 -6.940 1.00 0.00 H new ATOM 0 HA GLU A 137 34.757 -13.520 -5.769 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.397 -11.979 -5.897 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.064 -11.542 -4.847 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.164 -13.780 -3.747 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.449 -14.274 -4.833 1.00 0.00 H new ATOM 864 N MET A 138 35.709 -11.576 -8.254 1.00 0.00 N ATOM 865 CA MET A 138 35.232 -10.561 -9.186 1.00 0.00 C ATOM 866 C MET A 138 33.984 -11.056 -9.911 1.00 0.00 C ATOM 867 O MET A 138 33.026 -10.305 -10.100 1.00 0.00 O ATOM 868 CB MET A 138 36.329 -10.231 -10.204 1.00 0.00 C ATOM 869 CG MET A 138 37.402 -9.358 -9.550 1.00 0.00 C ATOM 870 SD MET A 138 38.782 -9.131 -10.703 1.00 0.00 S ATOM 871 CE MET A 138 37.905 -8.136 -11.935 1.00 0.00 C ATOM 0 H MET A 138 36.642 -11.936 -8.456 1.00 0.00 H new ATOM 0 HA MET A 138 34.980 -9.660 -8.626 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.776 -11.151 -10.581 1.00 0.00 H new ATOM 0 HB3 MET A 138 35.898 -9.712 -11.060 1.00 0.00 H new ATOM 0 HG2 MET A 138 36.981 -8.391 -9.275 1.00 0.00 H new ATOM 0 HG3 MET A 138 37.755 -9.825 -8.631 1.00 0.00 H new ATOM 0 HE1 MET A 138 38.528 -7.292 -12.231 1.00 0.00 H new ATOM 0 HE2 MET A 138 37.685 -8.749 -12.809 1.00 0.00 H new ATOM 0 HE3 MET A 138 36.973 -7.767 -11.508 1.00 0.00 H new ATOM 881 N SER A 139 33.997 -12.324 -10.306 1.00 0.00 N ATOM 882 CA SER A 139 32.857 -12.915 -10.997 1.00 0.00 C ATOM 883 C SER A 139 31.652 -13.006 -10.069 1.00 0.00 C ATOM 884 O SER A 139 30.516 -12.807 -10.497 1.00 0.00 O ATOM 885 CB SER A 139 33.233 -14.305 -11.523 1.00 0.00 C ATOM 886 OG SER A 139 34.261 -14.145 -12.489 1.00 0.00 O ATOM 0 H SER A 139 34.781 -12.960 -10.160 1.00 0.00 H new ATOM 0 HA SER A 139 32.588 -12.277 -11.839 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.573 -14.942 -10.707 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.365 -14.792 -11.967 1.00 0.00 H new ATOM 0 HG SER A 139 35.122 -14.030 -12.035 1.00 0.00 H new ATOM 892 N ALA A 140 31.906 -13.294 -8.794 1.00 0.00 N ATOM 893 CA ALA A 140 30.829 -13.397 -7.813 1.00 0.00 C ATOM 894 C ALA A 140 30.149 -12.046 -7.617 1.00 0.00 C ATOM 895 O ALA A 140 28.922 -11.953 -7.589 1.00 0.00 O ATOM 896 CB ALA A 140 31.397 -13.890 -6.480 1.00 0.00 C ATOM 0 H ALA A 140 32.840 -13.459 -8.419 1.00 0.00 H new ATOM 0 HA ALA A 140 30.087 -14.107 -8.180 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.593 -13.967 -5.748 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.855 -14.869 -6.620 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.148 -13.186 -6.122 1.00 0.00 H new ATOM 902 N ALA A 141 30.949 -11.001 -7.472 1.00 0.00 N ATOM 903 CA ALA A 141 30.409 -9.665 -7.282 1.00 0.00 C ATOM 904 C ALA A 141 29.805 -9.145 -8.583 1.00 0.00 C ATOM 905 O ALA A 141 28.928 -8.280 -8.570 1.00 0.00 O ATOM 906 CB ALA A 141 31.507 -8.712 -6.811 1.00 0.00 C ATOM 0 H ALA A 141 31.968 -11.052 -7.482 1.00 0.00 H new ATOM 0 HA ALA A 141 29.629 -9.716 -6.523 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.089 -7.715 -6.673 1.00 0.00 H new ATOM 0 HB2 ALA A 141 31.917 -9.068 -5.866 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.300 -8.672 -7.558 1.00 0.00 H new ATOM 912 N LYS A 142 30.278 -9.682 -9.706 1.00 0.00 N ATOM 913 CA LYS A 142 29.777 -9.272 -11.014 1.00 0.00 C ATOM 914 C LYS A 142 28.345 -9.758 -11.230 1.00 0.00 C ATOM 915 O LYS A 142 27.470 -8.993 -11.637 1.00 0.00 O ATOM 916 CB LYS A 142 30.679 -9.841 -12.109 1.00 0.00 C ATOM 917 CG LYS A 142 30.242 -9.288 -13.466 1.00 0.00 C ATOM 918 CD LYS A 142 31.186 -9.801 -14.553 1.00 0.00 C ATOM 919 CE LYS A 142 30.757 -9.232 -15.907 1.00 0.00 C ATOM 920 NZ LYS A 142 31.684 -9.720 -16.967 1.00 0.00 N1+ ATOM 0 H LYS A 142 31.004 -10.398 -9.736 1.00 0.00 H new ATOM 0 HA LYS A 142 29.782 -8.183 -11.057 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.718 -9.576 -11.914 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.623 -10.930 -12.112 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.219 -9.595 -13.683 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.251 -8.198 -13.446 1.00 0.00 H new ATOM 0 HD2 LYS A 142 32.211 -9.505 -14.330 1.00 0.00 H new ATOM 0 HD3 LYS A 142 31.168 -10.890 -14.582 1.00 0.00 H new ATOM 0 HE2 LYS A 142 29.735 -9.536 -16.134 1.00 0.00 H new ATOM 0 HE3 LYS A 142 30.765 -8.143 -15.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 31.393 -9.334 -17.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 32.653 -9.409 -16.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 31.654 -10.759 -17.003 1.00 0.00 H new ATOM 934 N VAL A 143 28.123 -11.040 -10.954 1.00 0.00 N ATOM 935 CA VAL A 143 26.800 -11.633 -11.118 1.00 0.00 C ATOM 936 C VAL A 143 25.823 -11.061 -10.098 1.00 0.00 C ATOM 937 O VAL A 143 24.650 -10.844 -10.404 1.00 0.00 O ATOM 938 CB VAL A 143 26.872 -13.157 -10.981 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.452 -13.526 -9.618 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.465 -13.751 -11.109 1.00 0.00 C ATOM 0 H VAL A 143 28.838 -11.685 -10.618 1.00 0.00 H new ATOM 0 HA VAL A 143 26.441 -11.388 -12.118 1.00 0.00 H new ATOM 0 HB VAL A 143 27.512 -13.557 -11.768 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.501 -14.611 -9.525 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.454 -13.108 -9.524 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.815 -13.123 -8.830 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.518 -14.835 -11.011 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.826 -13.346 -10.324 1.00 0.00 H new ATOM 0 HG23 VAL A 143 25.049 -13.494 -12.083 1.00 0.00 H new ATOM 950 N ALA A 144 26.306 -10.817 -8.884 1.00 0.00 N ATOM 951 CA ALA A 144 25.462 -10.271 -7.830 1.00 0.00 C ATOM 952 C ALA A 144 25.008 -8.857 -8.180 1.00 0.00 C ATOM 953 O ALA A 144 23.833 -8.521 -8.050 1.00 0.00 O ATOM 954 CB ALA A 144 26.245 -10.250 -6.515 1.00 0.00 C ATOM 0 H ALA A 144 27.273 -10.988 -8.608 1.00 0.00 H new ATOM 0 HA ALA A 144 24.578 -10.901 -7.725 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.616 -9.842 -5.724 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.544 -11.265 -6.254 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.133 -9.628 -6.630 1.00 0.00 H new ATOM 960 N PHE A 145 25.948 -8.036 -8.628 1.00 0.00 N ATOM 961 CA PHE A 145 25.641 -6.659 -8.996 1.00 0.00 C ATOM 962 C PHE A 145 24.625 -6.616 -10.125 1.00 0.00 C ATOM 963 O PHE A 145 23.711 -5.797 -10.116 1.00 0.00 O ATOM 964 CB PHE A 145 26.915 -5.925 -9.416 1.00 0.00 C ATOM 965 CG PHE A 145 26.570 -4.510 -9.819 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.436 -3.510 -8.844 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.380 -4.198 -11.170 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.109 -2.204 -9.226 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.056 -2.890 -11.548 1.00 0.00 C ATOM 970 CZ PHE A 145 25.922 -1.893 -10.576 1.00 0.00 C ATOM 0 H PHE A 145 26.927 -8.298 -8.745 1.00 0.00 H new ATOM 0 HA PHE A 145 25.214 -6.162 -8.125 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.631 -5.916 -8.594 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.391 -6.446 -10.247 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.585 -3.748 -7.801 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.483 -4.967 -11.921 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.001 -1.434 -8.476 1.00 0.00 H new ATOM 0 HE2 PHE A 145 25.909 -2.650 -12.591 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.674 -0.883 -10.868 1.00 0.00 H new ATOM 980 N MET A 146 24.795 -7.499 -11.096 1.00 0.00 N ATOM 981 CA MET A 146 23.894 -7.550 -12.239 1.00 0.00 C ATOM 982 C MET A 146 22.464 -7.847 -11.785 1.00 0.00 C ATOM 983 O MET A 146 21.506 -7.287 -12.316 1.00 0.00 O ATOM 984 CB MET A 146 24.361 -8.641 -13.206 1.00 0.00 C ATOM 985 CG MET A 146 25.581 -8.150 -13.992 1.00 0.00 C ATOM 986 SD MET A 146 25.080 -6.861 -15.164 1.00 0.00 S ATOM 987 CE MET A 146 24.490 -7.948 -16.490 1.00 0.00 C ATOM 0 H MET A 146 25.546 -8.189 -11.117 1.00 0.00 H new ATOM 0 HA MET A 146 23.906 -6.581 -12.739 1.00 0.00 H new ATOM 0 HB2 MET A 146 24.613 -9.546 -12.653 1.00 0.00 H new ATOM 0 HB3 MET A 146 23.555 -8.901 -13.892 1.00 0.00 H new ATOM 0 HG2 MET A 146 26.333 -7.759 -13.307 1.00 0.00 H new ATOM 0 HG3 MET A 146 26.039 -8.982 -14.527 1.00 0.00 H new ATOM 0 HE1 MET A 146 25.183 -7.907 -17.330 1.00 0.00 H new ATOM 0 HE2 MET A 146 24.428 -8.972 -16.121 1.00 0.00 H new ATOM 0 HE3 MET A 146 23.503 -7.620 -16.817 1.00 0.00 H new ATOM 997 N SER A 147 22.328 -8.721 -10.793 1.00 0.00 N ATOM 998 CA SER A 147 21.009 -9.064 -10.278 1.00 0.00 C ATOM 999 C SER A 147 20.403 -7.898 -9.498 1.00 0.00 C ATOM 1000 O SER A 147 19.204 -7.636 -9.596 1.00 0.00 O ATOM 1001 CB SER A 147 21.105 -10.287 -9.377 1.00 0.00 C ATOM 1002 OG SER A 147 22.048 -10.036 -8.347 1.00 0.00 O ATOM 0 H SER A 147 23.104 -9.199 -10.335 1.00 0.00 H new ATOM 0 HA SER A 147 20.361 -9.285 -11.126 1.00 0.00 H new ATOM 0 HB2 SER A 147 20.130 -10.513 -8.946 1.00 0.00 H new ATOM 0 HB3 SER A 147 21.407 -11.159 -9.958 1.00 0.00 H new ATOM 0 HG SER A 147 21.892 -10.654 -7.603 1.00 0.00 H new ATOM 1008 N ILE A 148 21.234 -7.206 -8.719 1.00 0.00 N ATOM 1009 CA ILE A 148 20.756 -6.075 -7.922 1.00 0.00 C ATOM 1010 C ILE A 148 20.132 -5.013 -8.818 1.00 0.00 C ATOM 1011 O ILE A 148 19.275 -4.245 -8.380 1.00 0.00 O ATOM 1012 CB ILE A 148 21.917 -5.460 -7.128 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.357 -6.442 -6.033 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.480 -4.135 -6.490 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.640 -5.940 -5.363 1.00 0.00 C ATOM 0 H ILE A 148 22.230 -7.405 -8.623 1.00 0.00 H new ATOM 0 HA ILE A 148 19.998 -6.441 -7.229 1.00 0.00 H new ATOM 0 HB ILE A 148 22.750 -5.265 -7.803 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.567 -6.549 -5.290 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.524 -7.429 -6.464 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.312 -3.709 -5.930 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.174 -3.439 -7.271 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.643 -4.315 -5.816 1.00 0.00 H new ATOM 0 HD11 ILE A 148 23.945 -6.643 -4.588 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.431 -5.857 -6.108 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.458 -4.963 -4.916 1.00 0.00 H new ATOM 1027 N LYS A 149 20.573 -4.962 -10.064 1.00 0.00 N ATOM 1028 CA LYS A 149 20.044 -3.970 -10.992 1.00 0.00 C ATOM 1029 C LYS A 149 18.534 -4.131 -11.146 1.00 0.00 C ATOM 1030 O LYS A 149 17.797 -3.146 -11.176 1.00 0.00 O ATOM 1031 CB LYS A 149 20.704 -4.115 -12.366 1.00 0.00 C ATOM 1032 CG LYS A 149 22.204 -3.820 -12.263 1.00 0.00 C ATOM 1033 CD LYS A 149 22.771 -3.498 -13.652 1.00 0.00 C ATOM 1034 CE LYS A 149 22.359 -4.583 -14.651 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.237 -4.503 -15.853 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.283 -5.582 -10.454 1.00 0.00 H new ATOM 0 HA LYS A 149 20.263 -2.982 -10.586 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.549 -5.124 -12.748 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.239 -3.431 -13.076 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.373 -2.980 -11.589 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.724 -4.679 -11.839 1.00 0.00 H new ATOM 0 HD2 LYS A 149 22.406 -2.527 -13.986 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.858 -3.431 -13.603 1.00 0.00 H new ATOM 0 HE2 LYS A 149 22.441 -5.568 -14.191 1.00 0.00 H new ATOM 0 HE3 LYS A 149 21.316 -4.452 -14.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 22.653 -4.542 -16.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 23.769 -3.609 -15.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.903 -5.302 -15.850 1.00 0.00 H new