USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=21 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 Set 1.1: A 103 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 116 SER OG : rot 100:sc= -0.993 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -129:sc= 1.03 (180deg=-0.973) USER MOD Single : A 85 ASN : amide:sc= -0.116 K(o=-0.12,f=-2.3!) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 160:sc= -0.0681 (180deg=-0.497) USER MOD Single : A 95 SER OG : rot -49:sc= 0.0355 USER MOD Single : A 96 SER OG : rot 180:sc= -0.466 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.476 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -30:sc= 0.518 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 113 THR OG1 : rot -21:sc= 0.558 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 163:sc= -0.0474 (180deg=-0.431) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0.224 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 74:sc= 0.188 USER MOD Single : A 142 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0385) USER MOD Single : A 146 MET CE :methyl 154:sc= -0.195 (180deg=-1.06) USER MOD Single : A 147 SER OG : rot -138:sc=-0.00237 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.835 -0.764 -6.456 1.00 0.00 N ATOM 17 CA ALA A 82 35.509 -2.038 -5.848 1.00 0.00 C ATOM 18 C ALA A 82 34.020 -2.107 -5.533 1.00 0.00 C ATOM 19 O ALA A 82 33.570 -1.640 -4.489 1.00 0.00 O ATOM 20 CB ALA A 82 36.312 -2.219 -4.561 1.00 0.00 C ATOM 0 HA ALA A 82 35.761 -2.834 -6.548 1.00 0.00 H new ATOM 0 HB1 ALA A 82 36.063 -3.179 -4.108 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.377 -2.192 -4.790 1.00 0.00 H new ATOM 0 HB3 ALA A 82 36.070 -1.416 -3.865 1.00 0.00 H new ATOM 26 N TYR A 83 33.267 -2.704 -6.436 1.00 0.00 N ATOM 27 CA TYR A 83 31.824 -2.847 -6.256 1.00 0.00 C ATOM 28 C TYR A 83 31.527 -3.356 -4.851 1.00 0.00 C ATOM 29 O TYR A 83 30.401 -3.268 -4.369 1.00 0.00 O ATOM 30 CB TYR A 83 31.254 -3.827 -7.291 1.00 0.00 C ATOM 31 CG TYR A 83 31.965 -3.638 -8.610 1.00 0.00 C ATOM 32 CD1 TYR A 83 32.122 -2.353 -9.145 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.467 -4.749 -9.303 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.780 -2.178 -10.366 1.00 0.00 C ATOM 35 CE2 TYR A 83 33.125 -4.572 -10.524 1.00 0.00 C ATOM 36 CZ TYR A 83 33.280 -3.286 -11.056 1.00 0.00 C ATOM 37 OH TYR A 83 33.929 -3.113 -12.261 1.00 0.00 O ATOM 0 H TYR A 83 33.625 -3.100 -7.305 1.00 0.00 H new ATOM 0 HA TYR A 83 31.355 -1.873 -6.395 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.378 -4.853 -6.943 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.184 -3.659 -7.415 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.734 -1.496 -8.614 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.345 -5.741 -8.894 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.902 -1.186 -10.776 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.514 -5.427 -11.057 1.00 0.00 H new ATOM 0 HH TYR A 83 34.215 -3.984 -12.607 1.00 0.00 H new ATOM 47 N LYS A 84 32.555 -3.884 -4.202 1.00 0.00 N ATOM 48 CA LYS A 84 32.397 -4.405 -2.844 1.00 0.00 C ATOM 49 C LYS A 84 32.019 -3.274 -1.892 1.00 0.00 C ATOM 50 O LYS A 84 31.155 -3.434 -1.028 1.00 0.00 O ATOM 51 CB LYS A 84 33.691 -5.067 -2.377 1.00 0.00 C ATOM 52 CG LYS A 84 33.972 -6.298 -3.243 1.00 0.00 C ATOM 53 CD LYS A 84 35.266 -6.965 -2.773 1.00 0.00 C ATOM 54 CE LYS A 84 35.610 -8.129 -3.705 1.00 0.00 C ATOM 55 NZ LYS A 84 34.580 -9.196 -3.568 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.497 -3.964 -4.584 1.00 0.00 H new ATOM 0 HA LYS A 84 31.602 -5.151 -2.846 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.519 -4.362 -2.447 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.607 -5.357 -1.330 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.142 -7.001 -3.175 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.059 -6.008 -4.290 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.079 -6.239 -2.765 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.151 -7.326 -1.751 1.00 0.00 H new ATOM 0 HE2 LYS A 84 35.654 -7.782 -4.737 1.00 0.00 H new ATOM 0 HE3 LYS A 84 36.595 -8.526 -3.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 35.047 -10.110 -3.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 33.954 -8.974 -2.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 34.018 -9.250 -4.442 1.00 0.00 H new ATOM 69 N ASN A 85 32.679 -2.134 -2.056 1.00 0.00 N ATOM 70 CA ASN A 85 32.404 -0.981 -1.196 1.00 0.00 C ATOM 71 C ASN A 85 30.967 -0.505 -1.383 1.00 0.00 C ATOM 72 O ASN A 85 30.263 -0.218 -0.414 1.00 0.00 O ATOM 73 CB ASN A 85 33.368 0.161 -1.523 1.00 0.00 C ATOM 74 CG ASN A 85 34.738 -0.118 -0.913 1.00 0.00 C ATOM 75 OD1 ASN A 85 34.858 -0.939 -0.003 1.00 0.00 O ATOM 76 ND2 ASN A 85 35.783 0.519 -1.361 1.00 0.00 N ATOM 0 H ASN A 85 33.398 -1.980 -2.763 1.00 0.00 H new ATOM 0 HA ASN A 85 32.543 -1.286 -0.159 1.00 0.00 H new ATOM 0 HB2 ASN A 85 33.458 0.273 -2.603 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.974 1.101 -1.137 1.00 0.00 H new ATOM 0 HD21 ASN A 85 36.702 0.338 -0.958 1.00 0.00 H new ATOM 0 HD22 ASN A 85 35.682 1.199 -2.115 1.00 0.00 H new ATOM 83 N LEU A 86 30.539 -0.425 -2.635 1.00 0.00 N ATOM 84 CA LEU A 86 29.190 0.018 -2.939 1.00 0.00 C ATOM 85 C LEU A 86 28.160 -0.953 -2.373 1.00 0.00 C ATOM 86 O LEU A 86 27.129 -0.546 -1.841 1.00 0.00 O ATOM 87 CB LEU A 86 29.012 0.135 -4.448 1.00 0.00 C ATOM 88 CG LEU A 86 27.595 0.671 -4.773 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.674 1.708 -5.897 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.692 -0.489 -5.217 1.00 0.00 C ATOM 0 H LEU A 86 31.104 -0.660 -3.451 1.00 0.00 H new ATOM 0 HA LEU A 86 29.036 0.993 -2.477 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.767 0.804 -4.861 1.00 0.00 H new ATOM 0 HB3 LEU A 86 29.158 -0.838 -4.917 1.00 0.00 H new ATOM 0 HG LEU A 86 27.180 1.137 -3.879 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.674 2.080 -6.120 1.00 0.00 H new ATOM 0 HD12 LEU A 86 28.308 2.537 -5.583 1.00 0.00 H new ATOM 0 HD13 LEU A 86 28.096 1.246 -6.789 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.696 -0.108 -5.445 1.00 0.00 H new ATOM 0 HD22 LEU A 86 27.113 -0.958 -6.106 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.625 -1.225 -4.416 1.00 0.00 H new ATOM 102 N LEU A 87 28.445 -2.243 -2.494 1.00 0.00 N ATOM 103 CA LEU A 87 27.532 -3.262 -1.996 1.00 0.00 C ATOM 104 C LEU A 87 27.266 -3.046 -0.512 1.00 0.00 C ATOM 105 O LEU A 87 26.156 -3.272 -0.031 1.00 0.00 O ATOM 106 CB LEU A 87 28.136 -4.654 -2.216 1.00 0.00 C ATOM 107 CG LEU A 87 27.973 -5.058 -3.688 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.852 -6.281 -3.986 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.499 -5.396 -3.989 1.00 0.00 C ATOM 0 H LEU A 87 29.293 -2.606 -2.929 1.00 0.00 H new ATOM 0 HA LEU A 87 26.590 -3.188 -2.540 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.191 -4.651 -1.944 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.643 -5.382 -1.572 1.00 0.00 H new ATOM 0 HG LEU A 87 28.280 -4.224 -4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.735 -6.567 -5.031 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.896 -6.035 -3.791 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.550 -7.111 -3.347 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.398 -5.681 -5.036 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.179 -6.223 -3.355 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.877 -4.523 -3.788 1.00 0.00 H new ATOM 121 N GLN A 88 28.288 -2.611 0.206 1.00 0.00 N ATOM 122 CA GLN A 88 28.149 -2.362 1.634 1.00 0.00 C ATOM 123 C GLN A 88 27.302 -1.115 1.882 1.00 0.00 C ATOM 124 O GLN A 88 26.604 -1.021 2.895 1.00 0.00 O ATOM 125 CB GLN A 88 29.526 -2.176 2.272 1.00 0.00 C ATOM 126 CG GLN A 88 30.298 -3.493 2.202 1.00 0.00 C ATOM 127 CD GLN A 88 31.692 -3.313 2.790 1.00 0.00 C ATOM 128 OE1 GLN A 88 32.032 -2.228 3.265 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.524 -4.318 2.791 1.00 0.00 N ATOM 0 H GLN A 88 29.217 -2.424 -0.171 1.00 0.00 H new ATOM 0 HA GLN A 88 27.654 -3.222 2.084 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.076 -1.391 1.754 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.419 -1.859 3.309 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.761 -4.268 2.749 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.371 -3.826 1.167 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.240 -5.215 2.397 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.458 -4.206 3.186 1.00 0.00 H new ATOM 138 N GLU A 89 27.379 -0.155 0.960 1.00 0.00 N ATOM 139 CA GLU A 89 26.621 1.085 1.105 1.00 0.00 C ATOM 140 C GLU A 89 25.120 0.830 1.019 1.00 0.00 C ATOM 141 O GLU A 89 24.350 1.319 1.848 1.00 0.00 O ATOM 142 CB GLU A 89 27.035 2.075 0.014 1.00 0.00 C ATOM 143 CG GLU A 89 28.467 2.550 0.270 1.00 0.00 C ATOM 144 CD GLU A 89 28.923 3.465 -0.861 1.00 0.00 C ATOM 145 OE1 GLU A 89 28.151 3.664 -1.784 1.00 0.00 O ATOM 146 OE2 GLU A 89 30.037 3.956 -0.786 1.00 0.00 O1- ATOM 0 H GLU A 89 27.950 -0.211 0.117 1.00 0.00 H new ATOM 0 HA GLU A 89 26.841 1.503 2.087 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.968 1.602 -0.966 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.355 2.927 0.004 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.518 3.080 1.221 1.00 0.00 H new ATOM 0 HG3 GLU A 89 29.135 1.692 0.347 1.00 0.00 H new ATOM 153 N ILE A 90 24.710 0.063 0.018 1.00 0.00 N ATOM 154 CA ILE A 90 23.296 -0.249 -0.162 1.00 0.00 C ATOM 155 C ILE A 90 22.793 -1.119 0.982 1.00 0.00 C ATOM 156 O ILE A 90 21.646 -1.007 1.402 1.00 0.00 O ATOM 157 CB ILE A 90 23.081 -0.963 -1.499 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.972 -2.201 -1.559 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.438 -0.021 -2.650 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.707 -2.960 -2.859 1.00 0.00 C ATOM 0 H ILE A 90 25.330 -0.352 -0.678 1.00 0.00 H new ATOM 0 HA ILE A 90 22.732 0.684 -0.163 1.00 0.00 H new ATOM 0 HB ILE A 90 22.036 -1.259 -1.588 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.021 -1.910 -1.503 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.774 -2.846 -0.703 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.284 -0.533 -3.600 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.802 0.863 -2.607 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.483 0.278 -2.565 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.344 -3.844 -2.901 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.661 -3.264 -2.896 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.927 -2.314 -3.709 1.00 0.00 H new ATOM 172 N ALA A 91 23.660 -1.998 1.470 1.00 0.00 N ATOM 173 CA ALA A 91 23.290 -2.895 2.558 1.00 0.00 C ATOM 174 C ALA A 91 22.847 -2.102 3.784 1.00 0.00 C ATOM 175 O ALA A 91 21.788 -2.364 4.356 1.00 0.00 O ATOM 176 CB ALA A 91 24.476 -3.786 2.931 1.00 0.00 C ATOM 0 H ALA A 91 24.616 -2.109 1.133 1.00 0.00 H new ATOM 0 HA ALA A 91 22.460 -3.516 2.220 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.189 -4.452 3.745 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.773 -4.378 2.065 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.312 -3.164 3.249 1.00 0.00 H new ATOM 182 N GLN A 92 23.662 -1.129 4.177 1.00 0.00 N ATOM 183 CA GLN A 92 23.340 -0.302 5.334 1.00 0.00 C ATOM 184 C GLN A 92 22.098 0.538 5.068 1.00 0.00 C ATOM 185 O GLN A 92 21.216 0.646 5.919 1.00 0.00 O ATOM 186 CB GLN A 92 24.520 0.620 5.660 1.00 0.00 C ATOM 187 CG GLN A 92 25.696 -0.212 6.176 1.00 0.00 C ATOM 188 CD GLN A 92 26.894 0.690 6.447 1.00 0.00 C ATOM 189 OE1 GLN A 92 27.386 1.361 5.538 1.00 0.00 O ATOM 190 NE2 GLN A 92 27.401 0.744 7.649 1.00 0.00 N ATOM 0 H GLN A 92 24.542 -0.895 3.717 1.00 0.00 H new ATOM 0 HA GLN A 92 23.144 -0.959 6.181 1.00 0.00 H new ATOM 0 HB2 GLN A 92 24.817 1.175 4.770 1.00 0.00 H new ATOM 0 HB3 GLN A 92 24.224 1.354 6.410 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.410 -0.734 7.089 1.00 0.00 H new ATOM 0 HG3 GLN A 92 25.962 -0.974 5.443 1.00 0.00 H new ATOM 0 HE21 GLN A 92 26.993 0.188 8.400 1.00 0.00 H new ATOM 0 HE22 GLN A 92 28.206 1.342 7.837 1.00 0.00 H new ATOM 199 N LYS A 93 22.034 1.133 3.880 1.00 0.00 N ATOM 200 CA LYS A 93 20.892 1.967 3.519 1.00 0.00 C ATOM 201 C LYS A 93 19.610 1.144 3.504 1.00 0.00 C ATOM 202 O LYS A 93 18.596 1.544 4.075 1.00 0.00 O ATOM 203 CB LYS A 93 21.118 2.589 2.139 1.00 0.00 C ATOM 204 CG LYS A 93 19.981 3.560 1.824 1.00 0.00 C ATOM 205 CD LYS A 93 20.258 4.260 0.493 1.00 0.00 C ATOM 206 CE LYS A 93 19.124 5.239 0.182 1.00 0.00 C ATOM 207 NZ LYS A 93 19.088 6.306 1.222 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.751 1.055 3.158 1.00 0.00 H new ATOM 0 HA LYS A 93 20.793 2.757 4.263 1.00 0.00 H new ATOM 0 HB2 LYS A 93 22.074 3.112 2.117 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.164 1.808 1.380 1.00 0.00 H new ATOM 0 HG2 LYS A 93 19.034 3.023 1.774 1.00 0.00 H new ATOM 0 HG3 LYS A 93 19.887 4.297 2.621 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.208 4.792 0.541 1.00 0.00 H new ATOM 0 HD3 LYS A 93 20.345 3.523 -0.306 1.00 0.00 H new ATOM 0 HE2 LYS A 93 19.272 5.682 -0.803 1.00 0.00 H new ATOM 0 HE3 LYS A 93 18.171 4.711 0.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 18.574 7.132 0.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 18.606 5.947 2.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 20.060 6.584 1.468 1.00 0.00 H new ATOM 221 N GLU A 94 19.662 -0.011 2.853 1.00 0.00 N ATOM 222 CA GLU A 94 18.501 -0.885 2.769 1.00 0.00 C ATOM 223 C GLU A 94 18.272 -1.598 4.097 1.00 0.00 C ATOM 224 O GLU A 94 17.307 -2.345 4.252 1.00 0.00 O ATOM 225 CB GLU A 94 18.701 -1.920 1.659 1.00 0.00 C ATOM 226 CG GLU A 94 18.715 -1.215 0.302 1.00 0.00 C ATOM 227 CD GLU A 94 18.983 -2.226 -0.808 1.00 0.00 C ATOM 228 OE1 GLU A 94 19.164 -3.390 -0.491 1.00 0.00 O ATOM 229 OE2 GLU A 94 19.000 -1.822 -1.960 1.00 0.00 O1- ATOM 0 H GLU A 94 20.493 -0.363 2.377 1.00 0.00 H new ATOM 0 HA GLU A 94 17.627 -0.275 2.540 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.637 -2.457 1.812 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.901 -2.660 1.688 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.760 -0.719 0.131 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.482 -0.441 0.293 1.00 0.00 H new ATOM 236 N SER A 95 19.168 -1.362 5.052 1.00 0.00 N ATOM 237 CA SER A 95 19.055 -1.987 6.365 1.00 0.00 C ATOM 238 C SER A 95 19.285 -3.490 6.265 1.00 0.00 C ATOM 239 O SER A 95 19.119 -4.222 7.240 1.00 0.00 O ATOM 240 CB SER A 95 17.666 -1.714 6.953 1.00 0.00 C ATOM 241 OG SER A 95 17.733 -1.812 8.370 1.00 0.00 O ATOM 0 H SER A 95 19.974 -0.747 4.942 1.00 0.00 H new ATOM 0 HA SER A 95 19.816 -1.561 7.019 1.00 0.00 H new ATOM 0 HB2 SER A 95 17.322 -0.722 6.661 1.00 0.00 H new ATOM 0 HB3 SER A 95 16.944 -2.430 6.560 1.00 0.00 H new ATOM 0 HG SER A 95 18.194 -2.640 8.619 1.00 0.00 H new ATOM 247 N SER A 96 19.667 -3.943 5.076 1.00 0.00 N ATOM 248 CA SER A 96 19.915 -5.363 4.857 1.00 0.00 C ATOM 249 C SER A 96 21.239 -5.770 5.487 1.00 0.00 C ATOM 250 O SER A 96 22.091 -4.926 5.769 1.00 0.00 O ATOM 251 CB SER A 96 19.946 -5.664 3.358 1.00 0.00 C ATOM 252 OG SER A 96 21.251 -5.416 2.858 1.00 0.00 O ATOM 0 H SER A 96 19.811 -3.354 4.256 1.00 0.00 H new ATOM 0 HA SER A 96 19.110 -5.932 5.322 1.00 0.00 H new ATOM 0 HB2 SER A 96 19.666 -6.702 3.178 1.00 0.00 H new ATOM 0 HB3 SER A 96 19.219 -5.042 2.835 1.00 0.00 H new ATOM 0 HG SER A 96 21.276 -5.609 1.898 1.00 0.00 H new ATOM 258 N LEU A 97 21.404 -7.065 5.713 1.00 0.00 N ATOM 259 CA LEU A 97 22.627 -7.564 6.321 1.00 0.00 C ATOM 260 C LEU A 97 23.815 -7.374 5.386 1.00 0.00 C ATOM 261 O LEU A 97 23.768 -7.764 4.220 1.00 0.00 O ATOM 262 CB LEU A 97 22.476 -9.056 6.650 1.00 0.00 C ATOM 263 CG LEU A 97 23.791 -9.601 7.228 1.00 0.00 C ATOM 264 CD1 LEU A 97 24.193 -8.785 8.466 1.00 0.00 C ATOM 265 CD2 LEU A 97 23.605 -11.069 7.619 1.00 0.00 C ATOM 0 H LEU A 97 20.714 -7.782 5.487 1.00 0.00 H new ATOM 0 HA LEU A 97 22.806 -7.000 7.236 1.00 0.00 H new ATOM 0 HB2 LEU A 97 21.667 -9.199 7.366 1.00 0.00 H new ATOM 0 HB3 LEU A 97 22.207 -9.610 5.751 1.00 0.00 H new ATOM 0 HG LEU A 97 24.576 -9.521 6.476 1.00 0.00 H new ATOM 0 HD11 LEU A 97 25.126 -9.176 8.872 1.00 0.00 H new ATOM 0 HD12 LEU A 97 24.329 -7.741 8.185 1.00 0.00 H new ATOM 0 HD13 LEU A 97 23.410 -8.859 9.221 1.00 0.00 H new ATOM 0 HD21 LEU A 97 24.537 -11.457 8.029 1.00 0.00 H new ATOM 0 HD22 LEU A 97 22.818 -11.149 8.368 1.00 0.00 H new ATOM 0 HD23 LEU A 97 23.328 -11.648 6.738 1.00 0.00 H new ATOM 277 N LEU A 98 24.889 -6.792 5.909 1.00 0.00 N ATOM 278 CA LEU A 98 26.088 -6.574 5.113 1.00 0.00 C ATOM 279 C LEU A 98 26.429 -7.833 4.317 1.00 0.00 C ATOM 280 O LEU A 98 26.068 -8.943 4.706 1.00 0.00 O ATOM 281 CB LEU A 98 27.270 -6.203 6.031 1.00 0.00 C ATOM 282 CG LEU A 98 27.310 -4.688 6.233 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.991 -4.224 6.850 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.468 -4.330 7.165 1.00 0.00 C ATOM 0 H LEU A 98 24.953 -6.466 6.873 1.00 0.00 H new ATOM 0 HA LEU A 98 25.902 -5.755 4.419 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.167 -6.705 6.993 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.206 -6.546 5.591 1.00 0.00 H new ATOM 0 HG LEU A 98 27.454 -4.194 5.272 1.00 0.00 H new ATOM 0 HD11 LEU A 98 26.017 -3.144 6.995 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.167 -4.481 6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.846 -4.716 7.812 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.498 -3.250 7.310 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.326 -4.822 8.127 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.407 -4.663 6.723 1.00 0.00 H new ATOM 296 N PRO A 99 27.124 -7.672 3.222 1.00 0.00 N ATOM 297 CA PRO A 99 27.535 -8.809 2.352 1.00 0.00 C ATOM 298 C PRO A 99 28.508 -9.743 3.065 1.00 0.00 C ATOM 299 O PRO A 99 28.989 -9.439 4.157 1.00 0.00 O ATOM 300 CB PRO A 99 28.189 -8.132 1.137 1.00 0.00 C ATOM 301 CG PRO A 99 28.611 -6.783 1.622 1.00 0.00 C ATOM 302 CD PRO A 99 27.594 -6.381 2.685 1.00 0.00 C ATOM 0 HA PRO A 99 26.693 -9.442 2.073 1.00 0.00 H new ATOM 0 HB2 PRO A 99 29.043 -8.707 0.778 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.488 -8.051 0.306 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.618 -6.815 2.038 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.627 -6.062 0.805 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.048 -5.765 3.461 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.775 -5.803 2.258 1.00 0.00 H new ATOM 310 N PHE A 100 28.799 -10.879 2.434 1.00 0.00 N ATOM 311 CA PHE A 100 29.731 -11.844 3.009 1.00 0.00 C ATOM 312 C PHE A 100 30.548 -12.505 1.906 1.00 0.00 C ATOM 313 O PHE A 100 29.994 -13.105 0.984 1.00 0.00 O ATOM 314 CB PHE A 100 28.960 -12.908 3.789 1.00 0.00 C ATOM 315 CG PHE A 100 29.900 -13.640 4.716 1.00 0.00 C ATOM 316 CD1 PHE A 100 30.279 -13.055 5.927 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.390 -14.902 4.361 1.00 0.00 C ATOM 318 CE1 PHE A 100 31.148 -13.732 6.789 1.00 0.00 C ATOM 319 CE2 PHE A 100 31.259 -15.579 5.222 1.00 0.00 C ATOM 320 CZ PHE A 100 31.640 -14.995 6.436 1.00 0.00 C ATOM 0 H PHE A 100 28.407 -11.151 1.533 1.00 0.00 H new ATOM 0 HA PHE A 100 30.407 -11.321 3.686 1.00 0.00 H new ATOM 0 HB2 PHE A 100 28.158 -12.443 4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.493 -13.611 3.099 1.00 0.00 H new ATOM 0 HD1 PHE A 100 29.901 -12.080 6.197 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.097 -15.352 3.424 1.00 0.00 H new ATOM 0 HE1 PHE A 100 31.439 -13.281 7.726 1.00 0.00 H new ATOM 0 HE2 PHE A 100 31.637 -16.554 4.950 1.00 0.00 H new ATOM 0 HZ PHE A 100 32.313 -15.518 7.100 1.00 0.00 H new ATOM 330 N TYR A 101 31.869 -12.389 2.003 1.00 0.00 N ATOM 331 CA TYR A 101 32.756 -12.974 1.003 1.00 0.00 C ATOM 332 C TYR A 101 33.395 -14.249 1.540 1.00 0.00 C ATOM 333 O TYR A 101 33.896 -14.278 2.664 1.00 0.00 O ATOM 334 CB TYR A 101 33.852 -11.970 0.640 1.00 0.00 C ATOM 335 CG TYR A 101 33.216 -10.738 0.042 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.819 -10.736 -1.299 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.016 -9.600 0.834 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.224 -9.594 -1.851 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.420 -8.461 0.283 1.00 0.00 C ATOM 340 CZ TYR A 101 32.024 -8.458 -1.058 1.00 0.00 C ATOM 341 OH TYR A 101 31.436 -7.334 -1.601 1.00 0.00 O ATOM 0 H TYR A 101 32.347 -11.898 2.759 1.00 0.00 H new ATOM 0 HA TYR A 101 32.171 -13.218 0.116 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.426 -11.704 1.527 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.549 -12.415 -0.070 1.00 0.00 H new ATOM 0 HD1 TYR A 101 32.971 -11.614 -1.909 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.322 -9.602 1.870 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.920 -9.590 -2.887 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.266 -7.584 0.893 1.00 0.00 H new ATOM 0 HH TYR A 101 31.370 -6.636 -0.916 1.00 0.00 H new ATOM 351 N ALA A 102 33.377 -15.304 0.730 1.00 0.00 N ATOM 352 CA ALA A 102 33.961 -16.582 1.132 1.00 0.00 C ATOM 353 C ALA A 102 34.608 -17.266 -0.062 1.00 0.00 C ATOM 354 O ALA A 102 34.122 -17.158 -1.186 1.00 0.00 O ATOM 355 CB ALA A 102 32.876 -17.486 1.717 1.00 0.00 C ATOM 0 H ALA A 102 32.967 -15.301 -0.204 1.00 0.00 H new ATOM 0 HA ALA A 102 34.724 -16.396 1.888 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.317 -18.437 2.015 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.431 -17.004 2.587 1.00 0.00 H new ATOM 0 HB3 ALA A 102 32.106 -17.662 0.966 1.00 0.00 H new ATOM 361 N THR A 103 35.712 -17.967 0.189 1.00 0.00 N ATOM 362 CA THR A 103 36.431 -18.665 -0.876 1.00 0.00 C ATOM 363 C THR A 103 36.622 -20.134 -0.522 1.00 0.00 C ATOM 364 O THR A 103 37.019 -20.465 0.595 1.00 0.00 O ATOM 365 CB THR A 103 37.797 -18.013 -1.093 1.00 0.00 C ATOM 366 OG1 THR A 103 37.613 -16.659 -1.478 1.00 0.00 O ATOM 367 CG2 THR A 103 38.549 -18.761 -2.194 1.00 0.00 C ATOM 0 H THR A 103 36.127 -18.067 1.115 1.00 0.00 H new ATOM 0 HA THR A 103 35.842 -18.597 -1.791 1.00 0.00 H new ATOM 0 HB THR A 103 38.374 -18.054 -0.169 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.486 -16.237 -1.616 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.523 -18.297 -2.349 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.686 -19.801 -1.899 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.975 -18.719 -3.120 1.00 0.00 H new ATOM 375 N ALA A 104 36.337 -21.017 -1.480 1.00 0.00 N ATOM 376 CA ALA A 104 36.482 -22.459 -1.262 1.00 0.00 C ATOM 377 C ALA A 104 37.400 -23.065 -2.318 1.00 0.00 C ATOM 378 O ALA A 104 37.450 -22.586 -3.449 1.00 0.00 O ATOM 379 CB ALA A 104 35.110 -23.129 -1.324 1.00 0.00 C ATOM 0 H ALA A 104 36.006 -20.762 -2.410 1.00 0.00 H new ATOM 0 HA ALA A 104 36.922 -22.624 -0.279 1.00 0.00 H new ATOM 0 HB1 ALA A 104 35.221 -24.201 -1.162 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.465 -22.710 -0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.664 -22.955 -2.303 1.00 0.00 H new ATOM 385 N THR A 105 38.124 -24.123 -1.945 1.00 0.00 N ATOM 386 CA THR A 105 39.033 -24.792 -2.861 1.00 0.00 C ATOM 387 C THR A 105 38.478 -26.151 -3.275 1.00 0.00 C ATOM 388 O THR A 105 37.990 -26.915 -2.441 1.00 0.00 O ATOM 389 CB THR A 105 40.382 -24.979 -2.181 1.00 0.00 C ATOM 390 OG1 THR A 105 40.290 -26.002 -1.199 1.00 0.00 O ATOM 391 CG2 THR A 105 40.816 -23.669 -1.523 1.00 0.00 C ATOM 0 H THR A 105 38.094 -24.531 -1.011 1.00 0.00 H new ATOM 0 HA THR A 105 39.147 -24.178 -3.754 1.00 0.00 H new ATOM 0 HB THR A 105 41.121 -25.267 -2.929 1.00 0.00 H new ATOM 0 HG1 THR A 105 41.161 -26.119 -0.766 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.782 -23.808 -1.038 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.900 -22.891 -2.282 1.00 0.00 H new ATOM 0 HG23 THR A 105 40.076 -23.373 -0.780 1.00 0.00 H new ATOM 399 N SER A 106 38.559 -26.447 -4.569 1.00 0.00 N ATOM 400 CA SER A 106 38.063 -27.718 -5.080 1.00 0.00 C ATOM 401 C SER A 106 38.636 -27.997 -6.459 1.00 0.00 C ATOM 402 O SER A 106 39.119 -27.092 -7.139 1.00 0.00 O ATOM 403 CB SER A 106 36.539 -27.695 -5.156 1.00 0.00 C ATOM 404 OG SER A 106 36.011 -27.372 -3.877 1.00 0.00 O ATOM 0 H SER A 106 38.959 -25.830 -5.276 1.00 0.00 H new ATOM 0 HA SER A 106 38.379 -28.508 -4.399 1.00 0.00 H new ATOM 0 HB2 SER A 106 36.211 -26.962 -5.893 1.00 0.00 H new ATOM 0 HB3 SER A 106 36.165 -28.665 -5.482 1.00 0.00 H new ATOM 0 HG SER A 106 36.618 -27.700 -3.180 1.00 0.00 H new ATOM 410 N GLY A 107 38.573 -29.261 -6.868 1.00 0.00 N ATOM 411 CA GLY A 107 39.084 -29.667 -8.172 1.00 0.00 C ATOM 412 C GLY A 107 40.197 -30.693 -8.017 1.00 0.00 C ATOM 413 O GLY A 107 40.562 -31.064 -6.902 1.00 0.00 O ATOM 0 H GLY A 107 38.174 -30.020 -6.316 1.00 0.00 H new ATOM 0 HA2 GLY A 107 38.276 -30.087 -8.770 1.00 0.00 H new ATOM 0 HA3 GLY A 107 39.458 -28.795 -8.709 1.00 0.00 H new ATOM 417 N PRO A 108 40.733 -31.154 -9.110 1.00 0.00 N ATOM 418 CA PRO A 108 41.829 -32.170 -9.110 1.00 0.00 C ATOM 419 C PRO A 108 43.083 -31.673 -8.394 1.00 0.00 C ATOM 420 O PRO A 108 43.361 -30.474 -8.362 1.00 0.00 O ATOM 421 CB PRO A 108 42.104 -32.402 -10.609 1.00 0.00 C ATOM 422 CG PRO A 108 41.564 -31.194 -11.291 1.00 0.00 C ATOM 423 CD PRO A 108 40.358 -30.763 -10.480 1.00 0.00 C ATOM 0 HA PRO A 108 41.547 -33.077 -8.576 1.00 0.00 H new ATOM 0 HB2 PRO A 108 43.170 -32.520 -10.801 1.00 0.00 H new ATOM 0 HB3 PRO A 108 41.614 -33.308 -10.965 1.00 0.00 H new ATOM 0 HG2 PRO A 108 42.311 -30.401 -11.331 1.00 0.00 H new ATOM 0 HG3 PRO A 108 41.283 -31.419 -12.320 1.00 0.00 H new ATOM 0 HD2 PRO A 108 40.178 -29.691 -10.560 1.00 0.00 H new ATOM 0 HD3 PRO A 108 39.448 -31.264 -10.810 1.00 0.00 H new ATOM 431 N SER A 109 43.841 -32.612 -7.833 1.00 0.00 N ATOM 432 CA SER A 109 45.070 -32.268 -7.131 1.00 0.00 C ATOM 433 C SER A 109 46.073 -31.649 -8.099 1.00 0.00 C ATOM 434 O SER A 109 47.015 -30.976 -7.684 1.00 0.00 O ATOM 435 CB SER A 109 45.677 -33.519 -6.496 1.00 0.00 C ATOM 436 OG SER A 109 46.848 -33.157 -5.775 1.00 0.00 O ATOM 0 H SER A 109 43.626 -33.609 -7.851 1.00 0.00 H new ATOM 0 HA SER A 109 44.835 -31.545 -6.350 1.00 0.00 H new ATOM 0 HB2 SER A 109 44.955 -33.989 -5.828 1.00 0.00 H new ATOM 0 HB3 SER A 109 45.921 -34.250 -7.266 1.00 0.00 H new ATOM 0 HG SER A 109 47.240 -33.956 -5.365 1.00 0.00 H new ATOM 442 N HIS A 110 45.859 -31.877 -9.395 1.00 0.00 N ATOM 443 CA HIS A 110 46.745 -31.329 -10.417 1.00 0.00 C ATOM 444 C HIS A 110 46.249 -29.964 -10.861 1.00 0.00 C ATOM 445 O HIS A 110 47.045 -29.061 -11.125 1.00 0.00 O ATOM 446 CB HIS A 110 46.809 -32.270 -11.618 1.00 0.00 C ATOM 447 CG HIS A 110 47.894 -31.814 -12.554 1.00 0.00 C ATOM 448 ND1 HIS A 110 47.633 -31.002 -13.647 1.00 0.00 N ATOM 449 CD2 HIS A 110 49.247 -32.046 -12.576 1.00 0.00 C ATOM 450 CE1 HIS A 110 48.801 -30.778 -14.276 1.00 0.00 C ATOM 451 NE2 HIS A 110 49.818 -31.391 -13.663 1.00 0.00 N ATOM 0 H HIS A 110 45.085 -32.433 -9.758 1.00 0.00 H new ATOM 0 HA HIS A 110 47.744 -31.225 -9.993 1.00 0.00 H new ATOM 0 HB2 HIS A 110 47.006 -33.289 -11.285 1.00 0.00 H new ATOM 0 HB3 HIS A 110 45.850 -32.283 -12.135 1.00 0.00 H new ATOM 0 HD2 HIS A 110 49.787 -32.646 -11.858 1.00 0.00 H new ATOM 0 HE1 HIS A 110 48.904 -30.177 -15.167 1.00 0.00 H new ATOM 0 HE2 HIS A 110 50.801 -31.381 -13.934 1.00 0.00 H new ATOM 459 N ALA A 111 44.923 -29.815 -10.935 1.00 0.00 N ATOM 460 CA ALA A 111 44.313 -28.545 -11.338 1.00 0.00 C ATOM 461 C ALA A 111 43.331 -28.067 -10.262 1.00 0.00 C ATOM 462 O ALA A 111 42.122 -28.266 -10.371 1.00 0.00 O ATOM 463 CB ALA A 111 43.605 -28.707 -12.700 1.00 0.00 C ATOM 0 H ALA A 111 44.254 -30.555 -10.722 1.00 0.00 H new ATOM 0 HA ALA A 111 45.093 -27.791 -11.446 1.00 0.00 H new ATOM 0 HB1 ALA A 111 43.155 -27.758 -12.991 1.00 0.00 H new ATOM 0 HB2 ALA A 111 44.331 -29.010 -13.454 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.828 -29.467 -12.618 1.00 0.00 H new ATOM 469 N PRO A 112 43.827 -27.454 -9.225 1.00 0.00 N ATOM 470 CA PRO A 112 42.982 -26.960 -8.110 1.00 0.00 C ATOM 471 C PRO A 112 42.389 -25.584 -8.393 1.00 0.00 C ATOM 472 O PRO A 112 43.117 -24.605 -8.544 1.00 0.00 O ATOM 473 CB PRO A 112 43.959 -26.911 -6.933 1.00 0.00 C ATOM 474 CG PRO A 112 45.309 -26.657 -7.548 1.00 0.00 C ATOM 475 CD PRO A 112 45.248 -27.160 -9.000 1.00 0.00 C ATOM 0 HA PRO A 112 42.115 -27.597 -7.932 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.691 -26.120 -6.232 1.00 0.00 H new ATOM 0 HB3 PRO A 112 43.951 -27.848 -6.376 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.552 -25.595 -7.519 1.00 0.00 H new ATOM 0 HG3 PRO A 112 46.089 -27.178 -6.993 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.613 -26.406 -9.697 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.864 -28.048 -9.139 1.00 0.00 H new ATOM 483 N THR A 113 41.062 -25.516 -8.456 1.00 0.00 N ATOM 484 CA THR A 113 40.371 -24.256 -8.715 1.00 0.00 C ATOM 485 C THR A 113 39.740 -23.733 -7.439 1.00 0.00 C ATOM 486 O THR A 113 39.698 -24.431 -6.427 1.00 0.00 O ATOM 487 CB THR A 113 39.293 -24.459 -9.783 1.00 0.00 C ATOM 488 OG1 THR A 113 38.279 -25.314 -9.274 1.00 0.00 O ATOM 489 CG2 THR A 113 39.915 -25.089 -11.030 1.00 0.00 C ATOM 0 H THR A 113 40.444 -26.318 -8.331 1.00 0.00 H new ATOM 0 HA THR A 113 41.096 -23.526 -9.075 1.00 0.00 H new ATOM 0 HB THR A 113 38.858 -23.495 -10.046 1.00 0.00 H new ATOM 0 HG1 THR A 113 38.639 -25.842 -8.531 1.00 0.00 H new ATOM 0 HG21 THR A 113 39.145 -25.232 -11.788 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.691 -24.432 -11.421 1.00 0.00 H new ATOM 0 HG23 THR A 113 40.353 -26.053 -10.771 1.00 0.00 H new ATOM 497 N PHE A 114 39.257 -22.495 -7.492 1.00 0.00 N ATOM 498 CA PHE A 114 38.627 -21.877 -6.324 1.00 0.00 C ATOM 499 C PHE A 114 37.284 -21.269 -6.705 1.00 0.00 C ATOM 500 O PHE A 114 37.134 -20.707 -7.790 1.00 0.00 O ATOM 501 CB PHE A 114 39.547 -20.786 -5.759 1.00 0.00 C ATOM 502 CG PHE A 114 40.986 -21.156 -6.032 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.598 -22.182 -5.305 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.708 -20.471 -7.013 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.931 -22.522 -5.557 1.00 0.00 C ATOM 506 CE2 PHE A 114 43.034 -20.809 -7.261 1.00 0.00 C ATOM 507 CZ PHE A 114 43.651 -21.833 -6.536 1.00 0.00 C ATOM 0 H PHE A 114 39.288 -21.903 -8.322 1.00 0.00 H new ATOM 0 HA PHE A 114 38.462 -22.643 -5.567 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.314 -19.825 -6.216 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.385 -20.677 -4.687 1.00 0.00 H new ATOM 0 HD1 PHE A 114 41.040 -22.713 -4.548 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.237 -19.680 -7.578 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.403 -23.315 -4.996 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.591 -20.277 -8.018 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.681 -22.091 -6.732 1.00 0.00 H new ATOM 517 N THR A 115 36.310 -21.381 -5.805 1.00 0.00 N ATOM 518 CA THR A 115 34.978 -20.831 -6.053 1.00 0.00 C ATOM 519 C THR A 115 34.619 -19.812 -4.979 1.00 0.00 C ATOM 520 O THR A 115 34.550 -20.138 -3.795 1.00 0.00 O ATOM 521 CB THR A 115 33.944 -21.959 -6.054 1.00 0.00 C ATOM 522 OG1 THR A 115 34.286 -22.906 -7.057 1.00 0.00 O ATOM 523 CG2 THR A 115 32.559 -21.382 -6.347 1.00 0.00 C ATOM 0 H THR A 115 36.416 -21.844 -4.903 1.00 0.00 H new ATOM 0 HA THR A 115 34.979 -20.337 -7.025 1.00 0.00 H new ATOM 0 HB THR A 115 33.933 -22.446 -5.079 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.627 -23.632 -7.060 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.823 -22.186 -6.348 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.299 -20.652 -5.580 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.566 -20.896 -7.323 1.00 0.00 H new ATOM 531 N SER A 116 34.389 -18.572 -5.404 1.00 0.00 N ATOM 532 CA SER A 116 34.036 -17.505 -4.469 1.00 0.00 C ATOM 533 C SER A 116 32.527 -17.306 -4.447 1.00 0.00 C ATOM 534 O SER A 116 31.914 -17.029 -5.477 1.00 0.00 O ATOM 535 CB SER A 116 34.717 -16.201 -4.890 1.00 0.00 C ATOM 536 OG SER A 116 36.095 -16.267 -4.554 1.00 0.00 O ATOM 0 H SER A 116 34.440 -18.282 -6.381 1.00 0.00 H new ATOM 0 HA SER A 116 34.374 -17.785 -3.471 1.00 0.00 H new ATOM 0 HB2 SER A 116 34.598 -16.044 -5.962 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.248 -15.353 -4.390 1.00 0.00 H new ATOM 0 HG SER A 116 36.616 -16.495 -5.352 1.00 0.00 H new ATOM 542 N THR A 117 31.933 -17.445 -3.265 1.00 0.00 N ATOM 543 CA THR A 117 30.488 -17.279 -3.110 1.00 0.00 C ATOM 544 C THR A 117 30.184 -16.045 -2.274 1.00 0.00 C ATOM 545 O THR A 117 30.774 -15.841 -1.214 1.00 0.00 O ATOM 546 CB THR A 117 29.890 -18.514 -2.433 1.00 0.00 C ATOM 547 OG1 THR A 117 30.071 -19.644 -3.274 1.00 0.00 O ATOM 548 CG2 THR A 117 28.397 -18.289 -2.193 1.00 0.00 C ATOM 0 H THR A 117 32.427 -17.672 -2.402 1.00 0.00 H new ATOM 0 HA THR A 117 30.045 -17.157 -4.098 1.00 0.00 H new ATOM 0 HB THR A 117 30.388 -18.686 -1.479 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.690 -20.437 -2.842 1.00 0.00 H new ATOM 0 HG21 THR A 117 27.969 -19.168 -1.711 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.259 -17.419 -1.551 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.897 -18.119 -3.146 1.00 0.00 H new ATOM 556 N VAL A 118 29.258 -15.221 -2.762 1.00 0.00 N ATOM 557 CA VAL A 118 28.876 -13.997 -2.055 1.00 0.00 C ATOM 558 C VAL A 118 27.444 -14.106 -1.552 1.00 0.00 C ATOM 559 O VAL A 118 26.568 -14.615 -2.253 1.00 0.00 O ATOM 560 CB VAL A 118 29.004 -12.795 -2.987 1.00 0.00 C ATOM 561 CG1 VAL A 118 27.963 -12.893 -4.103 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.774 -11.514 -2.183 1.00 0.00 C ATOM 0 H VAL A 118 28.760 -15.376 -3.639 1.00 0.00 H new ATOM 0 HA VAL A 118 29.542 -13.863 -1.203 1.00 0.00 H new ATOM 0 HB VAL A 118 30.000 -12.780 -3.429 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.058 -12.033 -4.766 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.124 -13.809 -4.672 1.00 0.00 H new ATOM 0 HG13 VAL A 118 26.964 -12.907 -3.668 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.864 -10.650 -2.842 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.776 -11.534 -1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.518 -11.444 -1.389 1.00 0.00 H new ATOM 572 N GLU A 119 27.213 -13.630 -0.329 1.00 0.00 N ATOM 573 CA GLU A 119 25.880 -13.681 0.272 1.00 0.00 C ATOM 574 C GLU A 119 25.435 -12.294 0.721 1.00 0.00 C ATOM 575 O GLU A 119 26.195 -11.561 1.350 1.00 0.00 O ATOM 576 CB GLU A 119 25.890 -14.629 1.471 1.00 0.00 C ATOM 577 CG GLU A 119 24.463 -14.825 1.977 1.00 0.00 C ATOM 578 CD GLU A 119 24.461 -15.763 3.179 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.534 -16.054 3.681 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.385 -16.171 3.584 1.00 0.00 O1- ATOM 0 H GLU A 119 27.928 -13.207 0.263 1.00 0.00 H new ATOM 0 HA GLU A 119 25.178 -14.045 -0.478 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.321 -15.589 1.186 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.516 -14.222 2.265 1.00 0.00 H new ATOM 0 HG2 GLU A 119 24.031 -13.863 2.255 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.840 -15.237 1.183 1.00 0.00 H new ATOM 587 N PHE A 120 24.195 -11.941 0.395 1.00 0.00 N ATOM 588 CA PHE A 120 23.664 -10.640 0.786 1.00 0.00 C ATOM 589 C PHE A 120 22.147 -10.598 0.595 1.00 0.00 C ATOM 590 O PHE A 120 21.589 -11.373 -0.179 1.00 0.00 O ATOM 591 CB PHE A 120 24.316 -9.535 -0.043 1.00 0.00 C ATOM 592 CG PHE A 120 23.885 -9.665 -1.483 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.716 -9.035 -1.921 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.656 -10.410 -2.378 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.316 -9.151 -3.256 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.258 -10.529 -3.715 1.00 0.00 C ATOM 597 CZ PHE A 120 23.088 -9.899 -4.155 1.00 0.00 C ATOM 0 H PHE A 120 23.548 -12.528 -0.131 1.00 0.00 H new ATOM 0 HA PHE A 120 23.890 -10.481 1.840 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.031 -8.558 0.346 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.401 -9.603 0.030 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.122 -8.458 -1.228 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.560 -10.895 -2.039 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.413 -8.665 -3.594 1.00 0.00 H new ATOM 0 HE2 PHE A 120 24.853 -11.107 -4.407 1.00 0.00 H new ATOM 0 HZ PHE A 120 22.781 -9.989 -5.186 1.00 0.00 H new ATOM 607 N ALA A 121 21.487 -9.680 1.294 1.00 0.00 N ATOM 608 CA ALA A 121 20.038 -9.549 1.186 1.00 0.00 C ATOM 609 C ALA A 121 19.362 -10.893 1.428 1.00 0.00 C ATOM 610 O ALA A 121 18.232 -11.119 0.992 1.00 0.00 O ATOM 611 CB ALA A 121 19.659 -9.028 -0.203 1.00 0.00 C ATOM 0 H ALA A 121 21.928 -9.021 1.936 1.00 0.00 H new ATOM 0 HA ALA A 121 19.699 -8.841 1.942 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.575 -8.934 -0.273 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.119 -8.053 -0.364 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.012 -9.726 -0.962 1.00 0.00 H new ATOM 617 N GLY A 122 20.059 -11.782 2.129 1.00 0.00 N ATOM 618 CA GLY A 122 19.514 -13.101 2.428 1.00 0.00 C ATOM 619 C GLY A 122 19.545 -13.998 1.200 1.00 0.00 C ATOM 620 O GLY A 122 18.791 -14.965 1.106 1.00 0.00 O ATOM 0 H GLY A 122 20.995 -11.615 2.498 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.088 -13.561 3.233 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.489 -13.002 2.784 1.00 0.00 H new ATOM 624 N LYS A 123 20.419 -13.672 0.254 1.00 0.00 N ATOM 625 CA LYS A 123 20.544 -14.454 -0.976 1.00 0.00 C ATOM 626 C LYS A 123 22.004 -14.754 -1.265 1.00 0.00 C ATOM 627 O LYS A 123 22.886 -13.998 -0.868 1.00 0.00 O ATOM 628 CB LYS A 123 19.930 -13.687 -2.145 1.00 0.00 C ATOM 629 CG LYS A 123 18.413 -13.632 -1.974 1.00 0.00 C ATOM 630 CD LYS A 123 17.793 -12.878 -3.152 1.00 0.00 C ATOM 631 CE LYS A 123 16.268 -12.927 -3.044 1.00 0.00 C ATOM 632 NZ LYS A 123 15.836 -12.245 -1.793 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.051 -12.874 0.313 1.00 0.00 H new ATOM 0 HA LYS A 123 20.012 -15.396 -0.847 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.339 -12.678 -2.187 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.184 -14.173 -3.087 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.006 -14.642 -1.920 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.160 -13.136 -1.037 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.135 -11.843 -3.155 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.116 -13.323 -4.093 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.816 -12.443 -3.909 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.926 -13.962 -3.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.822 -12.021 -1.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.006 -12.871 -0.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.378 -11.366 -1.672 1.00 0.00 H new ATOM 646 N VAL A 124 22.251 -15.862 -1.962 1.00 0.00 N ATOM 647 CA VAL A 124 23.618 -16.258 -2.303 1.00 0.00 C ATOM 648 C VAL A 124 23.801 -16.312 -3.810 1.00 0.00 C ATOM 649 O VAL A 124 23.066 -17.001 -4.512 1.00 0.00 O ATOM 650 CB VAL A 124 23.923 -17.633 -1.704 1.00 0.00 C ATOM 651 CG1 VAL A 124 22.921 -18.662 -2.238 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.341 -18.050 -2.098 1.00 0.00 C ATOM 0 H VAL A 124 21.529 -16.498 -2.300 1.00 0.00 H new ATOM 0 HA VAL A 124 24.304 -15.517 -1.892 1.00 0.00 H new ATOM 0 HB VAL A 124 23.843 -17.583 -0.618 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.141 -19.640 -1.810 1.00 0.00 H new ATOM 0 HG12 VAL A 124 21.910 -18.363 -1.961 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.998 -18.716 -3.324 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.563 -19.029 -1.674 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.417 -18.099 -3.184 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.054 -17.319 -1.717 1.00 0.00 H new ATOM 662 N PHE A 125 24.792 -15.575 -4.305 1.00 0.00 N ATOM 663 CA PHE A 125 25.074 -15.545 -5.740 1.00 0.00 C ATOM 664 C PHE A 125 26.368 -16.292 -6.034 1.00 0.00 C ATOM 665 O PHE A 125 27.435 -15.934 -5.529 1.00 0.00 O ATOM 666 CB PHE A 125 25.197 -14.097 -6.210 1.00 0.00 C ATOM 667 CG PHE A 125 23.833 -13.449 -6.195 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.263 -13.054 -4.980 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.138 -13.238 -7.392 1.00 0.00 C ATOM 670 CE1 PHE A 125 21.999 -12.456 -4.961 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.875 -12.639 -7.371 1.00 0.00 C ATOM 672 CZ PHE A 125 21.306 -12.248 -6.157 1.00 0.00 C ATOM 0 H PHE A 125 25.410 -14.994 -3.739 1.00 0.00 H new ATOM 0 HA PHE A 125 24.256 -16.030 -6.273 1.00 0.00 H new ATOM 0 HB2 PHE A 125 25.880 -13.549 -5.561 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.617 -14.063 -7.215 1.00 0.00 H new ATOM 0 HD1 PHE A 125 23.800 -13.211 -4.056 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.578 -13.538 -8.332 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.558 -12.155 -4.022 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.339 -12.478 -8.295 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.330 -11.785 -6.142 1.00 0.00 H new ATOM 682 N SER A 126 26.269 -17.338 -6.848 1.00 0.00 N ATOM 683 CA SER A 126 27.439 -18.133 -7.202 1.00 0.00 C ATOM 684 C SER A 126 28.208 -17.469 -8.337 1.00 0.00 C ATOM 685 O SER A 126 27.619 -17.032 -9.326 1.00 0.00 O ATOM 686 CB SER A 126 27.009 -19.537 -7.628 1.00 0.00 C ATOM 687 OG SER A 126 26.451 -20.215 -6.512 1.00 0.00 O ATOM 0 H SER A 126 25.397 -17.653 -7.272 1.00 0.00 H new ATOM 0 HA SER A 126 28.087 -18.203 -6.328 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.278 -19.477 -8.434 1.00 0.00 H new ATOM 0 HB3 SER A 126 27.865 -20.091 -8.014 1.00 0.00 H new ATOM 0 HG SER A 126 26.173 -21.115 -6.782 1.00 0.00 H new ATOM 693 N GLY A 127 29.528 -17.398 -8.192 1.00 0.00 N ATOM 694 CA GLY A 127 30.374 -16.786 -9.216 1.00 0.00 C ATOM 695 C GLY A 127 30.848 -17.832 -10.218 1.00 0.00 C ATOM 696 O GLY A 127 30.337 -18.951 -10.242 1.00 0.00 O ATOM 0 H GLY A 127 30.034 -17.754 -7.381 1.00 0.00 H new ATOM 0 HA2 GLY A 127 29.819 -16.004 -9.734 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.234 -16.309 -8.747 1.00 0.00 H new ATOM 700 N GLU A 128 31.830 -17.466 -11.042 1.00 0.00 N ATOM 701 CA GLU A 128 32.368 -18.376 -12.033 1.00 0.00 C ATOM 702 C GLU A 128 33.647 -19.027 -11.526 1.00 0.00 C ATOM 703 O GLU A 128 34.530 -18.357 -10.994 1.00 0.00 O ATOM 704 CB GLU A 128 32.650 -17.626 -13.337 1.00 0.00 C ATOM 705 CG GLU A 128 33.544 -18.466 -14.239 1.00 0.00 C ATOM 706 CD GLU A 128 33.532 -17.920 -15.660 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.083 -16.801 -15.841 1.00 0.00 O ATOM 708 OE2 GLU A 128 33.970 -18.631 -16.550 1.00 0.00 O1- ATOM 0 H GLU A 128 32.264 -16.543 -11.037 1.00 0.00 H new ATOM 0 HA GLU A 128 31.630 -19.156 -12.219 1.00 0.00 H new ATOM 0 HB2 GLU A 128 31.713 -17.402 -13.847 1.00 0.00 H new ATOM 0 HB3 GLU A 128 33.131 -16.672 -13.121 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.563 -18.467 -13.852 1.00 0.00 H new ATOM 0 HG3 GLU A 128 33.202 -19.501 -14.238 1.00 0.00 H new ATOM 715 N GLU A 129 33.736 -20.333 -11.703 1.00 0.00 N ATOM 716 CA GLU A 129 34.916 -21.074 -11.266 1.00 0.00 C ATOM 717 C GLU A 129 36.151 -20.606 -12.034 1.00 0.00 C ATOM 718 O GLU A 129 36.052 -20.146 -13.172 1.00 0.00 O ATOM 719 CB GLU A 129 34.710 -22.575 -11.481 1.00 0.00 C ATOM 720 CG GLU A 129 34.447 -22.847 -12.963 1.00 0.00 C ATOM 721 CD GLU A 129 34.178 -24.332 -13.180 1.00 0.00 C ATOM 722 OE1 GLU A 129 34.779 -25.132 -12.483 1.00 0.00 O ATOM 723 OE2 GLU A 129 33.372 -24.647 -14.040 1.00 0.00 O1- ATOM 0 H GLU A 129 33.013 -20.903 -12.143 1.00 0.00 H new ATOM 0 HA GLU A 129 35.067 -20.886 -10.203 1.00 0.00 H new ATOM 0 HB2 GLU A 129 35.591 -23.125 -11.150 1.00 0.00 H new ATOM 0 HB3 GLU A 129 33.871 -22.927 -10.881 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.593 -22.261 -13.303 1.00 0.00 H new ATOM 0 HG3 GLU A 129 35.306 -22.534 -13.557 1.00 0.00 H new ATOM 730 N ALA A 130 37.311 -20.725 -11.400 1.00 0.00 N ATOM 731 CA ALA A 130 38.560 -20.312 -12.029 1.00 0.00 C ATOM 732 C ALA A 130 39.754 -20.735 -11.185 1.00 0.00 C ATOM 733 O ALA A 130 39.611 -21.062 -10.009 1.00 0.00 O ATOM 734 CB ALA A 130 38.569 -18.793 -12.212 1.00 0.00 C ATOM 0 H ALA A 130 37.413 -21.101 -10.457 1.00 0.00 H new ATOM 0 HA ALA A 130 38.634 -20.797 -13.002 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.504 -18.489 -12.682 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.732 -18.498 -12.844 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.478 -18.309 -11.240 1.00 0.00 H new ATOM 740 N LYS A 131 40.938 -20.709 -11.789 1.00 0.00 N ATOM 741 CA LYS A 131 42.162 -21.075 -11.082 1.00 0.00 C ATOM 742 C LYS A 131 42.765 -19.862 -10.389 1.00 0.00 C ATOM 743 O LYS A 131 43.982 -19.750 -10.265 1.00 0.00 O ATOM 744 CB LYS A 131 43.183 -21.656 -12.058 1.00 0.00 C ATOM 745 CG LYS A 131 43.503 -20.617 -13.135 1.00 0.00 C ATOM 746 CD LYS A 131 44.511 -21.200 -14.123 1.00 0.00 C ATOM 747 CE LYS A 131 44.844 -20.151 -15.189 1.00 0.00 C ATOM 748 NZ LYS A 131 45.867 -20.699 -16.123 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.077 -20.439 -12.763 1.00 0.00 H new ATOM 0 HA LYS A 131 41.908 -21.824 -10.332 1.00 0.00 H new ATOM 0 HB2 LYS A 131 44.092 -21.937 -11.526 1.00 0.00 H new ATOM 0 HB3 LYS A 131 42.789 -22.563 -12.517 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.592 -20.327 -13.658 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.908 -19.715 -12.676 1.00 0.00 H new ATOM 0 HD2 LYS A 131 45.418 -21.502 -13.599 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.101 -22.094 -14.593 1.00 0.00 H new ATOM 0 HE2 LYS A 131 43.944 -19.877 -15.739 1.00 0.00 H new ATOM 0 HE3 LYS A 131 45.217 -19.243 -14.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 46.093 -19.987 -16.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 46.729 -20.939 -15.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 45.494 -21.554 -16.583 1.00 0.00 H new ATOM 762 N THR A 132 41.911 -18.952 -9.940 1.00 0.00 N ATOM 763 CA THR A 132 42.384 -17.751 -9.260 1.00 0.00 C ATOM 764 C THR A 132 41.296 -17.191 -8.357 1.00 0.00 C ATOM 765 O THR A 132 40.107 -17.306 -8.653 1.00 0.00 O ATOM 766 CB THR A 132 42.805 -16.699 -10.287 1.00 0.00 C ATOM 767 OG1 THR A 132 43.129 -15.486 -9.616 1.00 0.00 O ATOM 768 CG2 THR A 132 41.661 -16.453 -11.267 1.00 0.00 C ATOM 0 H THR A 132 40.897 -19.020 -10.032 1.00 0.00 H new ATOM 0 HA THR A 132 43.246 -18.014 -8.647 1.00 0.00 H new ATOM 0 HB THR A 132 43.677 -17.055 -10.835 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.401 -14.811 -10.273 1.00 0.00 H new ATOM 0 HG21 THR A 132 41.963 -15.703 -11.998 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.416 -17.382 -11.781 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.786 -16.098 -10.723 1.00 0.00 H new ATOM 776 N LYS A 133 41.719 -16.582 -7.260 1.00 0.00 N ATOM 777 CA LYS A 133 40.787 -15.995 -6.310 1.00 0.00 C ATOM 778 C LYS A 133 40.355 -14.617 -6.792 1.00 0.00 C ATOM 779 O LYS A 133 39.358 -14.066 -6.326 1.00 0.00 O ATOM 780 CB LYS A 133 41.458 -15.875 -4.937 1.00 0.00 C ATOM 781 CG LYS A 133 41.756 -17.273 -4.390 1.00 0.00 C ATOM 782 CD LYS A 133 42.422 -17.155 -3.016 1.00 0.00 C ATOM 783 CE LYS A 133 42.738 -18.553 -2.479 1.00 0.00 C ATOM 784 NZ LYS A 133 43.487 -18.433 -1.196 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.702 -16.481 -7.006 1.00 0.00 H new ATOM 0 HA LYS A 133 39.909 -16.636 -6.228 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.381 -15.301 -5.021 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.808 -15.335 -4.249 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.833 -17.848 -4.310 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.409 -17.812 -5.077 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.337 -16.568 -3.093 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.763 -16.629 -2.325 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.815 -19.112 -2.323 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.329 -19.109 -3.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.703 -19.382 -0.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 44.374 -17.915 -1.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.908 -17.918 -0.503 1.00 0.00 H new ATOM 798 N LYS A 134 41.124 -14.066 -7.726 1.00 0.00 N ATOM 799 CA LYS A 134 40.822 -12.747 -8.266 1.00 0.00 C ATOM 800 C LYS A 134 39.614 -12.805 -9.193 1.00 0.00 C ATOM 801 O LYS A 134 38.631 -12.098 -8.987 1.00 0.00 O ATOM 802 CB LYS A 134 42.033 -12.218 -9.038 1.00 0.00 C ATOM 803 CG LYS A 134 43.200 -11.993 -8.076 1.00 0.00 C ATOM 804 CD LYS A 134 44.409 -11.468 -8.852 1.00 0.00 C ATOM 805 CE LYS A 134 45.583 -11.265 -7.893 1.00 0.00 C ATOM 806 NZ LYS A 134 46.746 -10.711 -8.642 1.00 0.00 N1+ ATOM 0 H LYS A 134 41.954 -14.509 -8.121 1.00 0.00 H new ATOM 0 HA LYS A 134 40.592 -12.079 -7.436 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.320 -12.928 -9.814 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.777 -11.284 -9.539 1.00 0.00 H new ATOM 0 HG2 LYS A 134 42.914 -11.281 -7.302 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.455 -12.926 -7.573 1.00 0.00 H new ATOM 0 HD2 LYS A 134 44.685 -12.173 -9.637 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.159 -10.527 -9.342 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.297 -10.586 -7.090 1.00 0.00 H new ATOM 0 HE3 LYS A 134 45.854 -12.213 -7.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 47.545 -10.573 -7.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 47.023 -11.375 -9.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 46.483 -9.798 -9.066 1.00 0.00 H new ATOM 820 N LEU A 135 39.697 -13.646 -10.218 1.00 0.00 N ATOM 821 CA LEU A 135 38.614 -13.779 -11.173 1.00 0.00 C ATOM 822 C LEU A 135 37.366 -14.359 -10.519 1.00 0.00 C ATOM 823 O LEU A 135 36.249 -13.924 -10.795 1.00 0.00 O ATOM 824 CB LEU A 135 39.058 -14.700 -12.322 1.00 0.00 C ATOM 825 CG LEU A 135 38.263 -14.363 -13.596 1.00 0.00 C ATOM 826 CD1 LEU A 135 38.944 -13.194 -14.329 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.217 -15.589 -14.515 1.00 0.00 C ATOM 0 H LEU A 135 40.503 -14.243 -10.405 1.00 0.00 H new ATOM 0 HA LEU A 135 38.372 -12.787 -11.554 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.126 -14.579 -12.506 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.898 -15.743 -12.047 1.00 0.00 H new ATOM 0 HG LEU A 135 37.246 -14.080 -13.324 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.382 -12.954 -15.232 1.00 0.00 H new ATOM 0 HD12 LEU A 135 38.972 -12.322 -13.676 1.00 0.00 H new ATOM 0 HD13 LEU A 135 39.961 -13.477 -14.599 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.653 -15.347 -15.416 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.232 -15.877 -14.788 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.733 -16.416 -13.995 1.00 0.00 H new ATOM 839 N ALA A 136 37.567 -15.354 -9.662 1.00 0.00 N ATOM 840 CA ALA A 136 36.448 -16.003 -8.992 1.00 0.00 C ATOM 841 C ALA A 136 35.611 -14.986 -8.227 1.00 0.00 C ATOM 842 O ALA A 136 34.402 -14.881 -8.438 1.00 0.00 O ATOM 843 CB ALA A 136 36.975 -17.060 -8.017 1.00 0.00 C ATOM 0 H ALA A 136 38.485 -15.725 -9.417 1.00 0.00 H new ATOM 0 HA ALA A 136 35.821 -16.474 -9.749 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.136 -17.544 -7.517 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.550 -17.806 -8.565 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.614 -16.583 -7.274 1.00 0.00 H new ATOM 849 N GLU A 137 36.256 -14.232 -7.343 1.00 0.00 N ATOM 850 CA GLU A 137 35.551 -13.230 -6.551 1.00 0.00 C ATOM 851 C GLU A 137 34.909 -12.185 -7.457 1.00 0.00 C ATOM 852 O GLU A 137 33.786 -11.744 -7.213 1.00 0.00 O ATOM 853 CB GLU A 137 36.530 -12.541 -5.595 1.00 0.00 C ATOM 854 CG GLU A 137 37.003 -13.539 -4.535 1.00 0.00 C ATOM 855 CD GLU A 137 38.052 -12.890 -3.639 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.339 -11.722 -3.846 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.553 -13.571 -2.759 1.00 0.00 O1- ATOM 0 H GLU A 137 37.257 -14.294 -7.158 1.00 0.00 H new ATOM 0 HA GLU A 137 34.769 -13.730 -5.979 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.384 -12.153 -6.150 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.047 -11.689 -5.117 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.157 -13.873 -3.935 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.421 -14.423 -5.017 1.00 0.00 H new ATOM 864 N MET A 138 35.629 -11.791 -8.501 1.00 0.00 N ATOM 865 CA MET A 138 35.114 -10.792 -9.432 1.00 0.00 C ATOM 866 C MET A 138 33.845 -11.296 -10.105 1.00 0.00 C ATOM 867 O MET A 138 32.878 -10.549 -10.256 1.00 0.00 O ATOM 868 CB MET A 138 36.170 -10.477 -10.496 1.00 0.00 C ATOM 869 CG MET A 138 37.247 -9.565 -9.905 1.00 0.00 C ATOM 870 SD MET A 138 38.578 -9.345 -11.108 1.00 0.00 S ATOM 871 CE MET A 138 39.745 -8.511 -10.003 1.00 0.00 C ATOM 0 H MET A 138 36.560 -12.143 -8.723 1.00 0.00 H new ATOM 0 HA MET A 138 34.880 -9.885 -8.874 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.622 -11.401 -10.858 1.00 0.00 H new ATOM 0 HB3 MET A 138 35.702 -9.994 -11.354 1.00 0.00 H new ATOM 0 HG2 MET A 138 36.816 -8.599 -9.643 1.00 0.00 H new ATOM 0 HG3 MET A 138 37.641 -9.998 -8.986 1.00 0.00 H new ATOM 0 HE1 MET A 138 40.659 -8.277 -10.549 1.00 0.00 H new ATOM 0 HE2 MET A 138 39.298 -7.589 -9.631 1.00 0.00 H new ATOM 0 HE3 MET A 138 39.981 -9.164 -9.163 1.00 0.00 H new ATOM 881 N SER A 139 33.852 -12.561 -10.508 1.00 0.00 N ATOM 882 CA SER A 139 32.695 -13.147 -11.165 1.00 0.00 C ATOM 883 C SER A 139 31.483 -13.129 -10.246 1.00 0.00 C ATOM 884 O SER A 139 30.371 -12.841 -10.685 1.00 0.00 O ATOM 885 CB SER A 139 32.998 -14.593 -11.567 1.00 0.00 C ATOM 886 OG SER A 139 34.030 -14.598 -12.547 1.00 0.00 O ATOM 0 H SER A 139 34.642 -13.196 -10.391 1.00 0.00 H new ATOM 0 HA SER A 139 32.475 -12.554 -12.053 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.306 -15.169 -10.694 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.101 -15.069 -11.963 1.00 0.00 H new ATOM 0 HG SER A 139 34.888 -14.396 -12.119 1.00 0.00 H new ATOM 892 N ALA A 140 31.703 -13.434 -8.970 1.00 0.00 N ATOM 893 CA ALA A 140 30.616 -13.450 -8.000 1.00 0.00 C ATOM 894 C ALA A 140 30.004 -12.063 -7.845 1.00 0.00 C ATOM 895 O ALA A 140 28.783 -11.908 -7.832 1.00 0.00 O ATOM 896 CB ALA A 140 31.141 -13.935 -6.645 1.00 0.00 C ATOM 0 H ALA A 140 32.618 -13.672 -8.587 1.00 0.00 H new ATOM 0 HA ALA A 140 29.844 -14.130 -8.360 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.326 -13.946 -5.922 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.546 -14.942 -6.751 1.00 0.00 H new ATOM 0 HB3 ALA A 140 31.926 -13.263 -6.297 1.00 0.00 H new ATOM 902 N ALA A 141 30.857 -11.056 -7.721 1.00 0.00 N ATOM 903 CA ALA A 141 30.388 -9.685 -7.566 1.00 0.00 C ATOM 904 C ALA A 141 29.788 -9.170 -8.869 1.00 0.00 C ATOM 905 O ALA A 141 28.964 -8.255 -8.863 1.00 0.00 O ATOM 906 CB ALA A 141 31.547 -8.778 -7.144 1.00 0.00 C ATOM 0 H ALA A 141 31.872 -11.160 -7.725 1.00 0.00 H new ATOM 0 HA ALA A 141 29.618 -9.673 -6.795 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.186 -7.756 -7.031 1.00 0.00 H new ATOM 0 HB2 ALA A 141 31.955 -9.126 -6.195 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.326 -8.806 -7.905 1.00 0.00 H new ATOM 912 N LYS A 142 30.206 -9.758 -9.985 1.00 0.00 N ATOM 913 CA LYS A 142 29.696 -9.348 -11.288 1.00 0.00 C ATOM 914 C LYS A 142 28.250 -9.798 -11.483 1.00 0.00 C ATOM 915 O LYS A 142 27.388 -9.008 -11.866 1.00 0.00 O ATOM 916 CB LYS A 142 30.569 -9.940 -12.396 1.00 0.00 C ATOM 917 CG LYS A 142 30.115 -9.397 -13.753 1.00 0.00 C ATOM 918 CD LYS A 142 31.009 -9.963 -14.855 1.00 0.00 C ATOM 919 CE LYS A 142 30.567 -9.409 -16.211 1.00 0.00 C ATOM 920 NZ LYS A 142 31.051 -8.007 -16.355 1.00 0.00 N1+ ATOM 0 H LYS A 142 30.891 -10.514 -10.014 1.00 0.00 H new ATOM 0 HA LYS A 142 29.726 -8.259 -11.335 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.615 -9.687 -12.223 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.499 -11.028 -12.386 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.076 -9.671 -13.937 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.163 -8.308 -13.755 1.00 0.00 H new ATOM 0 HD2 LYS A 142 32.049 -9.699 -14.665 1.00 0.00 H new ATOM 0 HD3 LYS A 142 30.952 -11.052 -14.860 1.00 0.00 H new ATOM 0 HE2 LYS A 142 30.965 -10.027 -17.016 1.00 0.00 H new ATOM 0 HE3 LYS A 142 29.480 -9.440 -16.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 30.871 -7.675 -17.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 30.548 -7.395 -15.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 32.072 -7.971 -16.161 1.00 0.00 H new ATOM 934 N VAL A 143 27.999 -11.077 -11.221 1.00 0.00 N ATOM 935 CA VAL A 143 26.659 -11.629 -11.376 1.00 0.00 C ATOM 936 C VAL A 143 25.717 -11.052 -10.335 1.00 0.00 C ATOM 937 O VAL A 143 24.552 -10.773 -10.626 1.00 0.00 O ATOM 938 CB VAL A 143 26.697 -13.154 -11.252 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.298 -13.538 -9.902 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.273 -13.710 -11.347 1.00 0.00 C ATOM 0 H VAL A 143 28.700 -11.746 -10.903 1.00 0.00 H new ATOM 0 HA VAL A 143 26.292 -11.360 -12.366 1.00 0.00 H new ATOM 0 HB VAL A 143 27.305 -13.568 -12.056 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.326 -14.624 -9.812 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.311 -13.142 -9.829 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.687 -13.123 -9.100 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.300 -14.796 -11.259 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.666 -13.295 -10.542 1.00 0.00 H new ATOM 0 HG23 VAL A 143 24.838 -13.435 -12.308 1.00 0.00 H new ATOM 950 N ALA A 144 26.221 -10.878 -9.118 1.00 0.00 N ATOM 951 CA ALA A 144 25.410 -10.339 -8.036 1.00 0.00 C ATOM 952 C ALA A 144 24.991 -8.905 -8.334 1.00 0.00 C ATOM 953 O ALA A 144 23.823 -8.552 -8.202 1.00 0.00 O ATOM 954 CB ALA A 144 26.207 -10.374 -6.727 1.00 0.00 C ATOM 0 H ALA A 144 27.182 -11.101 -8.858 1.00 0.00 H new ATOM 0 HA ALA A 144 24.514 -10.952 -7.941 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.597 -9.970 -5.919 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.481 -11.403 -6.495 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.110 -9.774 -6.835 1.00 0.00 H new ATOM 960 N PHE A 145 25.955 -8.085 -8.736 1.00 0.00 N ATOM 961 CA PHE A 145 25.678 -6.689 -9.042 1.00 0.00 C ATOM 962 C PHE A 145 24.638 -6.571 -10.143 1.00 0.00 C ATOM 963 O PHE A 145 23.721 -5.758 -10.048 1.00 0.00 O ATOM 964 CB PHE A 145 26.963 -5.981 -9.477 1.00 0.00 C ATOM 965 CG PHE A 145 26.659 -4.540 -9.812 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.110 -4.216 -11.059 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.922 -3.529 -8.879 1.00 0.00 C ATOM 968 CE1 PHE A 145 25.827 -2.882 -11.374 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.639 -2.195 -9.195 1.00 0.00 C ATOM 970 CZ PHE A 145 26.090 -1.871 -10.442 1.00 0.00 C ATOM 0 H PHE A 145 26.929 -8.361 -8.857 1.00 0.00 H new ATOM 0 HA PHE A 145 25.288 -6.217 -8.140 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.705 -6.031 -8.680 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.392 -6.484 -10.344 1.00 0.00 H new ATOM 0 HD1 PHE A 145 25.905 -4.996 -11.778 1.00 0.00 H new ATOM 0 HD2 PHE A 145 27.343 -3.779 -7.916 1.00 0.00 H new ATOM 0 HE1 PHE A 145 25.406 -2.632 -12.337 1.00 0.00 H new ATOM 0 HE2 PHE A 145 26.844 -1.415 -8.477 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.870 -0.842 -10.684 1.00 0.00 H new ATOM 980 N MET A 146 24.790 -7.377 -11.187 1.00 0.00 N ATOM 981 CA MET A 146 23.862 -7.342 -12.311 1.00 0.00 C ATOM 982 C MET A 146 22.447 -7.682 -11.858 1.00 0.00 C ATOM 983 O MET A 146 21.474 -7.093 -12.330 1.00 0.00 O ATOM 984 CB MET A 146 24.304 -8.336 -13.386 1.00 0.00 C ATOM 985 CG MET A 146 23.364 -8.237 -14.588 1.00 0.00 C ATOM 986 SD MET A 146 23.999 -9.266 -15.935 1.00 0.00 S ATOM 987 CE MET A 146 23.790 -10.869 -15.123 1.00 0.00 C ATOM 0 H MET A 146 25.543 -8.059 -11.279 1.00 0.00 H new ATOM 0 HA MET A 146 23.865 -6.332 -12.722 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.328 -8.124 -13.693 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.294 -9.350 -12.985 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.362 -8.563 -14.308 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.282 -7.200 -14.915 1.00 0.00 H new ATOM 0 HE1 MET A 146 23.673 -11.647 -15.878 1.00 0.00 H new ATOM 0 HE2 MET A 146 24.667 -11.085 -14.512 1.00 0.00 H new ATOM 0 HE3 MET A 146 22.904 -10.843 -14.489 1.00 0.00 H new ATOM 997 N SER A 147 22.341 -8.633 -10.936 1.00 0.00 N ATOM 998 CA SER A 147 21.041 -9.039 -10.416 1.00 0.00 C ATOM 999 C SER A 147 20.415 -7.925 -9.592 1.00 0.00 C ATOM 1000 O SER A 147 19.211 -7.675 -9.671 1.00 0.00 O ATOM 1001 CB SER A 147 21.195 -10.284 -9.555 1.00 0.00 C ATOM 1002 OG SER A 147 19.924 -10.900 -9.386 1.00 0.00 O ATOM 0 H SER A 147 23.134 -9.134 -10.536 1.00 0.00 H new ATOM 0 HA SER A 147 20.387 -9.256 -11.261 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.890 -10.981 -10.024 1.00 0.00 H new ATOM 0 HB3 SER A 147 21.615 -10.019 -8.585 1.00 0.00 H new ATOM 0 HG SER A 147 19.824 -11.195 -8.457 1.00 0.00 H new ATOM 1008 N ILE A 148 21.242 -7.269 -8.791 1.00 0.00 N ATOM 1009 CA ILE A 148 20.767 -6.191 -7.928 1.00 0.00 C ATOM 1010 C ILE A 148 20.096 -5.093 -8.740 1.00 0.00 C ATOM 1011 O ILE A 148 19.049 -4.579 -8.344 1.00 0.00 O ATOM 1012 CB ILE A 148 21.947 -5.598 -7.151 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.438 -6.604 -6.103 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.519 -4.306 -6.446 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.797 -6.156 -5.545 1.00 0.00 C ATOM 0 H ILE A 148 22.241 -7.461 -8.719 1.00 0.00 H new ATOM 0 HA ILE A 148 20.034 -6.606 -7.236 1.00 0.00 H new ATOM 0 HB ILE A 148 22.751 -5.377 -7.853 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.711 -6.684 -5.294 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.527 -7.594 -6.550 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.365 -3.893 -5.897 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.180 -3.582 -7.187 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.707 -4.522 -5.752 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.140 -6.875 -4.801 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.523 -6.099 -6.356 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.694 -5.175 -5.081 1.00 0.00 H new ATOM 1027 N LYS A 149 20.690 -4.728 -9.866 1.00 0.00 N ATOM 1028 CA LYS A 149 20.121 -3.681 -10.705 1.00 0.00 C ATOM 1029 C LYS A 149 19.009 -4.240 -11.588 1.00 0.00 C ATOM 1030 O LYS A 149 18.105 -3.513 -11.999 1.00 0.00 O ATOM 1031 CB LYS A 149 21.214 -3.078 -11.583 1.00 0.00 C ATOM 1032 CG LYS A 149 21.901 -4.183 -12.394 1.00 0.00 C ATOM 1033 CD LYS A 149 22.790 -3.559 -13.477 1.00 0.00 C ATOM 1034 CE LYS A 149 21.954 -3.263 -14.727 1.00 0.00 C ATOM 1035 NZ LYS A 149 22.844 -2.798 -15.819 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.556 -5.135 -10.218 1.00 0.00 H new ATOM 0 HA LYS A 149 19.699 -2.911 -10.059 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.784 -2.335 -12.255 1.00 0.00 H new ATOM 0 HB3 LYS A 149 21.946 -2.561 -10.963 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.501 -4.810 -11.735 1.00 0.00 H new ATOM 0 HG3 LYS A 149 21.152 -4.828 -12.853 1.00 0.00 H new ATOM 0 HD2 LYS A 149 23.242 -2.640 -13.104 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.606 -4.237 -13.726 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.416 -4.159 -15.038 1.00 0.00 H new ATOM 0 HE3 LYS A 149 21.205 -2.503 -14.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 22.277 -2.597 -16.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 23.338 -1.933 -15.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.542 -3.538 -16.037 1.00 0.00 H new