USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=20 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+ 163:sc= -0.0305 (180deg=-0.368) USER MOD Single : A 85 ASN : amide:sc= -1.25! K(o=-1.3!,f=-0.07) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ -161:sc= -0.0135 (180deg=-0.361) USER MOD Single : A 95 SER OG : rot -44:sc= 0.118 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.384 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc=-0.00435 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.175 K(o=-0.17,f=-0.86) USER MOD Single : A 113 THR OG1 : rot -20:sc= 0.377 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 80:sc= -0.864 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 180:sc= -0.0116 USER MOD Single : A 131 LYS NZ :NH3+ 142:sc= -0.985 (180deg=-1.95!) 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+ 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 -81:sc= -2.05! USER MOD Single : A 142 LYS NZ :NH3+ -161:sc= -0.183 (180deg=-0.725) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 79:sc= 0.983 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.604 -0.560 -6.571 1.00 0.00 N ATOM 17 CA ALA A 82 35.339 -1.851 -5.965 1.00 0.00 C ATOM 18 C ALA A 82 33.862 -1.964 -5.621 1.00 0.00 C ATOM 19 O ALA A 82 33.414 -1.492 -4.576 1.00 0.00 O ATOM 20 CB ALA A 82 36.180 -2.014 -4.704 1.00 0.00 C ATOM 0 HA ALA A 82 35.602 -2.638 -6.671 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.976 -2.986 -4.254 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.237 -1.948 -4.961 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.929 -1.226 -3.995 1.00 0.00 H new ATOM 26 N TYR A 83 33.119 -2.600 -6.510 1.00 0.00 N ATOM 27 CA TYR A 83 31.687 -2.788 -6.319 1.00 0.00 C ATOM 28 C TYR A 83 31.419 -3.301 -4.908 1.00 0.00 C ATOM 29 O TYR A 83 30.292 -3.254 -4.419 1.00 0.00 O ATOM 30 CB TYR A 83 31.145 -3.788 -7.353 1.00 0.00 C ATOM 31 CG TYR A 83 31.856 -3.592 -8.675 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.963 -2.310 -9.229 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.411 -4.692 -9.347 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.625 -2.127 -10.450 1.00 0.00 C ATOM 35 CE2 TYR A 83 33.072 -4.506 -10.567 1.00 0.00 C ATOM 36 CZ TYR A 83 33.178 -3.225 -11.117 1.00 0.00 C ATOM 37 OH TYR A 83 33.830 -3.042 -12.320 1.00 0.00 O ATOM 0 H TYR A 83 33.484 -2.997 -7.376 1.00 0.00 H new ATOM 0 HA TYR A 83 31.181 -1.832 -6.454 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.292 -4.808 -6.998 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.072 -3.647 -7.482 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.535 -1.462 -8.715 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.328 -5.682 -8.923 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.708 -1.138 -10.876 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.500 -5.352 -11.083 1.00 0.00 H new ATOM 0 HH TYR A 83 34.156 -3.905 -12.650 1.00 0.00 H new ATOM 47 N LYS A 84 32.472 -3.787 -4.265 1.00 0.00 N ATOM 48 CA LYS A 84 32.344 -4.301 -2.909 1.00 0.00 C ATOM 49 C LYS A 84 31.938 -3.177 -1.968 1.00 0.00 C ATOM 50 O LYS A 84 31.098 -3.360 -1.086 1.00 0.00 O ATOM 51 CB LYS A 84 33.668 -4.916 -2.447 1.00 0.00 C ATOM 52 CG LYS A 84 33.947 -6.181 -3.259 1.00 0.00 C ATOM 53 CD LYS A 84 35.270 -6.799 -2.802 1.00 0.00 C ATOM 54 CE LYS A 84 35.516 -8.105 -3.560 1.00 0.00 C ATOM 55 NZ LYS A 84 35.686 -7.812 -5.011 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.413 -3.836 -4.655 1.00 0.00 H new ATOM 0 HA LYS A 84 31.576 -5.074 -2.897 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.480 -4.200 -2.577 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.620 -5.155 -1.385 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.135 -6.896 -3.128 1.00 0.00 H new ATOM 0 HG3 LYS A 84 33.993 -5.941 -4.321 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.089 -6.103 -2.982 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.243 -6.989 -1.729 1.00 0.00 H new ATOM 0 HE2 LYS A 84 36.405 -8.602 -3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 84 34.679 -8.788 -3.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 36.130 -8.627 -5.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 34.756 -7.630 -5.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 36.291 -6.974 -5.127 1.00 0.00 H new ATOM 69 N ASN A 85 32.556 -2.019 -2.159 1.00 0.00 N ATOM 70 CA ASN A 85 32.263 -0.867 -1.312 1.00 0.00 C ATOM 71 C ASN A 85 30.817 -0.424 -1.480 1.00 0.00 C ATOM 72 O ASN A 85 30.118 -0.171 -0.503 1.00 0.00 O ATOM 73 CB ASN A 85 33.192 0.295 -1.657 1.00 0.00 C ATOM 74 CG ASN A 85 34.611 -0.018 -1.198 1.00 0.00 C ATOM 75 OD1 ASN A 85 35.575 0.371 -1.857 1.00 0.00 O ATOM 76 ND2 ASN A 85 34.799 -0.694 -0.097 1.00 0.00 N ATOM 0 H ASN A 85 33.255 -1.851 -2.883 1.00 0.00 H new ATOM 0 HA ASN A 85 32.423 -1.164 -0.276 1.00 0.00 H new ATOM 0 HB2 ASN A 85 33.180 0.474 -2.732 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.839 1.208 -1.178 1.00 0.00 H new ATOM 0 HD21 ASN A 85 35.747 -0.901 0.219 1.00 0.00 H new ATOM 0 HD22 ASN A 85 33.998 -1.015 0.447 1.00 0.00 H new ATOM 83 N LEU A 86 30.376 -0.331 -2.722 1.00 0.00 N ATOM 84 CA LEU A 86 29.011 0.089 -3.007 1.00 0.00 C ATOM 85 C LEU A 86 28.016 -0.901 -2.426 1.00 0.00 C ATOM 86 O LEU A 86 26.974 -0.511 -1.900 1.00 0.00 O ATOM 87 CB LEU A 86 28.814 0.190 -4.514 1.00 0.00 C ATOM 88 CG LEU A 86 27.386 0.709 -4.850 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.444 1.694 -6.028 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.464 -0.461 -5.238 1.00 0.00 C ATOM 0 H LEU A 86 30.938 -0.539 -3.547 1.00 0.00 H new ATOM 0 HA LEU A 86 28.840 1.063 -2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.560 0.862 -4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.968 -0.787 -4.972 1.00 0.00 H new ATOM 0 HG LEU A 86 26.993 1.208 -3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.439 2.050 -6.254 1.00 0.00 H new ATOM 0 HD12 LEU A 86 28.078 2.540 -5.764 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.856 1.191 -6.903 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.470 -0.079 -5.470 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.870 -0.970 -6.112 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.398 -1.164 -4.407 1.00 0.00 H new ATOM 102 N LEU A 87 28.340 -2.183 -2.529 1.00 0.00 N ATOM 103 CA LEU A 87 27.460 -3.223 -2.014 1.00 0.00 C ATOM 104 C LEU A 87 27.219 -2.995 -0.529 1.00 0.00 C ATOM 105 O LEU A 87 26.110 -3.178 -0.030 1.00 0.00 O ATOM 106 CB LEU A 87 28.093 -4.599 -2.243 1.00 0.00 C ATOM 107 CG LEU A 87 27.881 -5.035 -3.701 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.774 -6.244 -4.005 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.399 -5.402 -3.957 1.00 0.00 C ATOM 0 H LEU A 87 29.198 -2.526 -2.961 1.00 0.00 H new ATOM 0 HA LEU A 87 26.506 -3.185 -2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.159 -4.561 -2.017 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.649 -5.330 -1.567 1.00 0.00 H new ATOM 0 HG LEU A 87 28.146 -4.205 -4.356 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.625 -6.555 -5.039 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.819 -5.972 -3.855 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.514 -7.066 -3.338 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.274 -5.707 -4.996 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.109 -6.222 -3.300 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.769 -4.535 -3.755 1.00 0.00 H new ATOM 121 N GLN A 88 28.266 -2.582 0.167 1.00 0.00 N ATOM 122 CA GLN A 88 28.154 -2.312 1.590 1.00 0.00 C ATOM 123 C GLN A 88 27.299 -1.070 1.837 1.00 0.00 C ATOM 124 O GLN A 88 26.571 -0.999 2.826 1.00 0.00 O ATOM 125 CB GLN A 88 29.537 -2.105 2.201 1.00 0.00 C ATOM 126 CG GLN A 88 30.314 -3.419 2.163 1.00 0.00 C ATOM 127 CD GLN A 88 31.706 -3.221 2.749 1.00 0.00 C ATOM 128 OE1 GLN A 88 31.854 -2.619 3.811 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.741 -3.702 2.119 1.00 0.00 N ATOM 0 H GLN A 88 29.194 -2.428 -0.226 1.00 0.00 H new ATOM 0 HA GLN A 88 27.676 -3.171 2.061 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.078 -1.335 1.651 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.443 -1.756 3.229 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.779 -4.183 2.727 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.391 -3.776 1.136 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.615 -4.201 1.238 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.676 -3.579 2.507 1.00 0.00 H new ATOM 138 N GLU A 89 27.399 -0.085 0.943 1.00 0.00 N ATOM 139 CA GLU A 89 26.633 1.154 1.104 1.00 0.00 C ATOM 140 C GLU A 89 25.132 0.885 1.048 1.00 0.00 C ATOM 141 O GLU A 89 24.376 1.344 1.903 1.00 0.00 O ATOM 142 CB GLU A 89 27.008 2.142 0.002 1.00 0.00 C ATOM 143 CG GLU A 89 28.440 2.634 0.216 1.00 0.00 C ATOM 144 CD GLU A 89 28.865 3.516 -0.952 1.00 0.00 C ATOM 145 OE1 GLU A 89 28.040 3.754 -1.818 1.00 0.00 O ATOM 146 OE2 GLU A 89 30.010 3.936 -0.966 1.00 0.00 O1- ATOM 0 H GLU A 89 27.992 -0.118 0.113 1.00 0.00 H new ATOM 0 HA GLU A 89 26.875 1.575 2.080 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.919 1.664 -0.974 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.319 2.986 0.007 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.506 3.194 1.149 1.00 0.00 H new ATOM 0 HG3 GLU A 89 29.116 1.784 0.306 1.00 0.00 H new ATOM 153 N ILE A 90 24.708 0.138 0.036 1.00 0.00 N ATOM 154 CA ILE A 90 23.295 -0.188 -0.126 1.00 0.00 C ATOM 155 C ILE A 90 22.816 -1.085 1.009 1.00 0.00 C ATOM 156 O ILE A 90 21.671 -0.993 1.440 1.00 0.00 O ATOM 157 CB ILE A 90 23.072 -0.876 -1.476 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.977 -2.101 -1.572 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.414 0.093 -2.609 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.718 -2.833 -2.890 1.00 0.00 C ATOM 0 H ILE A 90 25.318 -0.252 -0.682 1.00 0.00 H new ATOM 0 HA ILE A 90 22.718 0.736 -0.097 1.00 0.00 H new ATOM 0 HB ILE A 90 22.029 -1.180 -1.560 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.022 -1.798 -1.513 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.791 -2.769 -0.731 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.255 -0.399 -3.569 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.774 0.973 -2.541 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.458 0.396 -2.526 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.366 -3.707 -2.954 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.676 -3.150 -2.931 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.927 -2.164 -3.725 1.00 0.00 H new ATOM 172 N ALA A 91 23.693 -1.964 1.477 1.00 0.00 N ATOM 173 CA ALA A 91 23.330 -2.878 2.553 1.00 0.00 C ATOM 174 C ALA A 91 22.826 -2.106 3.768 1.00 0.00 C ATOM 175 O ALA A 91 21.774 -2.424 4.322 1.00 0.00 O ATOM 176 CB ALA A 91 24.539 -3.726 2.953 1.00 0.00 C ATOM 0 H ALA A 91 24.649 -2.064 1.134 1.00 0.00 H new ATOM 0 HA ALA A 91 22.533 -3.529 2.193 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.257 -4.405 3.757 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.879 -4.303 2.093 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.344 -3.074 3.294 1.00 0.00 H new ATOM 182 N GLN A 92 23.581 -1.093 4.177 1.00 0.00 N ATOM 183 CA GLN A 92 23.199 -0.287 5.330 1.00 0.00 C ATOM 184 C GLN A 92 21.947 0.535 5.028 1.00 0.00 C ATOM 185 O GLN A 92 21.043 0.627 5.856 1.00 0.00 O ATOM 186 CB GLN A 92 24.348 0.648 5.714 1.00 0.00 C ATOM 187 CG GLN A 92 23.983 1.424 6.985 1.00 0.00 C ATOM 188 CD GLN A 92 25.129 2.346 7.380 1.00 0.00 C ATOM 189 OE1 GLN A 92 25.509 3.233 6.614 1.00 0.00 O ATOM 190 NE2 GLN A 92 25.705 2.193 8.541 1.00 0.00 N ATOM 0 H GLN A 92 24.454 -0.812 3.731 1.00 0.00 H new ATOM 0 HA GLN A 92 22.981 -0.958 6.161 1.00 0.00 H new ATOM 0 HB2 GLN A 92 25.259 0.072 5.878 1.00 0.00 H new ATOM 0 HB3 GLN A 92 24.552 1.342 4.899 1.00 0.00 H new ATOM 0 HG2 GLN A 92 23.078 2.007 6.817 1.00 0.00 H new ATOM 0 HG3 GLN A 92 23.769 0.729 7.797 1.00 0.00 H new ATOM 0 HE21 GLN A 92 25.389 1.458 9.174 1.00 0.00 H new ATOM 0 HE22 GLN A 92 26.471 2.808 8.815 1.00 0.00 H new ATOM 199 N LYS A 93 21.902 1.134 3.841 1.00 0.00 N ATOM 200 CA LYS A 93 20.754 1.952 3.460 1.00 0.00 C ATOM 201 C LYS A 93 19.484 1.109 3.425 1.00 0.00 C ATOM 202 O LYS A 93 18.454 1.493 3.982 1.00 0.00 O ATOM 203 CB LYS A 93 20.995 2.570 2.080 1.00 0.00 C ATOM 204 CG LYS A 93 19.841 3.511 1.728 1.00 0.00 C ATOM 205 CD LYS A 93 20.122 4.185 0.384 1.00 0.00 C ATOM 206 CE LYS A 93 18.982 5.149 0.050 1.00 0.00 C ATOM 207 NZ LYS A 93 17.728 4.377 -0.180 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.636 1.070 3.135 1.00 0.00 H new ATOM 0 HA LYS A 93 20.631 2.743 4.200 1.00 0.00 H new ATOM 0 HB2 LYS A 93 21.938 3.117 2.076 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.079 1.785 1.329 1.00 0.00 H new ATOM 0 HG2 LYS A 93 18.906 2.953 1.678 1.00 0.00 H new ATOM 0 HG3 LYS A 93 19.722 4.264 2.507 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.068 4.724 0.426 1.00 0.00 H new ATOM 0 HD3 LYS A 93 20.218 3.433 -0.399 1.00 0.00 H new ATOM 0 HE2 LYS A 93 18.841 5.858 0.866 1.00 0.00 H new ATOM 0 HE3 LYS A 93 19.232 5.730 -0.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 17.051 4.964 -0.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 17.944 3.520 -0.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 17.313 4.108 0.735 1.00 0.00 H new ATOM 221 N GLU A 94 19.566 -0.037 2.766 1.00 0.00 N ATOM 222 CA GLU A 94 18.422 -0.935 2.652 1.00 0.00 C ATOM 223 C GLU A 94 18.211 -1.702 3.953 1.00 0.00 C ATOM 224 O GLU A 94 17.322 -2.548 4.049 1.00 0.00 O ATOM 225 CB GLU A 94 18.648 -1.924 1.503 1.00 0.00 C ATOM 226 CG GLU A 94 18.728 -1.165 0.174 1.00 0.00 C ATOM 227 CD GLU A 94 17.387 -0.510 -0.141 1.00 0.00 C ATOM 228 OE1 GLU A 94 16.394 -0.938 0.424 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.374 0.411 -0.940 1.00 0.00 O1- ATOM 0 H GLU A 94 20.411 -0.369 2.302 1.00 0.00 H new ATOM 0 HA GLU A 94 17.533 -0.338 2.448 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.568 -2.484 1.669 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.835 -2.649 1.470 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.508 -0.406 0.227 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.004 -1.850 -0.628 1.00 0.00 H new ATOM 236 N SER A 95 19.033 -1.399 4.952 1.00 0.00 N ATOM 237 CA SER A 95 18.922 -2.065 6.246 1.00 0.00 C ATOM 238 C SER A 95 19.227 -3.556 6.116 1.00 0.00 C ATOM 239 O SER A 95 19.048 -4.319 7.064 1.00 0.00 O ATOM 240 CB SER A 95 17.513 -1.871 6.812 1.00 0.00 C ATOM 241 OG SER A 95 17.540 -2.075 8.219 1.00 0.00 O ATOM 0 H SER A 95 19.777 -0.704 4.893 1.00 0.00 H new ATOM 0 HA SER A 95 19.650 -1.621 6.925 1.00 0.00 H new ATOM 0 HB2 SER A 95 17.152 -0.868 6.585 1.00 0.00 H new ATOM 0 HB3 SER A 95 16.821 -2.572 6.345 1.00 0.00 H new ATOM 0 HG SER A 95 18.082 -2.865 8.425 1.00 0.00 H new ATOM 247 N SER A 96 19.691 -3.962 4.939 1.00 0.00 N ATOM 248 CA SER A 96 20.022 -5.364 4.703 1.00 0.00 C ATOM 249 C SER A 96 21.335 -5.723 5.387 1.00 0.00 C ATOM 250 O SER A 96 22.145 -4.847 5.693 1.00 0.00 O ATOM 251 CB SER A 96 20.129 -5.633 3.200 1.00 0.00 C ATOM 252 OG SER A 96 18.823 -5.695 2.641 1.00 0.00 O ATOM 0 H SER A 96 19.846 -3.347 4.140 1.00 0.00 H new ATOM 0 HA SER A 96 19.228 -5.982 5.121 1.00 0.00 H new ATOM 0 HB2 SER A 96 20.707 -4.844 2.718 1.00 0.00 H new ATOM 0 HB3 SER A 96 20.658 -6.569 3.023 1.00 0.00 H new ATOM 0 HG SER A 96 18.887 -5.865 1.678 1.00 0.00 H new ATOM 258 N LEU A 97 21.539 -7.014 5.638 1.00 0.00 N ATOM 259 CA LEU A 97 22.755 -7.469 6.299 1.00 0.00 C ATOM 260 C LEU A 97 23.956 -7.295 5.379 1.00 0.00 C ATOM 261 O LEU A 97 23.920 -7.679 4.210 1.00 0.00 O ATOM 262 CB LEU A 97 22.614 -8.944 6.692 1.00 0.00 C ATOM 263 CG LEU A 97 21.757 -9.063 7.956 1.00 0.00 C ATOM 264 CD1 LEU A 97 20.380 -8.440 7.703 1.00 0.00 C ATOM 265 CD2 LEU A 97 21.597 -10.541 8.321 1.00 0.00 C ATOM 0 H LEU A 97 20.883 -7.756 5.395 1.00 0.00 H new ATOM 0 HA LEU A 97 22.909 -6.869 7.196 1.00 0.00 H new ATOM 0 HB2 LEU A 97 22.157 -9.505 5.877 1.00 0.00 H new ATOM 0 HB3 LEU A 97 23.598 -9.379 6.866 1.00 0.00 H new ATOM 0 HG LEU A 97 22.242 -8.537 8.778 1.00 0.00 H new ATOM 0 HD11 LEU A 97 19.771 -8.525 8.603 1.00 0.00 H new ATOM 0 HD12 LEU A 97 20.499 -7.388 7.444 1.00 0.00 H new ATOM 0 HD13 LEU A 97 19.889 -8.963 6.882 1.00 0.00 H new ATOM 0 HD21 LEU A 97 20.988 -10.630 9.220 1.00 0.00 H new ATOM 0 HD22 LEU A 97 21.111 -11.068 7.500 1.00 0.00 H new ATOM 0 HD23 LEU A 97 22.578 -10.979 8.503 1.00 0.00 H new ATOM 277 N LEU A 98 25.015 -6.707 5.919 1.00 0.00 N ATOM 278 CA LEU A 98 26.222 -6.478 5.142 1.00 0.00 C ATOM 279 C LEU A 98 26.604 -7.738 4.354 1.00 0.00 C ATOM 280 O LEU A 98 26.360 -8.857 4.809 1.00 0.00 O ATOM 281 CB LEU A 98 27.383 -6.070 6.062 1.00 0.00 C ATOM 282 CG LEU A 98 27.256 -4.591 6.434 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.945 -4.363 7.191 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.441 -4.187 7.315 1.00 0.00 C ATOM 0 H LEU A 98 25.062 -6.383 6.885 1.00 0.00 H new ATOM 0 HA LEU A 98 26.024 -5.669 4.439 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.377 -6.683 6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.335 -6.248 5.562 1.00 0.00 H new ATOM 0 HG LEU A 98 27.255 -3.985 5.528 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.856 -3.309 7.455 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.105 -4.651 6.559 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.939 -4.966 8.099 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.354 -3.134 7.582 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.443 -4.792 8.222 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.371 -4.347 6.770 1.00 0.00 H new ATOM 296 N PRO A 99 27.200 -7.581 3.196 1.00 0.00 N ATOM 297 CA PRO A 99 27.629 -8.732 2.342 1.00 0.00 C ATOM 298 C PRO A 99 28.854 -9.447 2.917 1.00 0.00 C ATOM 299 O PRO A 99 29.750 -8.806 3.465 1.00 0.00 O ATOM 300 CB PRO A 99 27.953 -8.064 0.998 1.00 0.00 C ATOM 301 CG PRO A 99 28.395 -6.686 1.365 1.00 0.00 C ATOM 302 CD PRO A 99 27.545 -6.289 2.571 1.00 0.00 C ATOM 0 HA PRO A 99 26.867 -9.508 2.267 1.00 0.00 H new ATOM 0 HB2 PRO A 99 28.736 -8.603 0.465 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.080 -8.041 0.345 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.457 -6.667 1.611 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.247 -5.993 0.536 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.098 -5.647 3.257 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.653 -5.739 2.269 1.00 0.00 H new ATOM 310 N PHE A 100 28.897 -10.776 2.795 1.00 0.00 N ATOM 311 CA PHE A 100 30.020 -11.552 3.304 1.00 0.00 C ATOM 312 C PHE A 100 30.576 -12.383 2.172 1.00 0.00 C ATOM 313 O PHE A 100 29.837 -13.095 1.494 1.00 0.00 O ATOM 314 CB PHE A 100 29.551 -12.463 4.442 1.00 0.00 C ATOM 315 CG PHE A 100 30.707 -13.304 4.921 1.00 0.00 C ATOM 316 CD1 PHE A 100 31.680 -12.739 5.749 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.806 -14.646 4.535 1.00 0.00 C ATOM 318 CE1 PHE A 100 32.756 -13.515 6.194 1.00 0.00 C ATOM 319 CE2 PHE A 100 31.881 -15.422 4.979 1.00 0.00 C ATOM 320 CZ PHE A 100 32.857 -14.858 5.808 1.00 0.00 C ATOM 0 H PHE A 100 28.167 -11.332 2.349 1.00 0.00 H new ATOM 0 HA PHE A 100 30.791 -10.886 3.691 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.158 -11.864 5.264 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.739 -13.104 4.098 1.00 0.00 H new ATOM 0 HD1 PHE A 100 31.602 -11.703 6.046 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.053 -15.081 3.895 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.508 -13.079 6.835 1.00 0.00 H new ATOM 0 HE2 PHE A 100 31.958 -16.457 4.682 1.00 0.00 H new ATOM 0 HZ PHE A 100 33.688 -15.458 6.150 1.00 0.00 H new ATOM 330 N TYR A 101 31.877 -12.279 1.948 1.00 0.00 N ATOM 331 CA TYR A 101 32.506 -13.019 0.866 1.00 0.00 C ATOM 332 C TYR A 101 33.127 -14.308 1.397 1.00 0.00 C ATOM 333 O TYR A 101 33.624 -14.346 2.520 1.00 0.00 O ATOM 334 CB TYR A 101 33.597 -12.163 0.219 1.00 0.00 C ATOM 335 CG TYR A 101 32.991 -10.884 -0.304 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.910 -9.764 0.530 1.00 0.00 C ATOM 337 CD2 TYR A 101 32.507 -10.817 -1.616 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.342 -8.577 0.054 1.00 0.00 C ATOM 339 CE2 TYR A 101 31.942 -9.628 -2.092 1.00 0.00 C ATOM 340 CZ TYR A 101 31.858 -8.510 -1.256 1.00 0.00 C ATOM 341 OH TYR A 101 31.296 -7.339 -1.722 1.00 0.00 O ATOM 0 H TYR A 101 32.511 -11.696 2.494 1.00 0.00 H new ATOM 0 HA TYR A 101 31.746 -13.267 0.125 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.376 -11.937 0.947 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.070 -12.713 -0.595 1.00 0.00 H new ATOM 0 HD1 TYR A 101 33.286 -9.815 1.541 1.00 0.00 H new ATOM 0 HD2 TYR A 101 32.569 -11.682 -2.260 1.00 0.00 H new ATOM 0 HE1 TYR A 101 32.277 -7.713 0.698 1.00 0.00 H new ATOM 0 HE2 TYR A 101 31.571 -9.574 -3.105 1.00 0.00 H new ATOM 0 HH TYR A 101 31.011 -7.460 -2.652 1.00 0.00 H new ATOM 351 N ALA A 102 33.103 -15.359 0.581 1.00 0.00 N ATOM 352 CA ALA A 102 33.674 -16.646 0.979 1.00 0.00 C ATOM 353 C ALA A 102 34.357 -17.310 -0.209 1.00 0.00 C ATOM 354 O ALA A 102 33.884 -17.213 -1.341 1.00 0.00 O ATOM 355 CB ALA A 102 32.575 -17.565 1.513 1.00 0.00 C ATOM 0 H ALA A 102 32.697 -15.347 -0.355 1.00 0.00 H new ATOM 0 HA ALA A 102 34.411 -16.470 1.763 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.010 -18.520 1.806 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.101 -17.101 2.378 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.829 -17.730 0.736 1.00 0.00 H new ATOM 361 N THR A 103 35.471 -17.990 0.058 1.00 0.00 N ATOM 362 CA THR A 103 36.227 -18.681 -0.989 1.00 0.00 C ATOM 363 C THR A 103 36.428 -20.147 -0.617 1.00 0.00 C ATOM 364 O THR A 103 36.817 -20.463 0.509 1.00 0.00 O ATOM 365 CB THR A 103 37.589 -18.013 -1.182 1.00 0.00 C ATOM 366 OG1 THR A 103 37.398 -16.661 -1.576 1.00 0.00 O ATOM 367 CG2 THR A 103 38.380 -18.755 -2.265 1.00 0.00 C ATOM 0 H THR A 103 35.872 -18.078 0.992 1.00 0.00 H new ATOM 0 HA THR A 103 35.661 -18.623 -1.919 1.00 0.00 H new ATOM 0 HB THR A 103 38.145 -18.046 -0.245 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.269 -16.230 -1.699 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.350 -18.276 -2.400 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.526 -19.792 -1.963 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.827 -18.725 -3.204 1.00 0.00 H new ATOM 375 N ALA A 104 36.169 -21.044 -1.570 1.00 0.00 N ATOM 376 CA ALA A 104 36.328 -22.484 -1.340 1.00 0.00 C ATOM 377 C ALA A 104 37.212 -23.095 -2.422 1.00 0.00 C ATOM 378 O ALA A 104 37.267 -22.592 -3.545 1.00 0.00 O ATOM 379 CB ALA A 104 34.955 -23.160 -1.346 1.00 0.00 C ATOM 0 H ALA A 104 35.849 -20.801 -2.507 1.00 0.00 H new ATOM 0 HA ALA A 104 36.802 -22.639 -0.371 1.00 0.00 H new ATOM 0 HB1 ALA A 104 35.075 -24.230 -1.175 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.336 -22.734 -0.556 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.474 -22.999 -2.311 1.00 0.00 H new ATOM 385 N THR A 105 37.904 -24.184 -2.083 1.00 0.00 N ATOM 386 CA THR A 105 38.783 -24.859 -3.020 1.00 0.00 C ATOM 387 C THR A 105 38.171 -26.187 -3.450 1.00 0.00 C ATOM 388 O THR A 105 37.664 -26.944 -2.624 1.00 0.00 O ATOM 389 CB THR A 105 40.121 -25.111 -2.336 1.00 0.00 C ATOM 390 OG1 THR A 105 39.949 -26.087 -1.318 1.00 0.00 O ATOM 391 CG2 THR A 105 40.650 -23.810 -1.718 1.00 0.00 C ATOM 0 H THR A 105 37.867 -24.614 -1.159 1.00 0.00 H new ATOM 0 HA THR A 105 38.923 -24.237 -3.904 1.00 0.00 H new ATOM 0 HB THR A 105 40.840 -25.470 -3.073 1.00 0.00 H new ATOM 0 HG1 THR A 105 40.808 -26.254 -0.876 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.607 -24.001 -1.232 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.784 -23.063 -2.501 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.936 -23.440 -0.982 1.00 0.00 H new ATOM 399 N SER A 106 38.216 -26.460 -4.746 1.00 0.00 N ATOM 400 CA SER A 106 37.658 -27.699 -5.273 1.00 0.00 C ATOM 401 C SER A 106 38.244 -28.006 -6.639 1.00 0.00 C ATOM 402 O SER A 106 38.832 -27.135 -7.282 1.00 0.00 O ATOM 403 CB SER A 106 36.140 -27.585 -5.391 1.00 0.00 C ATOM 404 OG SER A 106 35.817 -26.586 -6.349 1.00 0.00 O ATOM 0 H SER A 106 38.629 -25.846 -5.448 1.00 0.00 H new ATOM 0 HA SER A 106 37.910 -28.506 -4.585 1.00 0.00 H new ATOM 0 HB2 SER A 106 35.714 -28.543 -5.690 1.00 0.00 H new ATOM 0 HB3 SER A 106 35.707 -27.331 -4.424 1.00 0.00 H new ATOM 0 HG SER A 106 34.843 -26.512 -6.428 1.00 0.00 H new ATOM 410 N GLY A 107 38.071 -29.249 -7.085 1.00 0.00 N ATOM 411 CA GLY A 107 38.580 -29.673 -8.391 1.00 0.00 C ATOM 412 C GLY A 107 39.622 -30.780 -8.244 1.00 0.00 C ATOM 413 O GLY A 107 39.874 -31.263 -7.139 1.00 0.00 O ATOM 0 H GLY A 107 37.584 -29.979 -6.565 1.00 0.00 H new ATOM 0 HA2 GLY A 107 37.755 -30.027 -9.009 1.00 0.00 H new ATOM 0 HA3 GLY A 107 39.022 -28.820 -8.907 1.00 0.00 H new ATOM 417 N PRO A 108 40.226 -31.189 -9.336 1.00 0.00 N ATOM 418 CA PRO A 108 41.268 -32.264 -9.334 1.00 0.00 C ATOM 419 C PRO A 108 42.496 -31.884 -8.512 1.00 0.00 C ATOM 420 O PRO A 108 42.826 -30.708 -8.372 1.00 0.00 O ATOM 421 CB PRO A 108 41.638 -32.438 -10.822 1.00 0.00 C ATOM 422 CG PRO A 108 41.198 -31.180 -11.482 1.00 0.00 C ATOM 423 CD PRO A 108 39.987 -30.678 -10.700 1.00 0.00 C ATOM 0 HA PRO A 108 40.894 -33.180 -8.876 1.00 0.00 H new ATOM 0 HB2 PRO A 108 42.710 -32.594 -10.946 1.00 0.00 H new ATOM 0 HB3 PRO A 108 41.138 -33.305 -11.254 1.00 0.00 H new ATOM 0 HG2 PRO A 108 41.997 -30.439 -11.476 1.00 0.00 H new ATOM 0 HG3 PRO A 108 40.938 -31.360 -12.525 1.00 0.00 H new ATOM 0 HD2 PRO A 108 39.921 -29.590 -10.716 1.00 0.00 H new ATOM 0 HD3 PRO A 108 39.054 -31.060 -11.115 1.00 0.00 H new ATOM 431 N SER A 109 43.172 -32.897 -7.984 1.00 0.00 N ATOM 432 CA SER A 109 44.369 -32.667 -7.193 1.00 0.00 C ATOM 433 C SER A 109 45.483 -32.121 -8.079 1.00 0.00 C ATOM 434 O SER A 109 46.464 -31.563 -7.585 1.00 0.00 O ATOM 435 CB SER A 109 44.827 -33.974 -6.543 1.00 0.00 C ATOM 436 OG SER A 109 45.164 -34.912 -7.558 1.00 0.00 O ATOM 0 H SER A 109 42.912 -33.878 -8.089 1.00 0.00 H new ATOM 0 HA SER A 109 44.140 -31.940 -6.414 1.00 0.00 H new ATOM 0 HB2 SER A 109 45.688 -33.791 -5.900 1.00 0.00 H new ATOM 0 HB3 SER A 109 44.036 -34.375 -5.910 1.00 0.00 H new ATOM 0 HG SER A 109 45.459 -35.750 -7.144 1.00 0.00 H new ATOM 442 N HIS A 110 45.328 -32.284 -9.396 1.00 0.00 N ATOM 443 CA HIS A 110 46.330 -31.801 -10.345 1.00 0.00 C ATOM 444 C HIS A 110 46.020 -30.373 -10.753 1.00 0.00 C ATOM 445 O HIS A 110 46.916 -29.530 -10.831 1.00 0.00 O ATOM 446 CB HIS A 110 46.364 -32.695 -11.585 1.00 0.00 C ATOM 447 CG HIS A 110 47.416 -32.192 -12.536 1.00 0.00 C ATOM 448 ND1 HIS A 110 47.150 -31.216 -13.484 1.00 0.00 N ATOM 449 CD2 HIS A 110 48.739 -32.522 -12.701 1.00 0.00 C ATOM 450 CE1 HIS A 110 48.287 -30.993 -14.169 1.00 0.00 C ATOM 451 NE2 HIS A 110 49.286 -31.766 -13.734 1.00 0.00 N ATOM 0 H HIS A 110 44.524 -32.743 -9.825 1.00 0.00 H new ATOM 0 HA HIS A 110 47.306 -31.831 -9.860 1.00 0.00 H new ATOM 0 HB2 HIS A 110 46.579 -33.724 -11.299 1.00 0.00 H new ATOM 0 HB3 HIS A 110 45.389 -32.697 -12.072 1.00 0.00 H new ATOM 0 HD2 HIS A 110 49.274 -33.257 -12.118 1.00 0.00 H new ATOM 0 HE1 HIS A 110 48.380 -30.277 -14.972 1.00 0.00 H new ATOM 0 HE2 HIS A 110 50.244 -31.796 -14.084 1.00 0.00 H new ATOM 459 N ALA A 111 44.738 -30.103 -11.006 1.00 0.00 N ATOM 460 CA ALA A 111 44.299 -28.763 -11.395 1.00 0.00 C ATOM 461 C ALA A 111 43.213 -28.263 -10.432 1.00 0.00 C ATOM 462 O ALA A 111 42.025 -28.273 -10.757 1.00 0.00 O ATOM 463 CB ALA A 111 43.779 -28.775 -12.851 1.00 0.00 C ATOM 0 H ALA A 111 43.988 -30.792 -10.949 1.00 0.00 H new ATOM 0 HA ALA A 111 45.147 -28.081 -11.340 1.00 0.00 H new ATOM 0 HB1 ALA A 111 43.455 -27.772 -13.130 1.00 0.00 H new ATOM 0 HB2 ALA A 111 44.577 -29.098 -13.520 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.938 -29.464 -12.931 1.00 0.00 H new ATOM 469 N PRO A 112 43.601 -27.814 -9.258 1.00 0.00 N ATOM 470 CA PRO A 112 42.639 -27.299 -8.244 1.00 0.00 C ATOM 471 C PRO A 112 42.184 -25.870 -8.544 1.00 0.00 C ATOM 472 O PRO A 112 43.002 -24.970 -8.738 1.00 0.00 O ATOM 473 CB PRO A 112 43.428 -27.382 -6.930 1.00 0.00 C ATOM 474 CG PRO A 112 44.873 -27.258 -7.319 1.00 0.00 C ATOM 475 CD PRO A 112 44.994 -27.751 -8.773 1.00 0.00 C ATOM 0 HA PRO A 112 41.713 -27.873 -8.222 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.136 -26.585 -6.246 1.00 0.00 H new ATOM 0 HB3 PRO A 112 43.239 -28.326 -6.418 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.208 -26.224 -7.234 1.00 0.00 H new ATOM 0 HG3 PRO A 112 45.503 -27.852 -6.657 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.594 -27.068 -9.375 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.476 -28.727 -8.822 1.00 0.00 H new ATOM 483 N THR A 113 40.867 -25.674 -8.567 1.00 0.00 N ATOM 484 CA THR A 113 40.279 -24.361 -8.832 1.00 0.00 C ATOM 485 C THR A 113 39.638 -23.818 -7.567 1.00 0.00 C ATOM 486 O THR A 113 39.557 -24.510 -6.552 1.00 0.00 O ATOM 487 CB THR A 113 39.227 -24.466 -9.941 1.00 0.00 C ATOM 488 OG1 THR A 113 38.137 -25.258 -9.486 1.00 0.00 O ATOM 489 CG2 THR A 113 39.849 -25.115 -11.177 1.00 0.00 C ATOM 0 H THR A 113 40.183 -26.413 -8.404 1.00 0.00 H new ATOM 0 HA THR A 113 41.068 -23.682 -9.156 1.00 0.00 H new ATOM 0 HB THR A 113 38.870 -23.469 -10.198 1.00 0.00 H new ATOM 0 HG1 THR A 113 38.424 -25.803 -8.724 1.00 0.00 H new ATOM 0 HG21 THR A 113 39.100 -25.189 -11.965 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.684 -24.507 -11.526 1.00 0.00 H new ATOM 0 HG23 THR A 113 40.208 -26.112 -10.923 1.00 0.00 H new ATOM 497 N PHE A 114 39.196 -22.567 -7.634 1.00 0.00 N ATOM 498 CA PHE A 114 38.570 -21.917 -6.483 1.00 0.00 C ATOM 499 C PHE A 114 37.250 -21.269 -6.888 1.00 0.00 C ATOM 500 O PHE A 114 37.123 -20.733 -7.990 1.00 0.00 O ATOM 501 CB PHE A 114 39.521 -20.845 -5.932 1.00 0.00 C ATOM 502 CG PHE A 114 40.946 -21.278 -6.171 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.502 -22.303 -5.404 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.706 -20.654 -7.162 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.822 -22.705 -5.626 1.00 0.00 C ATOM 506 CE2 PHE A 114 43.023 -21.050 -7.385 1.00 0.00 C ATOM 507 CZ PHE A 114 43.584 -22.075 -6.616 1.00 0.00 C ATOM 0 H PHE A 114 39.258 -21.983 -8.468 1.00 0.00 H new ATOM 0 HA PHE A 114 38.369 -22.666 -5.717 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.332 -19.889 -6.419 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.346 -20.700 -4.866 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.912 -22.786 -4.639 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.272 -19.863 -7.756 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.253 -23.500 -5.035 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.610 -20.566 -8.151 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.606 -22.380 -6.787 1.00 0.00 H new ATOM 517 N THR A 115 36.272 -21.311 -5.986 1.00 0.00 N ATOM 518 CA THR A 115 34.964 -20.713 -6.246 1.00 0.00 C ATOM 519 C THR A 115 34.621 -19.715 -5.148 1.00 0.00 C ATOM 520 O THR A 115 34.552 -20.074 -3.971 1.00 0.00 O ATOM 521 CB THR A 115 33.894 -21.807 -6.289 1.00 0.00 C ATOM 522 OG1 THR A 115 34.184 -22.708 -7.348 1.00 0.00 O ATOM 523 CG2 THR A 115 32.524 -21.170 -6.513 1.00 0.00 C ATOM 0 H THR A 115 36.360 -21.752 -5.070 1.00 0.00 H new ATOM 0 HA THR A 115 34.996 -20.197 -7.205 1.00 0.00 H new ATOM 0 HB THR A 115 33.887 -22.351 -5.344 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.501 -23.410 -7.376 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.762 -21.948 -6.544 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.306 -20.480 -5.698 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.526 -20.626 -7.458 1.00 0.00 H new ATOM 531 N SER A 116 34.403 -18.462 -5.536 1.00 0.00 N ATOM 532 CA SER A 116 34.064 -17.412 -4.578 1.00 0.00 C ATOM 533 C SER A 116 32.569 -17.121 -4.622 1.00 0.00 C ATOM 534 O SER A 116 32.002 -16.894 -5.691 1.00 0.00 O ATOM 535 CB SER A 116 34.831 -16.135 -4.912 1.00 0.00 C ATOM 536 OG SER A 116 34.272 -15.048 -4.184 1.00 0.00 O ATOM 0 H SER A 116 34.455 -18.148 -6.505 1.00 0.00 H new ATOM 0 HA SER A 116 34.337 -17.753 -3.579 1.00 0.00 H new ATOM 0 HB2 SER A 116 35.885 -16.253 -4.660 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.780 -15.936 -5.982 1.00 0.00 H new ATOM 0 HG SER A 116 34.608 -15.063 -3.264 1.00 0.00 H new ATOM 542 N THR A 117 31.935 -17.133 -3.452 1.00 0.00 N ATOM 543 CA THR A 117 30.500 -16.873 -3.350 1.00 0.00 C ATOM 544 C THR A 117 30.228 -15.813 -2.288 1.00 0.00 C ATOM 545 O THR A 117 30.873 -15.791 -1.238 1.00 0.00 O ATOM 546 CB THR A 117 29.765 -18.165 -2.987 1.00 0.00 C ATOM 547 OG1 THR A 117 29.985 -19.132 -4.006 1.00 0.00 O ATOM 548 CG2 THR A 117 28.267 -17.888 -2.861 1.00 0.00 C ATOM 0 H THR A 117 32.392 -17.320 -2.560 1.00 0.00 H new ATOM 0 HA THR A 117 30.140 -16.509 -4.312 1.00 0.00 H new ATOM 0 HB THR A 117 30.141 -18.542 -2.036 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.517 -19.962 -3.776 1.00 0.00 H new ATOM 0 HG21 THR A 117 27.747 -18.810 -2.602 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.099 -17.146 -2.081 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.886 -17.510 -3.810 1.00 0.00 H new ATOM 556 N VAL A 118 29.266 -14.936 -2.570 1.00 0.00 N ATOM 557 CA VAL A 118 28.897 -13.867 -1.641 1.00 0.00 C ATOM 558 C VAL A 118 27.443 -14.042 -1.203 1.00 0.00 C ATOM 559 O VAL A 118 26.625 -14.599 -1.938 1.00 0.00 O ATOM 560 CB VAL A 118 29.074 -12.496 -2.311 1.00 0.00 C ATOM 561 CG1 VAL A 118 28.104 -12.355 -3.480 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.802 -11.395 -1.288 1.00 0.00 C ATOM 0 H VAL A 118 28.727 -14.944 -3.436 1.00 0.00 H new ATOM 0 HA VAL A 118 29.547 -13.920 -0.768 1.00 0.00 H new ATOM 0 HB VAL A 118 30.094 -12.409 -2.684 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.238 -11.380 -3.948 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.300 -13.139 -4.212 1.00 0.00 H new ATOM 0 HG13 VAL A 118 27.080 -12.446 -3.116 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.927 -10.421 -1.760 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.782 -11.489 -0.914 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.502 -11.488 -0.458 1.00 0.00 H new ATOM 572 N GLU A 119 27.128 -13.563 -0.002 1.00 0.00 N ATOM 573 CA GLU A 119 25.771 -13.669 0.535 1.00 0.00 C ATOM 574 C GLU A 119 25.288 -12.311 1.021 1.00 0.00 C ATOM 575 O GLU A 119 26.022 -11.576 1.679 1.00 0.00 O ATOM 576 CB GLU A 119 25.751 -14.663 1.699 1.00 0.00 C ATOM 577 CG GLU A 119 24.312 -14.858 2.179 1.00 0.00 C ATOM 578 CD GLU A 119 24.270 -15.900 3.293 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.328 -16.255 3.785 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.180 -16.323 3.638 1.00 0.00 O1- ATOM 0 H GLU A 119 27.792 -13.098 0.618 1.00 0.00 H new ATOM 0 HA GLU A 119 25.109 -14.020 -0.256 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.173 -15.617 1.383 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.371 -14.295 2.516 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.909 -13.912 2.540 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.683 -15.177 1.348 1.00 0.00 H new ATOM 587 N PHE A 120 24.041 -11.996 0.705 1.00 0.00 N ATOM 588 CA PHE A 120 23.463 -10.724 1.135 1.00 0.00 C ATOM 589 C PHE A 120 21.956 -10.702 0.884 1.00 0.00 C ATOM 590 O PHE A 120 21.446 -11.480 0.081 1.00 0.00 O ATOM 591 CB PHE A 120 24.120 -9.568 0.386 1.00 0.00 C ATOM 592 CG PHE A 120 23.833 -9.695 -1.084 1.00 0.00 C ATOM 593 CD1 PHE A 120 24.704 -10.417 -1.903 1.00 0.00 C ATOM 594 CD2 PHE A 120 22.700 -9.085 -1.630 1.00 0.00 C ATOM 595 CE1 PHE A 120 24.443 -10.532 -3.269 1.00 0.00 C ATOM 596 CE2 PHE A 120 22.437 -9.197 -2.999 1.00 0.00 C ATOM 597 CZ PHE A 120 23.310 -9.922 -3.821 1.00 0.00 C ATOM 0 H PHE A 120 23.415 -12.590 0.161 1.00 0.00 H new ATOM 0 HA PHE A 120 23.644 -10.613 2.204 1.00 0.00 H new ATOM 0 HB2 PHE A 120 23.742 -8.617 0.760 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.196 -9.574 0.559 1.00 0.00 H new ATOM 0 HD1 PHE A 120 25.579 -10.886 -1.479 1.00 0.00 H new ATOM 0 HD2 PHE A 120 22.028 -8.527 -0.995 1.00 0.00 H new ATOM 0 HE1 PHE A 120 25.116 -11.092 -3.901 1.00 0.00 H new ATOM 0 HE2 PHE A 120 21.562 -8.725 -3.422 1.00 0.00 H new ATOM 0 HZ PHE A 120 23.109 -10.010 -4.879 1.00 0.00 H new ATOM 607 N ALA A 121 21.249 -9.794 1.556 1.00 0.00 N ATOM 608 CA ALA A 121 19.802 -9.682 1.377 1.00 0.00 C ATOM 609 C ALA A 121 19.126 -11.036 1.582 1.00 0.00 C ATOM 610 O ALA A 121 17.994 -11.247 1.147 1.00 0.00 O ATOM 611 CB ALA A 121 19.478 -9.154 -0.022 1.00 0.00 C ATOM 0 H ALA A 121 21.649 -9.133 2.222 1.00 0.00 H new ATOM 0 HA ALA A 121 19.423 -8.982 2.122 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.397 -9.076 -0.140 1.00 0.00 H new ATOM 0 HB2 ALA A 121 19.929 -8.170 -0.153 1.00 0.00 H new ATOM 0 HB3 ALA A 121 19.876 -9.839 -0.771 1.00 0.00 H new ATOM 617 N GLY A 122 19.827 -11.947 2.247 1.00 0.00 N ATOM 618 CA GLY A 122 19.282 -13.276 2.508 1.00 0.00 C ATOM 619 C GLY A 122 19.322 -14.141 1.252 1.00 0.00 C ATOM 620 O GLY A 122 18.590 -15.126 1.138 1.00 0.00 O ATOM 0 H GLY A 122 20.766 -11.793 2.613 1.00 0.00 H new ATOM 0 HA2 GLY A 122 19.852 -13.757 3.303 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.254 -13.188 2.861 1.00 0.00 H new ATOM 624 N LYS A 123 20.177 -13.759 0.308 1.00 0.00 N ATOM 625 CA LYS A 123 20.322 -14.485 -0.953 1.00 0.00 C ATOM 626 C LYS A 123 21.795 -14.733 -1.249 1.00 0.00 C ATOM 627 O LYS A 123 22.664 -13.970 -0.824 1.00 0.00 O ATOM 628 CB LYS A 123 19.695 -13.675 -2.089 1.00 0.00 C ATOM 629 CG LYS A 123 18.172 -13.724 -1.982 1.00 0.00 C ATOM 630 CD LYS A 123 17.559 -12.913 -3.123 1.00 0.00 C ATOM 631 CE LYS A 123 16.032 -12.972 -3.028 1.00 0.00 C ATOM 632 NZ LYS A 123 15.430 -12.175 -4.134 1.00 0.00 N1+ ATOM 0 H LYS A 123 20.785 -12.944 0.392 1.00 0.00 H new ATOM 0 HA LYS A 123 19.812 -15.445 -0.870 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.039 -12.642 -2.043 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.014 -14.075 -3.052 1.00 0.00 H new ATOM 0 HG2 LYS A 123 17.826 -14.757 -2.028 1.00 0.00 H new ATOM 0 HG3 LYS A 123 17.850 -13.322 -1.021 1.00 0.00 H new ATOM 0 HD2 LYS A 123 17.898 -11.878 -3.071 1.00 0.00 H new ATOM 0 HD3 LYS A 123 17.890 -13.309 -4.083 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.694 -14.007 -3.086 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.702 -12.583 -2.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.393 -12.217 -4.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.742 -11.186 -4.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.734 -12.566 -5.049 1.00 0.00 H new ATOM 646 N VAL A 124 22.068 -15.817 -1.971 1.00 0.00 N ATOM 647 CA VAL A 124 23.438 -16.191 -2.321 1.00 0.00 C ATOM 648 C VAL A 124 23.735 -15.843 -3.782 1.00 0.00 C ATOM 649 O VAL A 124 22.822 -15.671 -4.591 1.00 0.00 O ATOM 650 CB VAL A 124 23.647 -17.691 -2.094 1.00 0.00 C ATOM 651 CG1 VAL A 124 22.658 -18.483 -2.953 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.080 -18.072 -2.479 1.00 0.00 C ATOM 0 H VAL A 124 21.356 -16.455 -2.327 1.00 0.00 H new ATOM 0 HA VAL A 124 24.121 -15.631 -1.682 1.00 0.00 H new ATOM 0 HB VAL A 124 23.480 -17.925 -1.043 1.00 0.00 H new ATOM 0 HG11 VAL A 124 22.808 -19.550 -2.790 1.00 0.00 H new ATOM 0 HG12 VAL A 124 21.639 -18.214 -2.676 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.822 -18.250 -4.005 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.229 -19.140 -2.317 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.249 -17.837 -3.530 1.00 0.00 H new ATOM 0 HG23 VAL A 124 25.783 -17.511 -1.864 1.00 0.00 H new ATOM 662 N PHE A 125 25.022 -15.751 -4.101 1.00 0.00 N ATOM 663 CA PHE A 125 25.461 -15.429 -5.461 1.00 0.00 C ATOM 664 C PHE A 125 26.828 -16.045 -5.731 1.00 0.00 C ATOM 665 O PHE A 125 27.850 -15.561 -5.242 1.00 0.00 O ATOM 666 CB PHE A 125 25.521 -13.912 -5.628 1.00 0.00 C ATOM 667 CG PHE A 125 24.125 -13.347 -5.609 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.507 -13.051 -4.390 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.454 -13.108 -6.809 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.216 -12.515 -4.375 1.00 0.00 C ATOM 671 CE2 PHE A 125 22.162 -12.573 -6.793 1.00 0.00 C ATOM 672 CZ PHE A 125 21.544 -12.275 -5.576 1.00 0.00 C ATOM 0 H PHE A 125 25.783 -15.895 -3.437 1.00 0.00 H new ATOM 0 HA PHE A 125 24.750 -15.841 -6.177 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.114 -13.471 -4.827 1.00 0.00 H new ATOM 0 HB3 PHE A 125 26.014 -13.658 -6.566 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.026 -13.236 -3.461 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.932 -13.336 -7.750 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.738 -12.286 -3.434 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.642 -12.390 -7.722 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.547 -11.859 -5.564 1.00 0.00 H new ATOM 682 N SER A 126 26.834 -17.113 -6.524 1.00 0.00 N ATOM 683 CA SER A 126 28.073 -17.802 -6.874 1.00 0.00 C ATOM 684 C SER A 126 28.694 -17.183 -8.119 1.00 0.00 C ATOM 685 O SER A 126 27.989 -16.643 -8.969 1.00 0.00 O ATOM 686 CB SER A 126 27.791 -19.281 -7.128 1.00 0.00 C ATOM 687 OG SER A 126 28.983 -19.917 -7.569 1.00 0.00 O ATOM 0 H SER A 126 25.995 -17.520 -6.937 1.00 0.00 H new ATOM 0 HA SER A 126 28.771 -17.701 -6.043 1.00 0.00 H new ATOM 0 HB2 SER A 126 27.428 -19.756 -6.216 1.00 0.00 H new ATOM 0 HB3 SER A 126 27.008 -19.390 -7.878 1.00 0.00 H new ATOM 0 HG SER A 126 28.806 -20.867 -7.732 1.00 0.00 H new ATOM 693 N GLY A 127 30.017 -17.277 -8.225 1.00 0.00 N ATOM 694 CA GLY A 127 30.740 -16.735 -9.377 1.00 0.00 C ATOM 695 C GLY A 127 31.076 -17.838 -10.366 1.00 0.00 C ATOM 696 O GLY A 127 30.442 -18.894 -10.369 1.00 0.00 O ATOM 0 H GLY A 127 30.613 -17.723 -7.528 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.135 -15.972 -9.867 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.656 -16.248 -9.042 1.00 0.00 H new ATOM 700 N GLU A 128 32.069 -17.585 -11.218 1.00 0.00 N ATOM 701 CA GLU A 128 32.476 -18.562 -12.225 1.00 0.00 C ATOM 702 C GLU A 128 33.751 -19.290 -11.792 1.00 0.00 C ATOM 703 O GLU A 128 34.696 -18.662 -11.314 1.00 0.00 O ATOM 704 CB GLU A 128 32.701 -17.856 -13.579 1.00 0.00 C ATOM 705 CG GLU A 128 34.123 -17.285 -13.662 1.00 0.00 C ATOM 706 CD GLU A 128 34.221 -16.277 -14.802 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.283 -15.517 -14.981 1.00 0.00 O ATOM 708 OE2 GLU A 128 35.235 -16.277 -15.481 1.00 0.00 O1- ATOM 0 H GLU A 128 32.603 -16.716 -11.231 1.00 0.00 H new ATOM 0 HA GLU A 128 31.681 -19.300 -12.333 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.539 -18.561 -14.394 1.00 0.00 H new ATOM 0 HB3 GLU A 128 31.974 -17.054 -13.702 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.385 -16.805 -12.719 1.00 0.00 H new ATOM 0 HG3 GLU A 128 34.838 -18.092 -13.819 1.00 0.00 H new ATOM 715 N GLU A 129 33.781 -20.605 -11.965 1.00 0.00 N ATOM 716 CA GLU A 129 34.960 -21.375 -11.593 1.00 0.00 C ATOM 717 C GLU A 129 36.199 -20.814 -12.288 1.00 0.00 C ATOM 718 O GLU A 129 36.125 -20.340 -13.421 1.00 0.00 O ATOM 719 CB GLU A 129 34.768 -22.841 -11.980 1.00 0.00 C ATOM 720 CG GLU A 129 33.673 -23.457 -11.109 1.00 0.00 C ATOM 721 CD GLU A 129 33.424 -24.901 -11.531 1.00 0.00 C ATOM 722 OE1 GLU A 129 34.130 -25.372 -12.407 1.00 0.00 O ATOM 723 OE2 GLU A 129 32.529 -25.514 -10.973 1.00 0.00 O1- ATOM 0 H GLU A 129 33.015 -21.154 -12.355 1.00 0.00 H new ATOM 0 HA GLU A 129 35.099 -21.304 -10.514 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.497 -22.918 -13.033 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.702 -23.388 -11.850 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.968 -23.421 -10.060 1.00 0.00 H new ATOM 0 HG3 GLU A 129 32.754 -22.878 -11.202 1.00 0.00 H new ATOM 730 N ALA A 130 37.332 -20.875 -11.598 1.00 0.00 N ATOM 731 CA ALA A 130 38.584 -20.371 -12.155 1.00 0.00 C ATOM 732 C ALA A 130 39.775 -20.834 -11.322 1.00 0.00 C ATOM 733 O ALA A 130 39.625 -21.189 -10.152 1.00 0.00 O ATOM 734 CB ALA A 130 38.557 -18.842 -12.204 1.00 0.00 C ATOM 0 H ALA A 130 37.411 -21.265 -10.659 1.00 0.00 H new ATOM 0 HA ALA A 130 38.690 -20.766 -13.165 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.495 -18.475 -12.621 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.728 -18.513 -12.830 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.429 -18.448 -11.196 1.00 0.00 H new ATOM 740 N LYS A 131 40.961 -20.816 -11.931 1.00 0.00 N ATOM 741 CA LYS A 131 42.184 -21.229 -11.241 1.00 0.00 C ATOM 742 C LYS A 131 42.810 -20.041 -10.524 1.00 0.00 C ATOM 743 O LYS A 131 44.030 -19.954 -10.386 1.00 0.00 O ATOM 744 CB LYS A 131 43.192 -21.817 -12.244 1.00 0.00 C ATOM 745 CG LYS A 131 44.190 -22.720 -11.510 1.00 0.00 C ATOM 746 CD LYS A 131 45.125 -23.383 -12.522 1.00 0.00 C ATOM 747 CE LYS A 131 46.160 -24.223 -11.775 1.00 0.00 C ATOM 748 NZ LYS A 131 45.470 -25.332 -11.055 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.101 -20.521 -12.897 1.00 0.00 H new ATOM 0 HA LYS A 131 41.925 -21.993 -10.508 1.00 0.00 H new ATOM 0 HB2 LYS A 131 42.666 -22.388 -13.009 1.00 0.00 H new ATOM 0 HB3 LYS A 131 43.722 -21.013 -12.754 1.00 0.00 H new ATOM 0 HG2 LYS A 131 44.768 -22.134 -10.796 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.656 -23.481 -10.940 1.00 0.00 H new ATOM 0 HD2 LYS A 131 44.554 -24.011 -13.205 1.00 0.00 H new ATOM 0 HD3 LYS A 131 45.622 -22.625 -13.127 1.00 0.00 H new ATOM 0 HE2 LYS A 131 46.890 -24.628 -12.476 1.00 0.00 H new ATOM 0 HE3 LYS A 131 46.708 -23.601 -11.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 46.052 -26.192 -11.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 45.328 -25.065 -10.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 44.547 -25.513 -11.499 1.00 0.00 H new ATOM 762 N THR A 132 41.968 -19.127 -10.061 1.00 0.00 N ATOM 763 CA THR A 132 42.451 -17.947 -9.350 1.00 0.00 C ATOM 764 C THR A 132 41.349 -17.361 -8.470 1.00 0.00 C ATOM 765 O THR A 132 40.162 -17.475 -8.784 1.00 0.00 O ATOM 766 CB THR A 132 42.930 -16.895 -10.351 1.00 0.00 C ATOM 767 OG1 THR A 132 43.337 -15.727 -9.651 1.00 0.00 O ATOM 768 CG2 THR A 132 41.790 -16.545 -11.302 1.00 0.00 C ATOM 0 H THR A 132 40.954 -19.177 -10.163 1.00 0.00 H new ATOM 0 HA THR A 132 43.284 -18.244 -8.713 1.00 0.00 H new ATOM 0 HB THR A 132 43.772 -17.290 -10.920 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.646 -15.053 -10.292 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.129 -15.795 -12.016 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.475 -17.440 -11.838 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.949 -16.149 -10.732 1.00 0.00 H new ATOM 776 N LYS A 133 41.751 -16.731 -7.372 1.00 0.00 N ATOM 777 CA LYS A 133 40.797 -16.120 -6.452 1.00 0.00 C ATOM 778 C LYS A 133 40.324 -14.768 -6.972 1.00 0.00 C ATOM 779 O LYS A 133 39.171 -14.385 -6.779 1.00 0.00 O ATOM 780 CB LYS A 133 41.425 -15.945 -5.070 1.00 0.00 C ATOM 781 CG LYS A 133 41.658 -17.319 -4.443 1.00 0.00 C ATOM 782 CD LYS A 133 42.290 -17.150 -3.060 1.00 0.00 C ATOM 783 CE LYS A 133 42.511 -18.525 -2.426 1.00 0.00 C ATOM 784 NZ LYS A 133 43.144 -18.361 -1.086 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.728 -16.630 -7.097 1.00 0.00 H new ATOM 0 HA LYS A 133 39.937 -16.785 -6.375 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.369 -15.406 -5.152 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.771 -15.348 -4.434 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.714 -17.857 -4.359 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.309 -17.916 -5.081 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.239 -16.621 -3.145 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.643 -16.545 -2.425 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.560 -19.049 -2.329 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.147 -19.135 -3.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.294 -19.296 -0.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 44.059 -17.878 -1.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.521 -17.795 -0.475 1.00 0.00 H new ATOM 798 N LYS A 134 41.229 -14.036 -7.613 1.00 0.00 N ATOM 799 CA LYS A 134 40.893 -12.715 -8.133 1.00 0.00 C ATOM 800 C LYS A 134 39.700 -12.788 -9.083 1.00 0.00 C ATOM 801 O LYS A 134 38.704 -12.092 -8.896 1.00 0.00 O ATOM 802 CB LYS A 134 42.098 -12.135 -8.877 1.00 0.00 C ATOM 803 CG LYS A 134 43.221 -11.837 -7.881 1.00 0.00 C ATOM 804 CD LYS A 134 44.434 -11.273 -8.627 1.00 0.00 C ATOM 805 CE LYS A 134 45.558 -10.986 -7.628 1.00 0.00 C ATOM 806 NZ LYS A 134 46.742 -10.443 -8.353 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.191 -14.330 -7.784 1.00 0.00 H new ATOM 0 HA LYS A 134 40.629 -12.073 -7.293 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.446 -12.840 -9.632 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.811 -11.223 -9.400 1.00 0.00 H new ATOM 0 HG2 LYS A 134 42.877 -11.123 -7.133 1.00 0.00 H new ATOM 0 HG3 LYS A 134 43.499 -12.747 -7.349 1.00 0.00 H new ATOM 0 HD2 LYS A 134 44.775 -11.984 -9.380 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.158 -10.359 -9.153 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.219 -10.272 -6.878 1.00 0.00 H new ATOM 0 HE3 LYS A 134 45.830 -11.899 -7.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 47.505 -10.248 -7.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 47.070 -11.139 -9.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 46.478 -9.562 -8.839 1.00 0.00 H new ATOM 820 N LEU A 135 39.808 -13.629 -10.104 1.00 0.00 N ATOM 821 CA LEU A 135 38.737 -13.776 -11.074 1.00 0.00 C ATOM 822 C LEU A 135 37.483 -14.365 -10.430 1.00 0.00 C ATOM 823 O LEU A 135 36.363 -13.952 -10.737 1.00 0.00 O ATOM 824 CB LEU A 135 39.205 -14.693 -12.216 1.00 0.00 C ATOM 825 CG LEU A 135 38.430 -14.372 -13.508 1.00 0.00 C ATOM 826 CD1 LEU A 135 39.108 -13.195 -14.233 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.411 -15.606 -14.425 1.00 0.00 C ATOM 0 H LEU A 135 40.624 -14.216 -10.279 1.00 0.00 H new ATOM 0 HA LEU A 135 38.489 -12.788 -11.463 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.274 -14.562 -12.383 1.00 0.00 H new ATOM 0 HB3 LEU A 135 39.051 -15.736 -11.941 1.00 0.00 H new ATOM 0 HG LEU A 135 37.405 -14.101 -13.256 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.560 -12.967 -15.147 1.00 0.00 H new ATOM 0 HD12 LEU A 135 39.110 -12.320 -13.583 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.134 -13.464 -14.482 1.00 0.00 H new ATOM 0 HD21 LEU A 135 37.862 -15.373 -15.337 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.433 -15.886 -14.679 1.00 0.00 H new ATOM 0 HD23 LEU A 135 37.925 -16.435 -13.910 1.00 0.00 H new ATOM 839 N ALA A 136 37.677 -15.342 -9.549 1.00 0.00 N ATOM 840 CA ALA A 136 36.550 -15.985 -8.889 1.00 0.00 C ATOM 841 C ALA A 136 35.689 -14.953 -8.180 1.00 0.00 C ATOM 842 O ALA A 136 34.479 -14.884 -8.402 1.00 0.00 O ATOM 843 CB ALA A 136 37.056 -17.012 -7.878 1.00 0.00 C ATOM 0 H ALA A 136 38.593 -15.701 -9.279 1.00 0.00 H new ATOM 0 HA ALA A 136 35.947 -16.487 -9.645 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.207 -17.489 -7.388 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.649 -17.768 -8.393 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.673 -16.513 -7.131 1.00 0.00 H new ATOM 849 N GLU A 137 36.311 -14.158 -7.317 1.00 0.00 N ATOM 850 CA GLU A 137 35.582 -13.139 -6.575 1.00 0.00 C ATOM 851 C GLU A 137 34.942 -12.143 -7.533 1.00 0.00 C ATOM 852 O GLU A 137 33.812 -11.703 -7.325 1.00 0.00 O ATOM 853 CB GLU A 137 36.538 -12.407 -5.630 1.00 0.00 C ATOM 854 CG GLU A 137 37.018 -13.369 -4.538 1.00 0.00 C ATOM 855 CD GLU A 137 38.038 -12.673 -3.642 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.317 -11.511 -3.887 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.525 -13.313 -2.724 1.00 0.00 O1- ATOM 0 H GLU A 137 37.310 -14.199 -7.116 1.00 0.00 H new ATOM 0 HA GLU A 137 34.796 -13.621 -5.994 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.391 -12.019 -6.188 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.036 -11.551 -5.180 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.170 -13.709 -3.943 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.464 -14.254 -4.992 1.00 0.00 H new ATOM 864 N MET A 138 35.676 -11.784 -8.581 1.00 0.00 N ATOM 865 CA MET A 138 35.165 -10.831 -9.560 1.00 0.00 C ATOM 866 C MET A 138 33.890 -11.367 -10.205 1.00 0.00 C ATOM 867 O MET A 138 32.887 -10.663 -10.294 1.00 0.00 O ATOM 868 CB MET A 138 36.217 -10.576 -10.640 1.00 0.00 C ATOM 869 CG MET A 138 35.699 -9.525 -11.624 1.00 0.00 C ATOM 870 SD MET A 138 36.983 -9.156 -12.843 1.00 0.00 S ATOM 871 CE MET A 138 36.585 -10.487 -14.003 1.00 0.00 C ATOM 0 H MET A 138 36.615 -12.133 -8.773 1.00 0.00 H new ATOM 0 HA MET A 138 34.938 -9.895 -9.049 1.00 0.00 H new ATOM 0 HB2 MET A 138 37.146 -10.235 -10.183 1.00 0.00 H new ATOM 0 HB3 MET A 138 36.443 -11.503 -11.168 1.00 0.00 H new ATOM 0 HG2 MET A 138 34.802 -9.890 -12.124 1.00 0.00 H new ATOM 0 HG3 MET A 138 35.419 -8.618 -11.089 1.00 0.00 H new ATOM 0 HE1 MET A 138 37.269 -10.447 -14.851 1.00 0.00 H new ATOM 0 HE2 MET A 138 36.685 -11.449 -13.501 1.00 0.00 H new ATOM 0 HE3 MET A 138 35.561 -10.367 -14.357 1.00 0.00 H new ATOM 881 N SER A 139 33.934 -12.621 -10.649 1.00 0.00 N ATOM 882 CA SER A 139 32.774 -13.240 -11.282 1.00 0.00 C ATOM 883 C SER A 139 31.595 -13.286 -10.318 1.00 0.00 C ATOM 884 O SER A 139 30.445 -13.128 -10.724 1.00 0.00 O ATOM 885 CB SER A 139 33.129 -14.652 -11.752 1.00 0.00 C ATOM 886 OG SER A 139 34.031 -14.547 -12.844 1.00 0.00 O ATOM 0 H SER A 139 34.754 -13.224 -10.583 1.00 0.00 H new ATOM 0 HA SER A 139 32.486 -12.639 -12.145 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.582 -15.220 -10.939 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.230 -15.189 -12.053 1.00 0.00 H new ATOM 0 HG SER A 139 33.530 -14.356 -13.665 1.00 0.00 H new ATOM 892 N ALA A 140 31.880 -13.494 -9.038 1.00 0.00 N ATOM 893 CA ALA A 140 30.823 -13.549 -8.037 1.00 0.00 C ATOM 894 C ALA A 140 30.188 -12.176 -7.843 1.00 0.00 C ATOM 895 O ALA A 140 28.963 -12.038 -7.854 1.00 0.00 O ATOM 896 CB ALA A 140 31.403 -14.041 -6.713 1.00 0.00 C ATOM 0 H ALA A 140 32.823 -13.626 -8.672 1.00 0.00 H new ATOM 0 HA ALA A 140 30.052 -14.238 -8.381 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.613 -14.083 -5.963 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.827 -15.036 -6.849 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.183 -13.356 -6.381 1.00 0.00 H new ATOM 902 N ALA A 141 31.027 -11.164 -7.656 1.00 0.00 N ATOM 903 CA ALA A 141 30.539 -9.808 -7.450 1.00 0.00 C ATOM 904 C ALA A 141 29.723 -9.343 -8.649 1.00 0.00 C ATOM 905 O ALA A 141 28.848 -8.486 -8.523 1.00 0.00 O ATOM 906 CB ALA A 141 31.716 -8.854 -7.234 1.00 0.00 C ATOM 0 H ALA A 141 32.043 -11.257 -7.643 1.00 0.00 H new ATOM 0 HA ALA A 141 29.901 -9.805 -6.566 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.341 -7.842 -7.081 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.282 -9.168 -6.357 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.364 -8.872 -8.110 1.00 0.00 H new ATOM 912 N LYS A 142 30.003 -9.922 -9.811 1.00 0.00 N ATOM 913 CA LYS A 142 29.277 -9.569 -11.026 1.00 0.00 C ATOM 914 C LYS A 142 27.829 -10.031 -10.946 1.00 0.00 C ATOM 915 O LYS A 142 26.911 -9.305 -11.329 1.00 0.00 O ATOM 916 CB LYS A 142 29.949 -10.220 -12.239 1.00 0.00 C ATOM 917 CG LYS A 142 31.270 -9.504 -12.566 1.00 0.00 C ATOM 918 CD LYS A 142 31.004 -8.309 -13.486 1.00 0.00 C ATOM 919 CE LYS A 142 32.331 -7.657 -13.863 1.00 0.00 C ATOM 920 NZ LYS A 142 33.013 -7.181 -12.627 1.00 0.00 N1+ ATOM 0 H LYS A 142 30.723 -10.634 -9.938 1.00 0.00 H new ATOM 0 HA LYS A 142 29.294 -8.484 -11.131 1.00 0.00 H new ATOM 0 HB2 LYS A 142 30.139 -11.274 -12.036 1.00 0.00 H new ATOM 0 HB3 LYS A 142 29.281 -10.177 -13.100 1.00 0.00 H new ATOM 0 HG2 LYS A 142 31.747 -9.166 -11.646 1.00 0.00 H new ATOM 0 HG3 LYS A 142 31.960 -10.197 -13.047 1.00 0.00 H new ATOM 0 HD2 LYS A 142 30.479 -8.636 -14.383 1.00 0.00 H new ATOM 0 HD3 LYS A 142 30.360 -7.586 -12.985 1.00 0.00 H new ATOM 0 HE2 LYS A 142 32.964 -8.371 -14.390 1.00 0.00 H new ATOM 0 HE3 LYS A 142 32.159 -6.822 -14.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 33.731 -6.472 -12.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 32.313 -6.754 -11.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 33.471 -7.985 -12.152 1.00 0.00 H new ATOM 934 N VAL A 143 27.632 -11.249 -10.459 1.00 0.00 N ATOM 935 CA VAL A 143 26.288 -11.796 -10.357 1.00 0.00 C ATOM 936 C VAL A 143 25.438 -10.956 -9.410 1.00 0.00 C ATOM 937 O VAL A 143 24.289 -10.637 -9.716 1.00 0.00 O ATOM 938 CB VAL A 143 26.336 -13.241 -9.843 1.00 0.00 C ATOM 939 CG1 VAL A 143 25.002 -13.950 -10.139 1.00 0.00 C ATOM 940 CG2 VAL A 143 27.497 -13.998 -10.506 1.00 0.00 C ATOM 0 H VAL A 143 28.374 -11.868 -10.133 1.00 0.00 H new ATOM 0 HA VAL A 143 25.842 -11.779 -11.351 1.00 0.00 H new ATOM 0 HB VAL A 143 26.496 -13.228 -8.765 1.00 0.00 H new ATOM 0 HG11 VAL A 143 25.045 -14.975 -9.771 1.00 0.00 H new ATOM 0 HG12 VAL A 143 24.190 -13.420 -9.642 1.00 0.00 H new ATOM 0 HG13 VAL A 143 24.825 -13.958 -11.215 1.00 0.00 H new ATOM 0 HG21 VAL A 143 27.523 -15.022 -10.135 1.00 0.00 H new ATOM 0 HG22 VAL A 143 27.355 -14.007 -11.587 1.00 0.00 H new ATOM 0 HG23 VAL A 143 28.438 -13.502 -10.268 1.00 0.00 H new ATOM 950 N ALA A 144 25.999 -10.601 -8.254 1.00 0.00 N ATOM 951 CA ALA A 144 25.268 -9.803 -7.279 1.00 0.00 C ATOM 952 C ALA A 144 24.923 -8.429 -7.845 1.00 0.00 C ATOM 953 O ALA A 144 23.783 -7.980 -7.759 1.00 0.00 O ATOM 954 CB ALA A 144 26.125 -9.632 -6.020 1.00 0.00 C ATOM 0 H ALA A 144 26.947 -10.852 -7.975 1.00 0.00 H new ATOM 0 HA ALA A 144 24.340 -10.319 -7.036 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.581 -9.035 -5.288 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.348 -10.611 -5.596 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.056 -9.128 -6.279 1.00 0.00 H new ATOM 960 N PHE A 145 25.919 -7.762 -8.416 1.00 0.00 N ATOM 961 CA PHE A 145 25.708 -6.433 -8.979 1.00 0.00 C ATOM 962 C PHE A 145 24.687 -6.479 -10.110 1.00 0.00 C ATOM 963 O PHE A 145 23.801 -5.632 -10.188 1.00 0.00 O ATOM 964 CB PHE A 145 27.028 -5.868 -9.503 1.00 0.00 C ATOM 965 CG PHE A 145 26.850 -4.405 -9.843 1.00 0.00 C ATOM 966 CD1 PHE A 145 27.006 -3.433 -8.845 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.537 -4.018 -11.152 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.847 -2.078 -9.156 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.376 -2.661 -11.461 1.00 0.00 C ATOM 970 CZ PHE A 145 26.533 -1.691 -10.463 1.00 0.00 C ATOM 0 H PHE A 145 26.872 -8.115 -8.501 1.00 0.00 H new ATOM 0 HA PHE A 145 25.325 -5.787 -8.189 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.810 -5.986 -8.753 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.348 -6.421 -10.386 1.00 0.00 H new ATOM 0 HD1 PHE A 145 27.249 -3.730 -7.836 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.420 -4.765 -11.923 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.967 -1.330 -8.386 1.00 0.00 H new ATOM 0 HE2 PHE A 145 26.131 -2.363 -12.470 1.00 0.00 H new ATOM 0 HZ PHE A 145 26.412 -0.645 -10.702 1.00 0.00 H new ATOM 980 N MET A 146 24.817 -7.467 -10.988 1.00 0.00 N ATOM 981 CA MET A 146 23.902 -7.602 -12.116 1.00 0.00 C ATOM 982 C MET A 146 22.480 -7.888 -11.633 1.00 0.00 C ATOM 983 O MET A 146 21.512 -7.354 -12.173 1.00 0.00 O ATOM 984 CB MET A 146 24.374 -8.744 -13.022 1.00 0.00 C ATOM 985 CG MET A 146 25.606 -8.300 -13.819 1.00 0.00 C ATOM 986 SD MET A 146 25.145 -7.033 -15.029 1.00 0.00 S ATOM 987 CE MET A 146 24.653 -8.152 -16.368 1.00 0.00 C ATOM 0 H MET A 146 25.542 -8.183 -10.942 1.00 0.00 H new ATOM 0 HA MET A 146 23.896 -6.664 -12.672 1.00 0.00 H new ATOM 0 HB2 MET A 146 24.615 -9.621 -12.421 1.00 0.00 H new ATOM 0 HB3 MET A 146 23.574 -9.034 -13.703 1.00 0.00 H new ATOM 0 HG2 MET A 146 26.364 -7.907 -13.142 1.00 0.00 H new ATOM 0 HG3 MET A 146 26.047 -9.157 -14.329 1.00 0.00 H new ATOM 0 HE1 MET A 146 24.327 -7.568 -17.229 1.00 0.00 H new ATOM 0 HE2 MET A 146 25.501 -8.775 -16.652 1.00 0.00 H new ATOM 0 HE3 MET A 146 23.834 -8.787 -16.029 1.00 0.00 H new ATOM 997 N SER A 147 22.363 -8.728 -10.612 1.00 0.00 N ATOM 998 CA SER A 147 21.053 -9.072 -10.068 1.00 0.00 C ATOM 999 C SER A 147 20.434 -7.881 -9.343 1.00 0.00 C ATOM 1000 O SER A 147 19.237 -7.620 -9.470 1.00 0.00 O ATOM 1001 CB SER A 147 21.184 -10.249 -9.114 1.00 0.00 C ATOM 1002 OG SER A 147 21.876 -11.301 -9.775 1.00 0.00 O ATOM 0 H SER A 147 23.150 -9.180 -10.147 1.00 0.00 H new ATOM 0 HA SER A 147 20.398 -9.347 -10.895 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.724 -9.948 -8.216 1.00 0.00 H new ATOM 0 HB3 SER A 147 20.198 -10.588 -8.795 1.00 0.00 H new ATOM 0 HG SER A 147 22.837 -11.111 -9.776 1.00 0.00 H new ATOM 1008 N ILE A 148 21.253 -7.165 -8.577 1.00 0.00 N ATOM 1009 CA ILE A 148 20.769 -6.004 -7.831 1.00 0.00 C ATOM 1010 C ILE A 148 20.121 -4.996 -8.778 1.00 0.00 C ATOM 1011 O ILE A 148 19.179 -4.300 -8.405 1.00 0.00 O ATOM 1012 CB ILE A 148 21.927 -5.336 -7.066 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.290 -6.188 -5.843 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.511 -3.935 -6.592 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.662 -5.758 -5.320 1.00 0.00 C ATOM 0 H ILE A 148 22.246 -7.365 -8.456 1.00 0.00 H new ATOM 0 HA ILE A 148 20.023 -6.344 -7.113 1.00 0.00 H new ATOM 0 HB ILE A 148 22.786 -5.252 -7.732 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.537 -6.068 -5.064 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.305 -7.244 -6.112 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.338 -3.473 -6.053 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.252 -3.321 -7.455 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.647 -4.016 -5.932 1.00 0.00 H new ATOM 0 HD11 ILE A 148 23.925 -6.360 -4.451 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.410 -5.901 -6.100 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.630 -4.706 -5.036 1.00 0.00 H new ATOM 1027 N LYS A 149 20.629 -4.918 -10.001 1.00 0.00 N ATOM 1028 CA LYS A 149 20.078 -3.986 -10.975 1.00 0.00 C ATOM 1029 C LYS A 149 18.618 -4.319 -11.266 1.00 0.00 C ATOM 1030 O LYS A 149 17.775 -3.427 -11.362 1.00 0.00 O ATOM 1031 CB LYS A 149 20.884 -4.050 -12.273 1.00 0.00 C ATOM 1032 CG LYS A 149 22.255 -3.399 -12.066 1.00 0.00 C ATOM 1033 CD LYS A 149 23.115 -3.602 -13.320 1.00 0.00 C ATOM 1034 CE LYS A 149 22.647 -2.671 -14.444 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.679 -2.634 -15.517 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.410 -5.480 -10.339 1.00 0.00 H new ATOM 0 HA LYS A 149 20.136 -2.980 -10.560 1.00 0.00 H new ATOM 0 HB2 LYS A 149 21.007 -5.087 -12.584 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.346 -3.539 -13.071 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.137 -2.335 -11.862 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.749 -3.837 -11.199 1.00 0.00 H new ATOM 0 HD2 LYS A 149 24.161 -3.404 -13.087 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.052 -4.639 -13.648 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.697 -3.021 -14.849 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.477 -1.668 -14.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.363 -2.003 -16.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 24.575 -2.281 -15.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.820 -3.592 -15.896 1.00 0.00 H new