USER MOD reduce.3.24.130724 H: found=0, std=0, add=845, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 846 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 57 GLN : amide:sc= 0.0247 X(o=-0.26,f=-0.37) USER MOD Set 1.2: A 61 ASN : amide:sc= -0.282 X(o=-0.26,f=-0.42) USER MOD Set 2.1: A 19 LYS NZ :NH3+ -143:sc= 1.17 (180deg=0) USER MOD Set 2.2: A 82 ASN : amide:sc= 0.523 K(o=1.7,f=-5.9) USER MOD Set 3.1: A 11 TYR OH : rot 179:sc= 0.0795 USER MOD Set 3.2: A 86 HIS : no HD1:sc= 0 X(o=0.079,f=-0.01) USER MOD Single : A 7 SER OG : rot 180:sc= -0.229 USER MOD Single : A 8 TYR OH : rot 50:sc= -0.923 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN :FLIP amide:sc= -0.158 F(o=-1.9!,f=-0.16) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HD1:sc= -0.328 X(o=-0.33,f=0.034) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -0.262 X(o=-0.26,f=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 166:sc= 0.492 (180deg=0.379) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0.45 X(o=0.45,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 98:sc= 0.694 USER MOD Single : A 45 ASN : amide:sc= -0.406 X(o=-0.41,f=-0.018) USER MOD Single : A 47 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.014) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.0349 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -1.02 K(o=-1,f=-2.9!) USER MOD Single : A 56 MET CE :methyl 179:sc= -1.89 (180deg=-1.92) USER MOD Single : A 58 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 59 TYR OH : rot 166:sc= -0.199 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.0014) USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 75 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0201) USER MOD Single : A 78 LYS NZ :NH3+ -169:sc= -0.0804 (180deg=-0.226) USER MOD Single : A 83 SER OG : rot 90:sc= -0.0682 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= 0.695 K(o=0.69,f=-7.1!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 77:sc= 0.376 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 82 N LEU A 6 2.284 10.449 -11.342 1.00 0.00 N ATOM 83 CA LEU A 6 2.665 9.116 -10.886 1.00 0.00 C ATOM 84 C LEU A 6 1.444 8.427 -10.258 1.00 0.00 C ATOM 85 O LEU A 6 0.823 8.979 -9.333 1.00 0.00 O ATOM 86 CB LEU A 6 3.783 9.233 -9.816 1.00 0.00 C ATOM 87 CG LEU A 6 4.391 7.907 -9.285 1.00 0.00 C ATOM 88 CD1 LEU A 6 5.092 7.123 -10.409 1.00 0.00 C ATOM 89 CD2 LEU A 6 5.351 8.198 -8.120 1.00 0.00 C ATOM 0 HA LEU A 6 3.027 8.533 -11.733 1.00 0.00 H new ATOM 0 HB2 LEU A 6 4.591 9.833 -10.235 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.383 9.786 -8.967 1.00 0.00 H new ATOM 0 HG LEU A 6 3.581 7.278 -8.915 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.507 6.200 -10.005 1.00 0.00 H new ATOM 0 HD12 LEU A 6 4.371 6.885 -11.191 1.00 0.00 H new ATOM 0 HD13 LEU A 6 5.895 7.729 -10.829 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.773 7.262 -7.754 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.155 8.848 -8.465 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.807 8.690 -7.314 1.00 0.00 H new ATOM 101 N SER A 7 1.093 7.237 -10.768 1.00 0.00 N ATOM 102 CA SER A 7 0.098 6.365 -10.126 1.00 0.00 C ATOM 103 C SER A 7 0.787 5.584 -8.988 1.00 0.00 C ATOM 104 O SER A 7 1.990 5.289 -9.070 1.00 0.00 O ATOM 105 CB SER A 7 -0.555 5.420 -11.166 1.00 0.00 C ATOM 106 OG SER A 7 0.400 4.591 -11.800 1.00 0.00 O ATOM 0 H SER A 7 1.486 6.855 -11.628 1.00 0.00 H new ATOM 0 HA SER A 7 -0.707 6.965 -9.702 1.00 0.00 H new ATOM 0 HB2 SER A 7 -1.304 4.800 -10.673 1.00 0.00 H new ATOM 0 HB3 SER A 7 -1.077 6.013 -11.917 1.00 0.00 H new ATOM 0 HG SER A 7 -0.050 4.009 -12.447 1.00 0.00 H new ATOM 112 N TYR A 8 0.024 5.267 -7.929 1.00 0.00 N ATOM 113 CA TYR A 8 0.547 4.619 -6.709 1.00 0.00 C ATOM 114 C TYR A 8 1.144 3.227 -7.007 1.00 0.00 C ATOM 115 O TYR A 8 2.024 2.769 -6.287 1.00 0.00 O ATOM 116 CB TYR A 8 -0.562 4.525 -5.633 1.00 0.00 C ATOM 117 CG TYR A 8 -0.093 3.976 -4.268 1.00 0.00 C ATOM 118 CD1 TYR A 8 1.063 4.472 -3.658 1.00 0.00 C ATOM 119 CD2 TYR A 8 -0.803 2.982 -3.585 1.00 0.00 C ATOM 120 CE1 TYR A 8 1.487 4.007 -2.436 1.00 0.00 C ATOM 121 CE2 TYR A 8 -0.373 2.517 -2.354 1.00 0.00 C ATOM 122 CZ TYR A 8 0.770 3.034 -1.789 1.00 0.00 C ATOM 123 OH TYR A 8 1.206 2.569 -0.574 1.00 0.00 O ATOM 0 H TYR A 8 -0.978 5.453 -7.892 1.00 0.00 H new ATOM 0 HA TYR A 8 1.357 5.239 -6.325 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -0.989 5.517 -5.483 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -1.362 3.888 -6.010 1.00 0.00 H new ATOM 0 HD1 TYR A 8 1.636 5.238 -4.159 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -1.700 2.572 -4.025 1.00 0.00 H new ATOM 0 HE1 TYR A 8 2.384 4.407 -1.986 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -0.933 1.751 -1.839 1.00 0.00 H new ATOM 0 HH TYR A 8 1.393 3.327 0.018 1.00 0.00 H new ATOM 133 N GLY A 9 0.677 2.591 -8.092 1.00 0.00 N ATOM 134 CA GLY A 9 1.190 1.292 -8.526 1.00 0.00 C ATOM 135 C GLY A 9 2.626 1.387 -9.003 1.00 0.00 C ATOM 136 O GLY A 9 3.470 0.563 -8.641 1.00 0.00 O ATOM 0 H GLY A 9 -0.063 2.964 -8.687 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.127 0.582 -7.702 1.00 0.00 H new ATOM 0 HA3 GLY A 9 0.564 0.904 -9.330 1.00 0.00 H new ATOM 140 N GLU A 10 2.895 2.448 -9.775 1.00 0.00 N ATOM 141 CA GLU A 10 4.236 2.767 -10.285 1.00 0.00 C ATOM 142 C GLU A 10 5.141 3.277 -9.147 1.00 0.00 C ATOM 143 O GLU A 10 6.365 3.087 -9.187 1.00 0.00 O ATOM 144 CB GLU A 10 4.121 3.836 -11.397 1.00 0.00 C ATOM 145 CG GLU A 10 3.259 3.423 -12.605 1.00 0.00 C ATOM 146 CD GLU A 10 3.851 2.266 -13.420 1.00 0.00 C ATOM 147 OE1 GLU A 10 4.685 2.526 -14.311 1.00 0.00 O ATOM 148 OE2 GLU A 10 3.493 1.092 -13.168 1.00 0.00 O ATOM 0 H GLU A 10 2.181 3.116 -10.066 1.00 0.00 H new ATOM 0 HA GLU A 10 4.685 1.863 -10.697 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.704 4.746 -10.965 1.00 0.00 H new ATOM 0 HB3 GLU A 10 5.123 4.081 -11.750 1.00 0.00 H new ATOM 0 HG2 GLU A 10 2.268 3.137 -12.252 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.128 4.286 -13.258 1.00 0.00 H new ATOM 155 N TYR A 11 4.518 3.935 -8.141 1.00 0.00 N ATOM 156 CA TYR A 11 5.220 4.406 -6.934 1.00 0.00 C ATOM 157 C TYR A 11 5.713 3.207 -6.116 1.00 0.00 C ATOM 158 O TYR A 11 6.842 3.205 -5.663 1.00 0.00 O ATOM 159 CB TYR A 11 4.322 5.316 -6.043 1.00 0.00 C ATOM 160 CG TYR A 11 5.063 5.894 -4.813 1.00 0.00 C ATOM 161 CD1 TYR A 11 6.098 6.814 -4.975 1.00 0.00 C ATOM 162 CD2 TYR A 11 4.756 5.504 -3.508 1.00 0.00 C ATOM 163 CE1 TYR A 11 6.795 7.318 -3.903 1.00 0.00 C ATOM 164 CE2 TYR A 11 5.449 6.018 -2.428 1.00 0.00 C ATOM 165 CZ TYR A 11 6.470 6.919 -2.633 1.00 0.00 C ATOM 166 OH TYR A 11 7.177 7.418 -1.564 1.00 0.00 O ATOM 0 H TYR A 11 3.521 4.151 -8.147 1.00 0.00 H new ATOM 0 HA TYR A 11 6.067 5.006 -7.266 1.00 0.00 H new ATOM 0 HB2 TYR A 11 3.939 6.139 -6.647 1.00 0.00 H new ATOM 0 HB3 TYR A 11 3.460 4.742 -5.702 1.00 0.00 H new ATOM 0 HD1 TYR A 11 6.359 7.140 -5.971 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.964 4.789 -3.340 1.00 0.00 H new ATOM 0 HE1 TYR A 11 7.596 8.026 -4.061 1.00 0.00 H new ATOM 0 HE2 TYR A 11 5.190 5.713 -1.425 1.00 0.00 H new ATOM 0 HH TYR A 11 6.814 7.051 -0.731 1.00 0.00 H new ATOM 176 N LEU A 12 4.848 2.192 -5.960 1.00 0.00 N ATOM 177 CA LEU A 12 5.161 0.953 -5.215 1.00 0.00 C ATOM 178 C LEU A 12 6.268 0.147 -5.888 1.00 0.00 C ATOM 179 O LEU A 12 7.078 -0.466 -5.208 1.00 0.00 O ATOM 180 CB LEU A 12 3.901 0.075 -5.064 1.00 0.00 C ATOM 181 CG LEU A 12 2.829 0.618 -4.083 1.00 0.00 C ATOM 182 CD1 LEU A 12 1.533 -0.190 -4.186 1.00 0.00 C ATOM 183 CD2 LEU A 12 3.367 0.641 -2.633 1.00 0.00 C ATOM 0 H LEU A 12 3.905 2.204 -6.348 1.00 0.00 H new ATOM 0 HA LEU A 12 5.513 1.255 -4.229 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.443 -0.047 -6.046 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.207 -0.916 -4.730 1.00 0.00 H new ATOM 0 HG LEU A 12 2.600 1.645 -4.366 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.798 0.211 -3.488 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.143 -0.124 -5.202 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.734 -1.233 -3.942 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.596 1.026 -1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.638 -0.370 -2.330 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.246 1.284 -2.581 1.00 0.00 H new ATOM 195 N GLU A 13 6.271 0.155 -7.229 1.00 0.00 N ATOM 196 CA GLU A 13 7.301 -0.509 -8.040 1.00 0.00 C ATOM 197 C GLU A 13 8.678 0.136 -7.814 1.00 0.00 C ATOM 198 O GLU A 13 9.654 -0.560 -7.514 1.00 0.00 O ATOM 199 CB GLU A 13 6.896 -0.474 -9.541 1.00 0.00 C ATOM 200 CG GLU A 13 5.724 -1.413 -9.894 1.00 0.00 C ATOM 201 CD GLU A 13 6.102 -2.901 -9.741 1.00 0.00 C ATOM 202 OE1 GLU A 13 6.805 -3.428 -10.630 1.00 0.00 O ATOM 203 OE2 GLU A 13 5.744 -3.542 -8.718 1.00 0.00 O ATOM 0 H GLU A 13 5.555 0.625 -7.784 1.00 0.00 H new ATOM 0 HA GLU A 13 7.377 -1.551 -7.730 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.625 0.547 -9.810 1.00 0.00 H new ATOM 0 HB3 GLU A 13 7.761 -0.744 -10.147 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.874 -1.188 -9.250 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.406 -1.224 -10.919 1.00 0.00 H new ATOM 210 N SER A 14 8.727 1.468 -7.914 1.00 0.00 N ATOM 211 CA SER A 14 9.973 2.246 -7.782 1.00 0.00 C ATOM 212 C SER A 14 10.496 2.222 -6.318 1.00 0.00 C ATOM 213 O SER A 14 11.708 2.081 -6.076 1.00 0.00 O ATOM 214 CB SER A 14 9.721 3.682 -8.271 1.00 0.00 C ATOM 215 OG SER A 14 10.917 4.431 -8.352 1.00 0.00 O ATOM 0 H SER A 14 7.903 2.043 -8.089 1.00 0.00 H new ATOM 0 HA SER A 14 10.750 1.794 -8.399 1.00 0.00 H new ATOM 0 HB2 SER A 14 9.244 3.653 -9.251 1.00 0.00 H new ATOM 0 HB3 SER A 14 9.027 4.179 -7.593 1.00 0.00 H new ATOM 0 HG SER A 14 10.715 5.337 -8.668 1.00 0.00 H new ATOM 221 N TRP A 15 9.550 2.331 -5.369 1.00 0.00 N ATOM 222 CA TRP A 15 9.790 2.210 -3.912 1.00 0.00 C ATOM 223 C TRP A 15 10.299 0.794 -3.563 1.00 0.00 C ATOM 224 O TRP A 15 11.139 0.633 -2.676 1.00 0.00 O ATOM 225 CB TRP A 15 8.470 2.533 -3.143 1.00 0.00 C ATOM 226 CG TRP A 15 8.510 2.324 -1.644 1.00 0.00 C ATOM 227 CD1 TRP A 15 9.029 3.173 -0.706 1.00 0.00 C ATOM 228 CD2 TRP A 15 8.005 1.190 -0.920 1.00 0.00 C ATOM 229 NE1 TRP A 15 8.867 2.641 0.546 1.00 0.00 N ATOM 230 CE2 TRP A 15 8.246 1.424 0.441 1.00 0.00 C ATOM 231 CE3 TRP A 15 7.360 0.008 -1.302 1.00 0.00 C ATOM 232 CZ2 TRP A 15 7.875 0.517 1.427 1.00 0.00 C ATOM 233 CZ3 TRP A 15 7.002 -0.897 -0.325 1.00 0.00 C ATOM 234 CH2 TRP A 15 7.255 -0.635 1.031 1.00 0.00 C ATOM 0 H TRP A 15 8.572 2.510 -5.595 1.00 0.00 H new ATOM 0 HA TRP A 15 10.559 2.922 -3.612 1.00 0.00 H new ATOM 0 HB2 TRP A 15 8.203 3.572 -3.339 1.00 0.00 H new ATOM 0 HB3 TRP A 15 7.672 1.916 -3.555 1.00 0.00 H new ATOM 0 HD1 TRP A 15 9.497 4.122 -0.920 1.00 0.00 H new ATOM 0 HE1 TRP A 15 9.162 3.081 1.418 1.00 0.00 H new ATOM 0 HE3 TRP A 15 7.147 -0.191 -2.342 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 8.070 0.716 2.470 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 6.520 -1.821 -0.607 1.00 0.00 H new ATOM 0 HH2 TRP A 15 6.954 -1.357 1.775 1.00 0.00 H new ATOM 245 N PHE A 16 9.775 -0.223 -4.285 1.00 0.00 N ATOM 246 CA PHE A 16 10.169 -1.628 -4.102 1.00 0.00 C ATOM 247 C PHE A 16 11.645 -1.856 -4.488 1.00 0.00 C ATOM 248 O PHE A 16 12.344 -2.607 -3.796 1.00 0.00 O ATOM 249 CB PHE A 16 9.253 -2.588 -4.903 1.00 0.00 C ATOM 250 CG PHE A 16 9.650 -4.048 -4.744 1.00 0.00 C ATOM 251 CD1 PHE A 16 9.498 -4.683 -3.522 1.00 0.00 C ATOM 252 CD2 PHE A 16 10.226 -4.763 -5.795 1.00 0.00 C ATOM 253 CE1 PHE A 16 9.903 -5.976 -3.362 1.00 0.00 C ATOM 254 CE2 PHE A 16 10.637 -6.057 -5.629 1.00 0.00 C ATOM 255 CZ PHE A 16 10.473 -6.666 -4.417 1.00 0.00 C ATOM 0 H PHE A 16 9.069 -0.087 -5.008 1.00 0.00 H new ATOM 0 HA PHE A 16 10.053 -1.852 -3.042 1.00 0.00 H new ATOM 0 HB2 PHE A 16 8.222 -2.458 -4.574 1.00 0.00 H new ATOM 0 HB3 PHE A 16 9.287 -2.319 -5.959 1.00 0.00 H new ATOM 0 HD1 PHE A 16 9.057 -4.152 -2.692 1.00 0.00 H new ATOM 0 HD2 PHE A 16 10.349 -4.286 -6.756 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.778 -6.464 -2.406 1.00 0.00 H new ATOM 0 HE2 PHE A 16 11.088 -6.594 -6.450 1.00 0.00 H new ATOM 0 HZ PHE A 16 10.789 -7.690 -4.282 1.00 0.00 H new ATOM 265 N ASN A 17 12.109 -1.205 -5.580 1.00 0.00 N ATOM 266 CA ASN A 17 13.531 -1.283 -6.011 1.00 0.00 C ATOM 267 C ASN A 17 14.460 -0.850 -4.857 1.00 0.00 C ATOM 268 O ASN A 17 15.480 -1.494 -4.597 1.00 0.00 O ATOM 269 CB ASN A 17 13.808 -0.418 -7.272 1.00 0.00 C ATOM 270 CG ASN A 17 13.142 -0.951 -8.546 1.00 0.00 C ATOM 271 OD1 ASN A 17 11.959 -0.473 -8.863 1.00 0.00 O flip ATOM 272 ND2 ASN A 17 13.697 -1.787 -9.247 1.00 0.00 N flip ATOM 0 H ASN A 17 11.525 -0.621 -6.179 1.00 0.00 H new ATOM 0 HA ASN A 17 13.736 -2.321 -6.275 1.00 0.00 H new ATOM 0 HB2 ASN A 17 13.459 0.598 -7.088 1.00 0.00 H new ATOM 0 HB3 ASN A 17 14.885 -0.361 -7.433 1.00 0.00 H new ATOM 0 HD21 ASN A 17 14.615 -2.145 -8.984 1.00 0.00 H new ATOM 0 HD22 ASN A 17 13.242 -2.125 -10.095 1.00 0.00 H new ATOM 279 N THR A 18 14.048 0.223 -4.155 1.00 0.00 N ATOM 280 CA THR A 18 14.731 0.743 -2.958 1.00 0.00 C ATOM 281 C THR A 18 14.603 -0.235 -1.768 1.00 0.00 C ATOM 282 O THR A 18 15.566 -0.460 -1.021 1.00 0.00 O ATOM 283 CB THR A 18 14.113 2.121 -2.546 1.00 0.00 C ATOM 284 OG1 THR A 18 14.045 2.975 -3.696 1.00 0.00 O ATOM 285 CG2 THR A 18 14.919 2.818 -1.426 1.00 0.00 C ATOM 0 H THR A 18 13.219 0.760 -4.409 1.00 0.00 H new ATOM 0 HA THR A 18 15.786 0.861 -3.205 1.00 0.00 H new ATOM 0 HB THR A 18 13.114 1.930 -2.154 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.657 3.838 -3.440 1.00 0.00 H new ATOM 0 HG21 THR A 18 14.449 3.769 -1.177 1.00 0.00 H new ATOM 0 HG22 THR A 18 14.939 2.181 -0.542 1.00 0.00 H new ATOM 0 HG23 THR A 18 15.938 2.996 -1.768 1.00 0.00 H new ATOM 293 N LYS A 19 13.402 -0.831 -1.638 1.00 0.00 N ATOM 294 CA LYS A 19 13.003 -1.651 -0.477 1.00 0.00 C ATOM 295 C LYS A 19 13.832 -2.944 -0.387 1.00 0.00 C ATOM 296 O LYS A 19 14.119 -3.426 0.708 1.00 0.00 O ATOM 297 CB LYS A 19 11.481 -1.971 -0.572 1.00 0.00 C ATOM 298 CG LYS A 19 10.859 -2.597 0.693 1.00 0.00 C ATOM 299 CD LYS A 19 10.991 -1.668 1.921 1.00 0.00 C ATOM 300 CE LYS A 19 10.273 -2.205 3.161 1.00 0.00 C ATOM 301 NZ LYS A 19 10.498 -1.337 4.339 1.00 0.00 N ATOM 0 H LYS A 19 12.672 -0.756 -2.346 1.00 0.00 H new ATOM 0 HA LYS A 19 13.197 -1.085 0.434 1.00 0.00 H new ATOM 0 HB2 LYS A 19 10.946 -1.049 -0.802 1.00 0.00 H new ATOM 0 HB3 LYS A 19 11.321 -2.650 -1.410 1.00 0.00 H new ATOM 0 HG2 LYS A 19 9.806 -2.811 0.512 1.00 0.00 H new ATOM 0 HG3 LYS A 19 11.346 -3.549 0.904 1.00 0.00 H new ATOM 0 HD2 LYS A 19 12.047 -1.529 2.152 1.00 0.00 H new ATOM 0 HD3 LYS A 19 10.588 -0.687 1.672 1.00 0.00 H new ATOM 0 HE2 LYS A 19 9.204 -2.277 2.960 1.00 0.00 H new ATOM 0 HE3 LYS A 19 10.626 -3.213 3.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 10.587 -1.925 5.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 11.371 -0.788 4.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.694 -0.687 4.450 1.00 0.00 H new ATOM 315 N ARG A 20 14.217 -3.472 -1.561 1.00 0.00 N ATOM 316 CA ARG A 20 15.090 -4.661 -1.704 1.00 0.00 C ATOM 317 C ARG A 20 16.446 -4.509 -0.965 1.00 0.00 C ATOM 318 O ARG A 20 17.075 -5.504 -0.611 1.00 0.00 O ATOM 319 CB ARG A 20 15.344 -4.923 -3.212 1.00 0.00 C ATOM 320 CG ARG A 20 14.086 -5.329 -4.010 1.00 0.00 C ATOM 321 CD ARG A 20 14.326 -5.387 -5.531 1.00 0.00 C ATOM 322 NE ARG A 20 15.358 -6.372 -5.912 1.00 0.00 N ATOM 323 CZ ARG A 20 15.680 -6.715 -7.173 1.00 0.00 C ATOM 324 NH1 ARG A 20 15.061 -6.169 -8.211 1.00 0.00 N ATOM 325 NH2 ARG A 20 16.636 -7.602 -7.387 1.00 0.00 N ATOM 0 H ARG A 20 13.927 -3.081 -2.457 1.00 0.00 H new ATOM 0 HA ARG A 20 14.573 -5.503 -1.244 1.00 0.00 H new ATOM 0 HB2 ARG A 20 15.768 -4.023 -3.658 1.00 0.00 H new ATOM 0 HB3 ARG A 20 16.092 -5.710 -3.311 1.00 0.00 H new ATOM 0 HG2 ARG A 20 13.744 -6.305 -3.665 1.00 0.00 H new ATOM 0 HG3 ARG A 20 13.286 -4.619 -3.801 1.00 0.00 H new ATOM 0 HD2 ARG A 20 13.391 -5.636 -6.032 1.00 0.00 H new ATOM 0 HD3 ARG A 20 14.624 -4.400 -5.885 1.00 0.00 H new ATOM 0 HE ARG A 20 15.869 -6.830 -5.157 1.00 0.00 H new ATOM 0 HH11 ARG A 20 14.327 -5.477 -8.061 1.00 0.00 H new ATOM 0 HH12 ARG A 20 15.319 -6.441 -9.160 1.00 0.00 H new ATOM 0 HH21 ARG A 20 17.126 -8.024 -6.598 1.00 0.00 H new ATOM 0 HH22 ARG A 20 16.883 -7.865 -8.341 1.00 0.00 H new ATOM 339 N HIS A 21 16.892 -3.255 -0.767 1.00 0.00 N ATOM 340 CA HIS A 21 18.164 -2.944 -0.075 1.00 0.00 C ATOM 341 C HIS A 21 17.991 -2.953 1.460 1.00 0.00 C ATOM 342 O HIS A 21 18.977 -3.055 2.195 1.00 0.00 O ATOM 343 CB HIS A 21 18.711 -1.574 -0.555 1.00 0.00 C ATOM 344 CG HIS A 21 19.005 -1.520 -2.031 1.00 0.00 C ATOM 345 ND1 HIS A 21 20.269 -1.333 -2.544 1.00 0.00 N ATOM 346 CD2 HIS A 21 18.186 -1.628 -3.100 1.00 0.00 C ATOM 347 CE1 HIS A 21 20.212 -1.331 -3.856 1.00 0.00 C ATOM 348 NE2 HIS A 21 18.959 -1.508 -4.219 1.00 0.00 N ATOM 0 H HIS A 21 16.384 -2.428 -1.080 1.00 0.00 H new ATOM 0 HA HIS A 21 18.885 -3.722 -0.328 1.00 0.00 H new ATOM 0 HB2 HIS A 21 17.986 -0.798 -0.310 1.00 0.00 H new ATOM 0 HB3 HIS A 21 19.623 -1.344 -0.004 1.00 0.00 H new ATOM 0 HD2 HIS A 21 17.117 -1.781 -3.074 1.00 0.00 H new ATOM 0 HE1 HIS A 21 21.051 -1.205 -4.524 1.00 0.00 H new ATOM 0 HE2 HIS A 21 18.621 -1.549 -5.180 1.00 0.00 H new ATOM 357 N SER A 22 16.735 -2.832 1.927 1.00 0.00 N ATOM 358 CA SER A 22 16.384 -2.891 3.359 1.00 0.00 C ATOM 359 C SER A 22 15.976 -4.322 3.776 1.00 0.00 C ATOM 360 O SER A 22 16.310 -4.782 4.879 1.00 0.00 O ATOM 361 CB SER A 22 15.232 -1.895 3.635 1.00 0.00 C ATOM 362 OG SER A 22 15.586 -0.579 3.246 1.00 0.00 O ATOM 0 H SER A 22 15.929 -2.690 1.318 1.00 0.00 H new ATOM 0 HA SER A 22 17.257 -2.616 3.951 1.00 0.00 H new ATOM 0 HB2 SER A 22 14.339 -2.209 3.094 1.00 0.00 H new ATOM 0 HB3 SER A 22 14.983 -1.908 4.696 1.00 0.00 H new ATOM 0 HG SER A 22 14.839 0.029 3.430 1.00 0.00 H new ATOM 368 N VAL A 23 15.258 -5.025 2.877 1.00 0.00 N ATOM 369 CA VAL A 23 14.697 -6.374 3.144 1.00 0.00 C ATOM 370 C VAL A 23 15.466 -7.445 2.347 1.00 0.00 C ATOM 371 O VAL A 23 16.110 -7.137 1.343 1.00 0.00 O ATOM 372 CB VAL A 23 13.153 -6.442 2.804 1.00 0.00 C ATOM 373 CG1 VAL A 23 12.366 -5.322 3.537 1.00 0.00 C ATOM 374 CG2 VAL A 23 12.879 -6.403 1.271 1.00 0.00 C ATOM 0 H VAL A 23 15.048 -4.676 1.942 1.00 0.00 H new ATOM 0 HA VAL A 23 14.812 -6.573 4.209 1.00 0.00 H new ATOM 0 HB VAL A 23 12.795 -7.406 3.167 1.00 0.00 H new ATOM 0 HG11 VAL A 23 11.308 -5.395 3.283 1.00 0.00 H new ATOM 0 HG12 VAL A 23 12.490 -5.436 4.614 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.747 -4.348 3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 23 11.805 -6.452 1.092 1.00 0.00 H new ATOM 0 HG22 VAL A 23 13.274 -5.477 0.854 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.366 -7.253 0.793 1.00 0.00 H new ATOM 384 N GLY A 24 15.403 -8.703 2.813 1.00 0.00 N ATOM 385 CA GLY A 24 16.050 -9.824 2.123 1.00 0.00 C ATOM 386 C GLY A 24 15.329 -10.234 0.841 1.00 0.00 C ATOM 387 O GLY A 24 14.252 -9.711 0.538 1.00 0.00 O ATOM 0 H GLY A 24 14.909 -8.966 3.666 1.00 0.00 H new ATOM 0 HA2 GLY A 24 17.078 -9.551 1.883 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.096 -10.680 2.797 1.00 0.00 H new ATOM 391 N ILE A 25 15.937 -11.181 0.103 1.00 0.00 N ATOM 392 CA ILE A 25 15.431 -11.674 -1.201 1.00 0.00 C ATOM 393 C ILE A 25 14.001 -12.255 -1.066 1.00 0.00 C ATOM 394 O ILE A 25 13.115 -11.965 -1.885 1.00 0.00 O ATOM 395 CB ILE A 25 16.387 -12.785 -1.800 1.00 0.00 C ATOM 396 CG1 ILE A 25 17.874 -12.294 -1.890 1.00 0.00 C ATOM 397 CG2 ILE A 25 15.884 -13.301 -3.180 1.00 0.00 C ATOM 398 CD1 ILE A 25 18.111 -11.105 -2.798 1.00 0.00 C ATOM 0 H ILE A 25 16.803 -11.633 0.395 1.00 0.00 H new ATOM 0 HA ILE A 25 15.406 -10.819 -1.877 1.00 0.00 H new ATOM 0 HB ILE A 25 16.361 -13.624 -1.105 1.00 0.00 H new ATOM 0 HG12 ILE A 25 18.216 -12.038 -0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 25 18.492 -13.123 -2.235 1.00 0.00 H new ATOM 0 HG21 ILE A 25 16.568 -14.062 -3.555 1.00 0.00 H new ATOM 0 HG22 ILE A 25 14.889 -13.732 -3.067 1.00 0.00 H new ATOM 0 HG23 ILE A 25 15.842 -12.471 -3.885 1.00 0.00 H new ATOM 0 HD11 ILE A 25 19.170 -10.846 -2.789 1.00 0.00 H new ATOM 0 HD12 ILE A 25 17.807 -11.357 -3.814 1.00 0.00 H new ATOM 0 HD13 ILE A 25 17.527 -10.255 -2.445 1.00 0.00 H new ATOM 410 N GLN A 26 13.797 -13.050 0.005 1.00 0.00 N ATOM 411 CA GLN A 26 12.518 -13.725 0.269 1.00 0.00 C ATOM 412 C GLN A 26 11.417 -12.689 0.567 1.00 0.00 C ATOM 413 O GLN A 26 10.353 -12.718 -0.055 1.00 0.00 O ATOM 414 CB GLN A 26 12.656 -14.755 1.431 1.00 0.00 C ATOM 415 CG GLN A 26 13.030 -14.157 2.809 1.00 0.00 C ATOM 416 CD GLN A 26 13.083 -15.167 3.957 1.00 0.00 C ATOM 417 OE1 GLN A 26 12.751 -14.840 5.101 1.00 0.00 O ATOM 418 NE2 GLN A 26 13.532 -16.384 3.683 1.00 0.00 N ATOM 0 H GLN A 26 14.514 -13.239 0.706 1.00 0.00 H new ATOM 0 HA GLN A 26 12.231 -14.279 -0.625 1.00 0.00 H new ATOM 0 HB2 GLN A 26 11.713 -15.292 1.531 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.413 -15.489 1.155 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.003 -13.672 2.726 1.00 0.00 H new ATOM 0 HG3 GLN A 26 12.307 -13.381 3.060 1.00 0.00 H new ATOM 0 HE21 GLN A 26 13.799 -16.626 2.729 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.610 -17.078 4.426 1.00 0.00 H new ATOM 427 N THR A 27 11.724 -11.737 1.474 1.00 0.00 N ATOM 428 CA THR A 27 10.782 -10.704 1.922 1.00 0.00 C ATOM 429 C THR A 27 10.410 -9.764 0.767 1.00 0.00 C ATOM 430 O THR A 27 9.279 -9.305 0.684 1.00 0.00 O ATOM 431 CB THR A 27 11.378 -9.875 3.100 1.00 0.00 C ATOM 432 OG1 THR A 27 11.932 -10.768 4.077 1.00 0.00 O ATOM 433 CG2 THR A 27 10.320 -8.978 3.776 1.00 0.00 C ATOM 0 H THR A 27 12.641 -11.668 1.916 1.00 0.00 H new ATOM 0 HA THR A 27 9.882 -11.211 2.270 1.00 0.00 H new ATOM 0 HB THR A 27 12.151 -9.226 2.688 1.00 0.00 H new ATOM 0 HG1 THR A 27 12.309 -10.249 4.818 1.00 0.00 H new ATOM 0 HG21 THR A 27 10.783 -8.420 4.590 1.00 0.00 H new ATOM 0 HG22 THR A 27 9.913 -8.281 3.044 1.00 0.00 H new ATOM 0 HG23 THR A 27 9.516 -9.599 4.172 1.00 0.00 H new ATOM 441 N ALA A 28 11.374 -9.534 -0.133 1.00 0.00 N ATOM 442 CA ALA A 28 11.169 -8.735 -1.340 1.00 0.00 C ATOM 443 C ALA A 28 10.061 -9.371 -2.204 1.00 0.00 C ATOM 444 O ALA A 28 9.063 -8.724 -2.540 1.00 0.00 O ATOM 445 CB ALA A 28 12.491 -8.601 -2.117 1.00 0.00 C ATOM 0 H ALA A 28 12.322 -9.900 -0.041 1.00 0.00 H new ATOM 0 HA ALA A 28 10.846 -7.731 -1.064 1.00 0.00 H new ATOM 0 HB1 ALA A 28 12.327 -8.004 -3.014 1.00 0.00 H new ATOM 0 HB2 ALA A 28 13.235 -8.113 -1.488 1.00 0.00 H new ATOM 0 HB3 ALA A 28 12.848 -9.591 -2.400 1.00 0.00 H new ATOM 451 N LYS A 29 10.220 -10.671 -2.477 1.00 0.00 N ATOM 452 CA LYS A 29 9.264 -11.459 -3.278 1.00 0.00 C ATOM 453 C LYS A 29 7.860 -11.493 -2.602 1.00 0.00 C ATOM 454 O LYS A 29 6.829 -11.465 -3.291 1.00 0.00 O ATOM 455 CB LYS A 29 9.874 -12.877 -3.505 1.00 0.00 C ATOM 456 CG LYS A 29 9.129 -13.820 -4.502 1.00 0.00 C ATOM 457 CD LYS A 29 7.967 -14.627 -3.869 1.00 0.00 C ATOM 458 CE LYS A 29 8.431 -15.517 -2.703 1.00 0.00 C ATOM 459 NZ LYS A 29 7.319 -16.310 -2.137 1.00 0.00 N ATOM 0 H LYS A 29 11.019 -11.213 -2.148 1.00 0.00 H new ATOM 0 HA LYS A 29 9.102 -10.995 -4.251 1.00 0.00 H new ATOM 0 HB2 LYS A 29 10.898 -12.752 -3.858 1.00 0.00 H new ATOM 0 HB3 LYS A 29 9.929 -13.380 -2.540 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.735 -13.222 -5.324 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.849 -14.517 -4.931 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.202 -13.937 -3.512 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.503 -15.249 -4.634 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.216 -16.189 -3.050 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.867 -14.894 -1.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.674 -16.896 -1.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.581 -15.669 -1.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.919 -16.924 -2.875 1.00 0.00 H new ATOM 473 N VAL A 30 7.847 -11.494 -1.253 1.00 0.00 N ATOM 474 CA VAL A 30 6.604 -11.482 -0.445 1.00 0.00 C ATOM 475 C VAL A 30 5.841 -10.142 -0.613 1.00 0.00 C ATOM 476 O VAL A 30 4.651 -10.140 -0.970 1.00 0.00 O ATOM 477 CB VAL A 30 6.917 -11.742 1.083 1.00 0.00 C ATOM 478 CG1 VAL A 30 5.658 -11.583 1.971 1.00 0.00 C ATOM 479 CG2 VAL A 30 7.551 -13.137 1.286 1.00 0.00 C ATOM 0 H VAL A 30 8.698 -11.503 -0.690 1.00 0.00 H new ATOM 0 HA VAL A 30 5.969 -12.289 -0.810 1.00 0.00 H new ATOM 0 HB VAL A 30 7.634 -10.983 1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.921 -11.771 3.012 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.269 -10.570 1.872 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.897 -12.296 1.655 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.757 -13.292 2.345 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.862 -13.905 0.934 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.482 -13.199 0.722 1.00 0.00 H new ATOM 489 N LEU A 31 6.558 -9.016 -0.388 1.00 0.00 N ATOM 490 CA LEU A 31 5.973 -7.655 -0.397 1.00 0.00 C ATOM 491 C LEU A 31 5.396 -7.317 -1.778 1.00 0.00 C ATOM 492 O LEU A 31 4.262 -6.856 -1.876 1.00 0.00 O ATOM 493 CB LEU A 31 7.020 -6.575 0.008 1.00 0.00 C ATOM 494 CG LEU A 31 7.665 -6.721 1.426 1.00 0.00 C ATOM 495 CD1 LEU A 31 8.653 -5.569 1.710 1.00 0.00 C ATOM 496 CD2 LEU A 31 6.593 -6.832 2.537 1.00 0.00 C ATOM 0 H LEU A 31 7.560 -9.026 -0.195 1.00 0.00 H new ATOM 0 HA LEU A 31 5.170 -7.649 0.340 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.820 -6.582 -0.732 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.541 -5.598 -0.049 1.00 0.00 H new ATOM 0 HG LEU A 31 8.230 -7.653 1.432 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.086 -5.697 2.702 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.447 -5.579 0.964 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.124 -4.617 1.665 1.00 0.00 H new ATOM 0 HD21 LEU A 31 7.082 -6.932 3.506 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.972 -5.936 2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.969 -7.706 2.354 1.00 0.00 H new ATOM 508 N LYS A 32 6.179 -7.613 -2.832 1.00 0.00 N ATOM 509 CA LYS A 32 5.801 -7.321 -4.229 1.00 0.00 C ATOM 510 C LYS A 32 4.585 -8.164 -4.649 1.00 0.00 C ATOM 511 O LYS A 32 3.726 -7.699 -5.410 1.00 0.00 O ATOM 512 CB LYS A 32 6.982 -7.611 -5.183 1.00 0.00 C ATOM 513 CG LYS A 32 6.770 -7.116 -6.634 1.00 0.00 C ATOM 514 CD LYS A 32 7.874 -7.593 -7.599 1.00 0.00 C ATOM 515 CE LYS A 32 7.731 -7.007 -9.009 1.00 0.00 C ATOM 516 NZ LYS A 32 7.901 -5.537 -9.020 1.00 0.00 N ATOM 0 H LYS A 32 7.091 -8.061 -2.740 1.00 0.00 H new ATOM 0 HA LYS A 32 5.541 -6.264 -4.292 1.00 0.00 H new ATOM 0 HB2 LYS A 32 7.881 -7.144 -4.781 1.00 0.00 H new ATOM 0 HB3 LYS A 32 7.162 -8.686 -5.202 1.00 0.00 H new ATOM 0 HG2 LYS A 32 5.803 -7.467 -6.994 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.736 -6.027 -6.639 1.00 0.00 H new ATOM 0 HD2 LYS A 32 8.847 -7.317 -7.194 1.00 0.00 H new ATOM 0 HD3 LYS A 32 7.851 -8.681 -7.660 1.00 0.00 H new ATOM 0 HE2 LYS A 32 8.471 -7.462 -9.667 1.00 0.00 H new ATOM 0 HE3 LYS A 32 6.749 -7.261 -9.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 8.034 -5.210 -9.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 7.055 -5.087 -8.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 8.734 -5.280 -8.453 1.00 0.00 H new ATOM 530 N GLY A 33 4.541 -9.408 -4.127 1.00 0.00 N ATOM 531 CA GLY A 33 3.421 -10.317 -4.357 1.00 0.00 C ATOM 532 C GLY A 33 2.104 -9.756 -3.843 1.00 0.00 C ATOM 533 O GLY A 33 1.072 -9.882 -4.498 1.00 0.00 O ATOM 0 H GLY A 33 5.279 -9.799 -3.541 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.334 -10.520 -5.424 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.623 -11.269 -3.867 1.00 0.00 H new ATOM 537 N TYR A 34 2.165 -9.097 -2.674 1.00 0.00 N ATOM 538 CA TYR A 34 1.010 -8.420 -2.072 1.00 0.00 C ATOM 539 C TYR A 34 0.672 -7.120 -2.817 1.00 0.00 C ATOM 540 O TYR A 34 -0.510 -6.818 -3.021 1.00 0.00 O ATOM 541 CB TYR A 34 1.269 -8.119 -0.577 1.00 0.00 C ATOM 542 CG TYR A 34 1.266 -9.355 0.333 1.00 0.00 C ATOM 543 CD1 TYR A 34 0.242 -10.301 0.242 1.00 0.00 C ATOM 544 CD2 TYR A 34 2.249 -9.553 1.304 1.00 0.00 C ATOM 545 CE1 TYR A 34 0.212 -11.404 1.068 1.00 0.00 C ATOM 546 CE2 TYR A 34 2.219 -10.652 2.134 1.00 0.00 C ATOM 547 CZ TYR A 34 1.201 -11.570 2.016 1.00 0.00 C ATOM 548 OH TYR A 34 1.175 -12.664 2.842 1.00 0.00 O ATOM 0 H TYR A 34 3.019 -9.020 -2.121 1.00 0.00 H new ATOM 0 HA TYR A 34 0.157 -9.094 -2.155 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.232 -7.617 -0.482 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.510 -7.422 -0.223 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.541 -10.165 -0.489 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.047 -8.832 1.406 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -0.579 -12.133 0.974 1.00 0.00 H new ATOM 0 HE2 TYR A 34 2.992 -10.793 2.875 1.00 0.00 H new ATOM 0 HH TYR A 34 1.942 -12.632 3.451 1.00 0.00 H new ATOM 558 N LEU A 35 1.715 -6.370 -3.233 1.00 0.00 N ATOM 559 CA LEU A 35 1.546 -5.057 -3.886 1.00 0.00 C ATOM 560 C LEU A 35 0.755 -5.204 -5.192 1.00 0.00 C ATOM 561 O LEU A 35 -0.333 -4.645 -5.320 1.00 0.00 O ATOM 562 CB LEU A 35 2.920 -4.365 -4.134 1.00 0.00 C ATOM 563 CG LEU A 35 3.682 -3.892 -2.851 1.00 0.00 C ATOM 564 CD1 LEU A 35 5.028 -3.210 -3.196 1.00 0.00 C ATOM 565 CD2 LEU A 35 2.788 -2.980 -1.977 1.00 0.00 C ATOM 0 H LEU A 35 2.688 -6.655 -3.126 1.00 0.00 H new ATOM 0 HA LEU A 35 0.977 -4.416 -3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.561 -5.056 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.760 -3.501 -4.779 1.00 0.00 H new ATOM 0 HG LEU A 35 3.920 -4.781 -2.267 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.524 -2.897 -2.277 1.00 0.00 H new ATOM 0 HD12 LEU A 35 5.666 -3.914 -3.731 1.00 0.00 H new ATOM 0 HD13 LEU A 35 4.844 -2.338 -3.824 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.343 -2.666 -1.093 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.493 -2.102 -2.551 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.897 -3.529 -1.671 1.00 0.00 H new ATOM 577 N ASN A 36 1.283 -6.017 -6.115 1.00 0.00 N ATOM 578 CA ASN A 36 0.719 -6.173 -7.476 1.00 0.00 C ATOM 579 C ASN A 36 -0.617 -6.940 -7.473 1.00 0.00 C ATOM 580 O ASN A 36 -1.468 -6.692 -8.332 1.00 0.00 O ATOM 581 CB ASN A 36 1.752 -6.837 -8.420 1.00 0.00 C ATOM 582 CG ASN A 36 2.934 -5.910 -8.721 1.00 0.00 C ATOM 583 OD1 ASN A 36 2.926 -5.164 -9.701 1.00 0.00 O ATOM 584 ND2 ASN A 36 3.946 -5.922 -7.870 1.00 0.00 N ATOM 0 H ASN A 36 2.112 -6.587 -5.947 1.00 0.00 H new ATOM 0 HA ASN A 36 0.500 -5.175 -7.854 1.00 0.00 H new ATOM 0 HB2 ASN A 36 2.120 -7.757 -7.965 1.00 0.00 H new ATOM 0 HB3 ASN A 36 1.263 -7.116 -9.353 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.744 -5.304 -8.018 1.00 0.00 H new ATOM 0 HD22 ASN A 36 3.929 -6.549 -7.066 1.00 0.00 H new ATOM 591 N SER A 37 -0.808 -7.848 -6.496 1.00 0.00 N ATOM 592 CA SER A 37 -2.048 -8.645 -6.384 1.00 0.00 C ATOM 593 C SER A 37 -3.202 -7.790 -5.840 1.00 0.00 C ATOM 594 O SER A 37 -4.302 -7.789 -6.395 1.00 0.00 O ATOM 595 CB SER A 37 -1.832 -9.874 -5.465 1.00 0.00 C ATOM 596 OG SER A 37 -3.013 -10.655 -5.315 1.00 0.00 O ATOM 0 H SER A 37 -0.119 -8.049 -5.771 1.00 0.00 H new ATOM 0 HA SER A 37 -2.308 -8.992 -7.384 1.00 0.00 H new ATOM 0 HB2 SER A 37 -1.038 -10.497 -5.877 1.00 0.00 H new ATOM 0 HB3 SER A 37 -1.496 -9.536 -4.485 1.00 0.00 H new ATOM 0 HG SER A 37 -2.828 -11.419 -4.729 1.00 0.00 H new ATOM 602 N ARG A 38 -2.950 -7.098 -4.719 1.00 0.00 N ATOM 603 CA ARG A 38 -3.998 -6.410 -3.942 1.00 0.00 C ATOM 604 C ARG A 38 -4.075 -4.913 -4.255 1.00 0.00 C ATOM 605 O ARG A 38 -5.132 -4.413 -4.670 1.00 0.00 O ATOM 606 CB ARG A 38 -3.766 -6.652 -2.427 1.00 0.00 C ATOM 607 CG ARG A 38 -3.767 -8.144 -1.992 1.00 0.00 C ATOM 608 CD ARG A 38 -5.133 -8.861 -2.171 1.00 0.00 C ATOM 609 NE ARG A 38 -5.490 -9.143 -3.583 1.00 0.00 N ATOM 610 CZ ARG A 38 -6.513 -9.905 -3.986 1.00 0.00 C ATOM 611 NH1 ARG A 38 -7.267 -10.546 -3.109 1.00 0.00 N ATOM 612 NH2 ARG A 38 -6.764 -10.028 -5.277 1.00 0.00 N ATOM 0 H ARG A 38 -2.015 -6.998 -4.324 1.00 0.00 H new ATOM 0 HA ARG A 38 -4.960 -6.832 -4.233 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -2.811 -6.208 -2.146 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -4.540 -6.126 -1.868 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -3.011 -8.679 -2.567 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -3.472 -8.205 -0.944 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -5.113 -9.800 -1.618 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.915 -8.246 -1.726 1.00 0.00 H new ATOM 0 HE ARG A 38 -4.907 -8.721 -4.306 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -7.072 -10.463 -2.111 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -8.044 -11.124 -3.430 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -6.180 -9.544 -5.959 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.542 -10.607 -5.592 1.00 0.00 H new ATOM 626 N ILE A 39 -2.954 -4.198 -4.070 1.00 0.00 N ATOM 627 CA ILE A 39 -2.948 -2.728 -4.085 1.00 0.00 C ATOM 628 C ILE A 39 -3.002 -2.176 -5.532 1.00 0.00 C ATOM 629 O ILE A 39 -3.803 -1.300 -5.796 1.00 0.00 O ATOM 630 CB ILE A 39 -1.726 -2.093 -3.310 1.00 0.00 C ATOM 631 CG1 ILE A 39 -1.647 -2.552 -1.808 1.00 0.00 C ATOM 632 CG2 ILE A 39 -1.811 -0.549 -3.372 1.00 0.00 C ATOM 633 CD1 ILE A 39 -1.092 -3.940 -1.545 1.00 0.00 C ATOM 0 H ILE A 39 -2.038 -4.616 -3.908 1.00 0.00 H new ATOM 0 HA ILE A 39 -3.851 -2.430 -3.552 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.821 -2.447 -3.804 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.034 -1.833 -1.265 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.650 -2.501 -1.384 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.966 -0.116 -2.836 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.785 -0.225 -4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.741 -0.217 -2.911 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.091 -4.134 -0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.713 -4.681 -2.047 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.073 -4.003 -1.926 1.00 0.00 H new ATOM 645 N ILE A 40 -2.175 -2.716 -6.461 1.00 0.00 N ATOM 646 CA ILE A 40 -2.085 -2.217 -7.864 1.00 0.00 C ATOM 647 C ILE A 40 -3.493 -2.167 -8.569 1.00 0.00 C ATOM 648 O ILE A 40 -3.850 -1.104 -9.099 1.00 0.00 O ATOM 649 CB ILE A 40 -0.990 -3.003 -8.738 1.00 0.00 C ATOM 650 CG1 ILE A 40 0.442 -2.353 -8.625 1.00 0.00 C ATOM 651 CG2 ILE A 40 -1.388 -3.140 -10.237 1.00 0.00 C ATOM 652 CD1 ILE A 40 1.020 -2.255 -7.222 1.00 0.00 C ATOM 0 H ILE A 40 -1.555 -3.502 -6.266 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.731 -1.188 -7.798 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.954 -4.005 -8.311 1.00 0.00 H new ATOM 0 HG12 ILE A 40 1.131 -2.931 -9.241 1.00 0.00 H new ATOM 0 HG13 ILE A 40 0.399 -1.350 -9.050 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.607 -3.680 -10.773 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.327 -3.687 -10.315 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.508 -2.149 -10.674 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.006 -1.793 -7.266 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.362 -1.649 -6.599 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.106 -3.254 -6.794 1.00 0.00 H new ATOM 664 N PRO A 41 -4.335 -3.273 -8.557 1.00 0.00 N ATOM 665 CA PRO A 41 -5.693 -3.249 -9.167 1.00 0.00 C ATOM 666 C PRO A 41 -6.700 -2.348 -8.408 1.00 0.00 C ATOM 667 O PRO A 41 -7.730 -1.968 -8.972 1.00 0.00 O ATOM 668 CB PRO A 41 -6.140 -4.745 -9.156 1.00 0.00 C ATOM 669 CG PRO A 41 -4.886 -5.518 -8.883 1.00 0.00 C ATOM 670 CD PRO A 41 -4.057 -4.623 -7.999 1.00 0.00 C ATOM 0 HA PRO A 41 -5.667 -2.816 -10.167 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -6.892 -4.927 -8.388 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.582 -5.033 -10.110 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.106 -6.465 -8.390 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.360 -5.755 -9.808 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -4.353 -4.699 -6.953 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -2.997 -4.872 -8.049 1.00 0.00 H new ATOM 678 N SER A 42 -6.412 -2.019 -7.131 1.00 0.00 N ATOM 679 CA SER A 42 -7.327 -1.208 -6.295 1.00 0.00 C ATOM 680 C SER A 42 -6.873 0.274 -6.220 1.00 0.00 C ATOM 681 O SER A 42 -7.470 1.149 -6.859 1.00 0.00 O ATOM 682 CB SER A 42 -7.408 -1.826 -4.879 1.00 0.00 C ATOM 683 OG SER A 42 -7.758 -3.199 -4.938 1.00 0.00 O ATOM 0 H SER A 42 -5.555 -2.301 -6.656 1.00 0.00 H new ATOM 0 HA SER A 42 -8.315 -1.217 -6.755 1.00 0.00 H new ATOM 0 HB2 SER A 42 -6.448 -1.714 -4.375 1.00 0.00 H new ATOM 0 HB3 SER A 42 -8.145 -1.285 -4.285 1.00 0.00 H new ATOM 0 HG SER A 42 -6.947 -3.746 -4.876 1.00 0.00 H new ATOM 689 N LEU A 43 -5.784 0.525 -5.470 1.00 0.00 N ATOM 690 CA LEU A 43 -5.271 1.880 -5.160 1.00 0.00 C ATOM 691 C LEU A 43 -4.123 2.284 -6.102 1.00 0.00 C ATOM 692 O LEU A 43 -3.734 3.456 -6.135 1.00 0.00 O ATOM 693 CB LEU A 43 -4.767 1.921 -3.688 1.00 0.00 C ATOM 694 CG LEU A 43 -5.760 1.375 -2.611 1.00 0.00 C ATOM 695 CD1 LEU A 43 -5.157 1.445 -1.191 1.00 0.00 C ATOM 696 CD2 LEU A 43 -7.124 2.102 -2.682 1.00 0.00 C ATOM 0 H LEU A 43 -5.224 -0.218 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 43 -6.089 2.587 -5.301 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -3.842 1.348 -3.625 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.521 2.953 -3.437 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.935 0.323 -2.836 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.877 1.057 -0.470 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.247 0.847 -1.152 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.921 2.481 -0.946 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.791 1.699 -1.920 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.978 3.168 -2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.565 1.952 -3.667 1.00 0.00 H new ATOM 708 N GLY A 44 -3.589 1.303 -6.850 1.00 0.00 N ATOM 709 CA GLY A 44 -2.402 1.497 -7.678 1.00 0.00 C ATOM 710 C GLY A 44 -2.669 2.296 -8.941 1.00 0.00 C ATOM 711 O GLY A 44 -1.875 3.162 -9.305 1.00 0.00 O ATOM 0 H GLY A 44 -3.972 0.359 -6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.638 2.006 -7.090 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.997 0.523 -7.952 1.00 0.00 H new ATOM 715 N ASN A 45 -3.795 1.997 -9.616 1.00 0.00 N ATOM 716 CA ASN A 45 -4.242 2.758 -10.813 1.00 0.00 C ATOM 717 C ASN A 45 -4.581 4.224 -10.452 1.00 0.00 C ATOM 718 O ASN A 45 -4.530 5.108 -11.314 1.00 0.00 O ATOM 719 CB ASN A 45 -5.467 2.079 -11.482 1.00 0.00 C ATOM 720 CG ASN A 45 -5.168 0.680 -12.029 1.00 0.00 C ATOM 721 OD1 ASN A 45 -4.714 0.525 -13.161 1.00 0.00 O ATOM 722 ND2 ASN A 45 -5.428 -0.353 -11.238 1.00 0.00 N ATOM 0 H ASN A 45 -4.418 1.232 -9.357 1.00 0.00 H new ATOM 0 HA ASN A 45 -3.415 2.760 -11.523 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -6.276 2.011 -10.755 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -5.822 2.710 -12.296 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.251 -1.303 -11.565 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.804 -0.197 -10.303 1.00 0.00 H new ATOM 729 N ILE A 46 -4.922 4.455 -9.172 1.00 0.00 N ATOM 730 CA ILE A 46 -5.181 5.800 -8.624 1.00 0.00 C ATOM 731 C ILE A 46 -3.843 6.557 -8.462 1.00 0.00 C ATOM 732 O ILE A 46 -2.844 5.954 -8.064 1.00 0.00 O ATOM 733 CB ILE A 46 -5.912 5.697 -7.226 1.00 0.00 C ATOM 734 CG1 ILE A 46 -7.183 4.791 -7.328 1.00 0.00 C ATOM 735 CG2 ILE A 46 -6.265 7.099 -6.656 1.00 0.00 C ATOM 736 CD1 ILE A 46 -7.871 4.506 -5.997 1.00 0.00 C ATOM 0 H ILE A 46 -5.027 3.710 -8.484 1.00 0.00 H new ATOM 0 HA ILE A 46 -5.827 6.344 -9.313 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.219 5.231 -6.526 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.899 5.268 -7.997 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -6.901 3.843 -7.786 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -6.766 6.985 -5.695 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -5.351 7.678 -6.523 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -6.926 7.618 -7.350 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -8.741 3.871 -6.166 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.175 3.998 -5.329 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -8.189 5.445 -5.544 1.00 0.00 H new ATOM 748 N LYS A 47 -3.829 7.870 -8.788 1.00 0.00 N ATOM 749 CA LYS A 47 -2.647 8.731 -8.569 1.00 0.00 C ATOM 750 C LYS A 47 -2.372 8.855 -7.060 1.00 0.00 C ATOM 751 O LYS A 47 -3.316 8.955 -6.270 1.00 0.00 O ATOM 752 CB LYS A 47 -2.842 10.134 -9.204 1.00 0.00 C ATOM 753 CG LYS A 47 -3.077 10.119 -10.732 1.00 0.00 C ATOM 754 CD LYS A 47 -1.905 9.479 -11.526 1.00 0.00 C ATOM 755 CE LYS A 47 -2.161 9.431 -13.045 1.00 0.00 C ATOM 756 NZ LYS A 47 -2.288 10.792 -13.642 1.00 0.00 N ATOM 0 H LYS A 47 -4.624 8.355 -9.204 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.789 8.268 -9.056 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.690 10.622 -8.723 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -1.962 10.741 -8.990 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -3.994 9.571 -10.946 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.227 11.141 -11.080 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -0.993 10.044 -11.335 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -1.736 8.466 -11.160 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.344 8.898 -13.532 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.072 8.865 -13.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.392 10.710 -14.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.124 11.268 -13.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -1.437 11.348 -13.422 1.00 0.00 H new ATOM 770 N LEU A 48 -1.083 8.861 -6.698 1.00 0.00 N ATOM 771 CA LEU A 48 -0.589 8.780 -5.296 1.00 0.00 C ATOM 772 C LEU A 48 -1.241 9.824 -4.347 1.00 0.00 C ATOM 773 O LEU A 48 -1.588 9.501 -3.202 1.00 0.00 O ATOM 774 CB LEU A 48 0.963 8.912 -5.307 1.00 0.00 C ATOM 775 CG LEU A 48 1.695 9.039 -3.927 1.00 0.00 C ATOM 776 CD1 LEU A 48 1.394 7.848 -3.002 1.00 0.00 C ATOM 777 CD2 LEU A 48 3.215 9.190 -4.142 1.00 0.00 C ATOM 0 H LEU A 48 -0.327 8.923 -7.380 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.882 7.811 -4.892 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.370 8.042 -5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.221 9.786 -5.905 1.00 0.00 H new ATOM 0 HG LEU A 48 1.314 9.933 -3.433 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.922 7.978 -2.057 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.322 7.795 -2.814 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.725 6.925 -3.478 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.712 9.277 -3.176 1.00 0.00 H new ATOM 0 HD22 LEU A 48 3.597 8.315 -4.669 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.412 10.084 -4.733 1.00 0.00 H new ATOM 789 N ALA A 49 -1.421 11.056 -4.843 1.00 0.00 N ATOM 790 CA ALA A 49 -1.992 12.175 -4.060 1.00 0.00 C ATOM 791 C ALA A 49 -3.513 12.040 -3.902 1.00 0.00 C ATOM 792 O ALA A 49 -4.081 12.521 -2.917 1.00 0.00 O ATOM 793 CB ALA A 49 -1.640 13.520 -4.707 1.00 0.00 C ATOM 0 H ALA A 49 -1.176 11.311 -5.800 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.551 12.136 -3.064 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -2.068 14.331 -4.117 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.557 13.633 -4.746 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -2.045 13.554 -5.719 1.00 0.00 H new ATOM 799 N LYS A 50 -4.157 11.367 -4.875 1.00 0.00 N ATOM 800 CA LYS A 50 -5.623 11.177 -4.907 1.00 0.00 C ATOM 801 C LYS A 50 -6.073 10.076 -3.924 1.00 0.00 C ATOM 802 O LYS A 50 -7.275 9.868 -3.742 1.00 0.00 O ATOM 803 CB LYS A 50 -6.092 10.846 -6.350 1.00 0.00 C ATOM 804 CG LYS A 50 -5.665 11.878 -7.418 1.00 0.00 C ATOM 805 CD LYS A 50 -6.182 13.311 -7.138 1.00 0.00 C ATOM 806 CE LYS A 50 -5.747 14.316 -8.219 1.00 0.00 C ATOM 807 NZ LYS A 50 -6.182 15.699 -7.908 1.00 0.00 N ATOM 0 H LYS A 50 -3.675 10.938 -5.665 1.00 0.00 H new ATOM 0 HA LYS A 50 -6.088 12.111 -4.591 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -5.699 9.869 -6.630 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -7.179 10.766 -6.355 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -4.577 11.898 -7.477 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.031 11.553 -8.392 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -7.270 13.296 -7.077 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -5.813 13.644 -6.168 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.662 14.292 -8.319 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -6.162 14.014 -9.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -5.867 16.340 -8.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -7.219 15.729 -7.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -5.766 15.999 -7.003 1.00 0.00 H new ATOM 821 N LEU A 51 -5.100 9.374 -3.303 1.00 0.00 N ATOM 822 CA LEU A 51 -5.367 8.415 -2.213 1.00 0.00 C ATOM 823 C LEU A 51 -5.970 9.136 -0.992 1.00 0.00 C ATOM 824 O LEU A 51 -5.257 9.794 -0.227 1.00 0.00 O ATOM 825 CB LEU A 51 -4.081 7.632 -1.803 1.00 0.00 C ATOM 826 CG LEU A 51 -3.758 6.335 -2.614 1.00 0.00 C ATOM 827 CD1 LEU A 51 -3.593 6.605 -4.119 1.00 0.00 C ATOM 828 CD2 LEU A 51 -2.511 5.647 -2.035 1.00 0.00 C ATOM 0 H LEU A 51 -4.112 9.457 -3.543 1.00 0.00 H new ATOM 0 HA LEU A 51 -6.090 7.690 -2.586 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.230 8.307 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -4.168 7.362 -0.751 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.612 5.666 -2.514 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.370 5.671 -4.634 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -4.516 7.027 -4.516 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.776 7.309 -4.275 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -2.295 4.745 -2.607 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.661 6.326 -2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -2.692 5.382 -0.994 1.00 0.00 H new ATOM 840 N THR A 52 -7.295 9.039 -0.865 1.00 0.00 N ATOM 841 CA THR A 52 -8.036 9.516 0.309 1.00 0.00 C ATOM 842 C THR A 52 -8.266 8.343 1.291 1.00 0.00 C ATOM 843 O THR A 52 -8.049 7.172 0.937 1.00 0.00 O ATOM 844 CB THR A 52 -9.395 10.162 -0.133 1.00 0.00 C ATOM 845 OG1 THR A 52 -10.077 10.719 1.000 1.00 0.00 O ATOM 846 CG2 THR A 52 -10.320 9.165 -0.841 1.00 0.00 C ATOM 0 H THR A 52 -7.891 8.623 -1.580 1.00 0.00 H new ATOM 0 HA THR A 52 -7.453 10.283 0.819 1.00 0.00 H new ATOM 0 HB THR A 52 -9.147 10.949 -0.845 1.00 0.00 H new ATOM 0 HG1 THR A 52 -10.922 11.120 0.708 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.246 9.666 -1.125 1.00 0.00 H new ATOM 0 HG22 THR A 52 -9.826 8.782 -1.734 1.00 0.00 H new ATOM 0 HG23 THR A 52 -10.547 8.338 -0.168 1.00 0.00 H new ATOM 854 N SER A 53 -8.708 8.673 2.520 1.00 0.00 N ATOM 855 CA SER A 53 -8.975 7.683 3.592 1.00 0.00 C ATOM 856 C SER A 53 -10.170 6.776 3.217 1.00 0.00 C ATOM 857 O SER A 53 -10.252 5.629 3.661 1.00 0.00 O ATOM 858 CB SER A 53 -9.225 8.409 4.944 1.00 0.00 C ATOM 859 OG SER A 53 -9.283 7.494 6.029 1.00 0.00 O ATOM 0 H SER A 53 -8.892 9.636 2.802 1.00 0.00 H new ATOM 0 HA SER A 53 -8.098 7.045 3.703 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.430 9.133 5.121 1.00 0.00 H new ATOM 0 HB3 SER A 53 -10.159 8.968 4.889 1.00 0.00 H new ATOM 0 HG SER A 53 -9.440 7.985 6.863 1.00 0.00 H new ATOM 865 N LEU A 54 -11.085 7.313 2.374 1.00 0.00 N ATOM 866 CA LEU A 54 -12.220 6.549 1.799 1.00 0.00 C ATOM 867 C LEU A 54 -11.712 5.378 0.922 1.00 0.00 C ATOM 868 O LEU A 54 -12.280 4.285 0.954 1.00 0.00 O ATOM 869 CB LEU A 54 -13.134 7.494 0.970 1.00 0.00 C ATOM 870 CG LEU A 54 -14.315 6.826 0.182 1.00 0.00 C ATOM 871 CD1 LEU A 54 -15.296 6.087 1.123 1.00 0.00 C ATOM 872 CD2 LEU A 54 -15.054 7.860 -0.698 1.00 0.00 C ATOM 0 H LEU A 54 -11.057 8.287 2.073 1.00 0.00 H new ATOM 0 HA LEU A 54 -12.801 6.127 2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -13.555 8.238 1.646 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -12.509 8.030 0.255 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.878 6.075 -0.476 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -16.097 5.640 0.535 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -14.763 5.305 1.663 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -15.720 6.795 1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -15.867 7.368 -1.232 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -15.460 8.651 -0.067 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -14.357 8.291 -1.416 1.00 0.00 H new ATOM 884 N HIS A 55 -10.619 5.623 0.162 1.00 0.00 N ATOM 885 CA HIS A 55 -9.984 4.595 -0.697 1.00 0.00 C ATOM 886 C HIS A 55 -9.414 3.456 0.158 1.00 0.00 C ATOM 887 O HIS A 55 -9.526 2.287 -0.208 1.00 0.00 O ATOM 888 CB HIS A 55 -8.860 5.202 -1.589 1.00 0.00 C ATOM 889 CG HIS A 55 -9.331 6.102 -2.692 1.00 0.00 C ATOM 890 ND1 HIS A 55 -8.468 6.878 -3.430 1.00 0.00 N ATOM 891 CD2 HIS A 55 -10.566 6.322 -3.207 1.00 0.00 C ATOM 892 CE1 HIS A 55 -9.147 7.537 -4.341 1.00 0.00 C ATOM 893 NE2 HIS A 55 -10.422 7.218 -4.229 1.00 0.00 N ATOM 0 H HIS A 55 -10.155 6.531 0.126 1.00 0.00 H new ATOM 0 HA HIS A 55 -10.758 4.198 -1.354 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -8.177 5.763 -0.952 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -8.287 4.385 -2.029 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -11.490 5.874 -2.872 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -8.731 8.225 -5.062 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -11.177 7.581 -4.810 1.00 0.00 H new ATOM 902 N MET A 56 -8.818 3.828 1.303 1.00 0.00 N ATOM 903 CA MET A 56 -8.219 2.865 2.254 1.00 0.00 C ATOM 904 C MET A 56 -9.302 2.037 2.946 1.00 0.00 C ATOM 905 O MET A 56 -9.133 0.835 3.157 1.00 0.00 O ATOM 906 CB MET A 56 -7.362 3.608 3.302 1.00 0.00 C ATOM 907 CG MET A 56 -6.152 4.300 2.696 1.00 0.00 C ATOM 908 SD MET A 56 -5.075 3.133 1.835 1.00 0.00 S ATOM 909 CE MET A 56 -3.924 4.241 1.033 1.00 0.00 C ATOM 0 H MET A 56 -8.736 4.801 1.599 1.00 0.00 H new ATOM 0 HA MET A 56 -7.577 2.186 1.692 1.00 0.00 H new ATOM 0 HB2 MET A 56 -7.980 4.348 3.810 1.00 0.00 H new ATOM 0 HB3 MET A 56 -7.027 2.898 4.059 1.00 0.00 H new ATOM 0 HG2 MET A 56 -6.484 5.070 2.000 1.00 0.00 H new ATOM 0 HG3 MET A 56 -5.589 4.803 3.482 1.00 0.00 H new ATOM 0 HE1 MET A 56 -3.187 3.661 0.477 1.00 0.00 H new ATOM 0 HE2 MET A 56 -4.465 4.893 0.347 1.00 0.00 H new ATOM 0 HE3 MET A 56 -3.417 4.846 1.785 1.00 0.00 H new ATOM 919 N GLN A 57 -10.425 2.700 3.265 1.00 0.00 N ATOM 920 CA GLN A 57 -11.584 2.064 3.906 1.00 0.00 C ATOM 921 C GLN A 57 -12.187 0.993 2.977 1.00 0.00 C ATOM 922 O GLN A 57 -12.355 -0.159 3.379 1.00 0.00 O ATOM 923 CB GLN A 57 -12.646 3.138 4.288 1.00 0.00 C ATOM 924 CG GLN A 57 -13.882 2.600 5.041 1.00 0.00 C ATOM 925 CD GLN A 57 -13.522 1.791 6.291 1.00 0.00 C ATOM 926 OE1 GLN A 57 -13.341 2.343 7.370 1.00 0.00 O ATOM 927 NE2 GLN A 57 -13.424 0.471 6.158 1.00 0.00 N ATOM 0 H GLN A 57 -10.554 3.696 3.084 1.00 0.00 H new ATOM 0 HA GLN A 57 -11.256 1.572 4.822 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -12.166 3.897 4.906 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -12.982 3.634 3.377 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -14.517 3.438 5.329 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -14.466 1.974 4.367 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -13.580 0.037 5.248 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -13.193 -0.107 6.966 1.00 0.00 H new ATOM 936 N ASN A 58 -12.451 1.386 1.720 1.00 0.00 N ATOM 937 CA ASN A 58 -13.046 0.504 0.690 1.00 0.00 C ATOM 938 C ASN A 58 -12.093 -0.637 0.307 1.00 0.00 C ATOM 939 O ASN A 58 -12.541 -1.732 -0.052 1.00 0.00 O ATOM 940 CB ASN A 58 -13.424 1.316 -0.573 1.00 0.00 C ATOM 941 CG ASN A 58 -14.502 2.366 -0.318 1.00 0.00 C ATOM 942 OD1 ASN A 58 -15.356 2.206 0.548 1.00 0.00 O ATOM 943 ND2 ASN A 58 -14.469 3.443 -1.077 1.00 0.00 N ATOM 0 H ASN A 58 -12.258 2.329 1.383 1.00 0.00 H new ATOM 0 HA ASN A 58 -13.948 0.067 1.118 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -12.532 1.808 -0.960 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -13.771 0.631 -1.346 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -15.168 4.176 -0.953 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -13.745 3.544 -1.788 1.00 0.00 H new ATOM 950 N TYR A 59 -10.780 -0.360 0.393 1.00 0.00 N ATOM 951 CA TYR A 59 -9.726 -1.353 0.141 1.00 0.00 C ATOM 952 C TYR A 59 -9.778 -2.466 1.204 1.00 0.00 C ATOM 953 O TYR A 59 -9.814 -3.649 0.867 1.00 0.00 O ATOM 954 CB TYR A 59 -8.336 -0.662 0.126 1.00 0.00 C ATOM 955 CG TYR A 59 -7.151 -1.628 0.004 1.00 0.00 C ATOM 956 CD1 TYR A 59 -6.877 -2.287 -1.198 1.00 0.00 C ATOM 957 CD2 TYR A 59 -6.325 -1.902 1.100 1.00 0.00 C ATOM 958 CE1 TYR A 59 -5.822 -3.171 -1.299 1.00 0.00 C ATOM 959 CE2 TYR A 59 -5.279 -2.785 0.999 1.00 0.00 C ATOM 960 CZ TYR A 59 -5.031 -3.415 -0.196 1.00 0.00 C ATOM 961 OH TYR A 59 -3.995 -4.307 -0.281 1.00 0.00 O ATOM 0 H TYR A 59 -10.421 0.562 0.640 1.00 0.00 H new ATOM 0 HA TYR A 59 -9.892 -1.809 -0.835 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -8.302 0.042 -0.705 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -8.223 -0.081 1.041 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.500 -2.102 -2.060 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -6.514 -1.410 2.042 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -5.617 -3.668 -2.236 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -4.653 -2.984 1.856 1.00 0.00 H new ATOM 0 HH TYR A 59 -3.406 -4.199 0.494 1.00 0.00 H new ATOM 971 N VAL A 60 -9.809 -2.052 2.483 1.00 0.00 N ATOM 972 CA VAL A 60 -9.858 -2.971 3.641 1.00 0.00 C ATOM 973 C VAL A 60 -11.159 -3.801 3.647 1.00 0.00 C ATOM 974 O VAL A 60 -11.146 -4.997 3.988 1.00 0.00 O ATOM 975 CB VAL A 60 -9.683 -2.181 4.991 1.00 0.00 C ATOM 976 CG1 VAL A 60 -9.908 -3.076 6.227 1.00 0.00 C ATOM 977 CG2 VAL A 60 -8.283 -1.528 5.057 1.00 0.00 C ATOM 0 H VAL A 60 -9.801 -1.067 2.747 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.026 -3.668 3.547 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.447 -1.404 5.007 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.776 -2.485 7.133 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -10.919 -3.482 6.203 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.188 -3.894 6.220 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -8.178 -0.986 5.997 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.517 -2.302 4.997 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.165 -0.836 4.223 1.00 0.00 H new ATOM 987 N ASN A 61 -12.261 -3.161 3.218 1.00 0.00 N ATOM 988 CA ASN A 61 -13.561 -3.835 3.048 1.00 0.00 C ATOM 989 C ASN A 61 -13.436 -4.937 1.983 1.00 0.00 C ATOM 990 O ASN A 61 -13.888 -6.069 2.195 1.00 0.00 O ATOM 991 CB ASN A 61 -14.672 -2.827 2.652 1.00 0.00 C ATOM 992 CG ASN A 61 -14.943 -1.742 3.700 1.00 0.00 C ATOM 993 OD1 ASN A 61 -14.755 -1.947 4.899 1.00 0.00 O ATOM 994 ND2 ASN A 61 -15.369 -0.566 3.248 1.00 0.00 N ATOM 0 H ASN A 61 -12.277 -2.169 2.981 1.00 0.00 H new ATOM 0 HA ASN A 61 -13.844 -4.282 4.001 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -14.393 -2.348 1.714 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -15.595 -3.376 2.468 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -15.549 0.197 3.901 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -15.516 -0.427 2.248 1.00 0.00 H new ATOM 1001 N SER A 62 -12.748 -4.602 0.870 1.00 0.00 N ATOM 1002 CA SER A 62 -12.533 -5.523 -0.254 1.00 0.00 C ATOM 1003 C SER A 62 -11.711 -6.750 0.192 1.00 0.00 C ATOM 1004 O SER A 62 -12.002 -7.863 -0.228 1.00 0.00 O ATOM 1005 CB SER A 62 -11.835 -4.802 -1.434 1.00 0.00 C ATOM 1006 OG SER A 62 -11.688 -5.662 -2.556 1.00 0.00 O ATOM 0 H SER A 62 -12.328 -3.683 0.731 1.00 0.00 H new ATOM 0 HA SER A 62 -13.509 -5.869 -0.595 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.415 -3.925 -1.720 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.855 -4.446 -1.116 1.00 0.00 H new ATOM 0 HG SER A 62 -11.246 -5.177 -3.284 1.00 0.00 H new ATOM 1012 N LEU A 63 -10.717 -6.527 1.082 1.00 0.00 N ATOM 1013 CA LEU A 63 -9.849 -7.600 1.631 1.00 0.00 C ATOM 1014 C LEU A 63 -10.673 -8.658 2.381 1.00 0.00 C ATOM 1015 O LEU A 63 -10.418 -9.867 2.263 1.00 0.00 O ATOM 1016 CB LEU A 63 -8.791 -6.999 2.590 1.00 0.00 C ATOM 1017 CG LEU A 63 -7.877 -5.894 1.986 1.00 0.00 C ATOM 1018 CD1 LEU A 63 -6.945 -5.300 3.059 1.00 0.00 C ATOM 1019 CD2 LEU A 63 -7.086 -6.413 0.761 1.00 0.00 C ATOM 0 H LEU A 63 -10.492 -5.599 1.441 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.350 -8.081 0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -9.307 -6.584 3.455 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -8.158 -7.808 2.955 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.521 -5.090 1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.317 -4.530 2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.543 -4.860 3.857 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.314 -6.088 3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -6.459 -5.613 0.367 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -6.458 -7.251 1.062 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -7.783 -6.741 -0.010 1.00 0.00 H new ATOM 1031 N ARG A 64 -11.673 -8.179 3.143 1.00 0.00 N ATOM 1032 CA ARG A 64 -12.594 -9.044 3.893 1.00 0.00 C ATOM 1033 C ARG A 64 -13.485 -9.850 2.915 1.00 0.00 C ATOM 1034 O ARG A 64 -13.791 -11.023 3.158 1.00 0.00 O ATOM 1035 CB ARG A 64 -13.464 -8.200 4.865 1.00 0.00 C ATOM 1036 CG ARG A 64 -14.195 -9.037 5.942 1.00 0.00 C ATOM 1037 CD ARG A 64 -15.093 -8.202 6.879 1.00 0.00 C ATOM 1038 NE ARG A 64 -15.514 -8.981 8.067 1.00 0.00 N ATOM 1039 CZ ARG A 64 -16.755 -9.434 8.331 1.00 0.00 C ATOM 1040 NH1 ARG A 64 -17.745 -9.254 7.469 1.00 0.00 N ATOM 1041 NH2 ARG A 64 -16.986 -10.086 9.458 1.00 0.00 N ATOM 0 H ARG A 64 -11.863 -7.183 3.254 1.00 0.00 H new ATOM 0 HA ARG A 64 -12.010 -9.747 4.486 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -12.829 -7.465 5.360 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -14.203 -7.645 4.287 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -14.805 -9.793 5.448 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -13.454 -9.567 6.541 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -14.555 -7.310 7.200 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -15.974 -7.864 6.334 1.00 0.00 H new ATOM 0 HE ARG A 64 -14.791 -9.196 8.754 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -17.573 -8.766 6.590 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -18.679 -9.603 7.685 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -16.227 -10.243 10.121 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -17.923 -10.432 9.664 1.00 0.00 H new ATOM 1055 N ASP A 65 -13.857 -9.207 1.784 1.00 0.00 N ATOM 1056 CA ASP A 65 -14.651 -9.839 0.702 1.00 0.00 C ATOM 1057 C ASP A 65 -13.819 -10.906 -0.048 1.00 0.00 C ATOM 1058 O ASP A 65 -14.386 -11.850 -0.609 1.00 0.00 O ATOM 1059 CB ASP A 65 -15.165 -8.774 -0.315 1.00 0.00 C ATOM 1060 CG ASP A 65 -16.132 -7.728 0.283 1.00 0.00 C ATOM 1061 OD1 ASP A 65 -17.117 -8.118 0.948 1.00 0.00 O ATOM 1062 OD2 ASP A 65 -15.928 -6.512 0.081 1.00 0.00 O ATOM 0 H ASP A 65 -13.615 -8.234 1.595 1.00 0.00 H new ATOM 0 HA ASP A 65 -15.508 -10.322 1.172 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -14.307 -8.254 -0.742 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -15.667 -9.287 -1.135 1.00 0.00 H new ATOM 1067 N GLU A 66 -12.470 -10.738 -0.064 1.00 0.00 N ATOM 1068 CA GLU A 66 -11.536 -11.725 -0.670 1.00 0.00 C ATOM 1069 C GLU A 66 -11.250 -12.890 0.296 1.00 0.00 C ATOM 1070 O GLU A 66 -10.577 -13.854 -0.077 1.00 0.00 O ATOM 1071 CB GLU A 66 -10.189 -11.055 -1.098 1.00 0.00 C ATOM 1072 CG GLU A 66 -10.326 -9.791 -1.974 1.00 0.00 C ATOM 1073 CD GLU A 66 -11.293 -9.973 -3.154 1.00 0.00 C ATOM 1074 OE1 GLU A 66 -10.933 -10.663 -4.134 1.00 0.00 O ATOM 1075 OE2 GLU A 66 -12.423 -9.438 -3.106 1.00 0.00 O ATOM 0 H GLU A 66 -12.004 -9.925 0.338 1.00 0.00 H new ATOM 0 HA GLU A 66 -12.027 -12.118 -1.561 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -9.631 -10.794 -0.199 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -9.594 -11.790 -1.641 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -10.671 -8.963 -1.354 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -9.344 -9.514 -2.357 1.00 0.00 H new ATOM 1082 N GLY A 67 -11.766 -12.787 1.536 1.00 0.00 N ATOM 1083 CA GLY A 67 -11.583 -13.824 2.555 1.00 0.00 C ATOM 1084 C GLY A 67 -10.160 -13.876 3.098 1.00 0.00 C ATOM 1085 O GLY A 67 -9.673 -14.943 3.491 1.00 0.00 O ATOM 0 H GLY A 67 -12.316 -11.988 1.852 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -12.274 -13.644 3.378 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -11.840 -14.794 2.129 1.00 0.00 H new ATOM 1089 N LEU A 68 -9.492 -12.712 3.094 1.00 0.00 N ATOM 1090 CA LEU A 68 -8.133 -12.559 3.626 1.00 0.00 C ATOM 1091 C LEU A 68 -8.181 -12.406 5.150 1.00 0.00 C ATOM 1092 O LEU A 68 -9.008 -11.648 5.676 1.00 0.00 O ATOM 1093 CB LEU A 68 -7.433 -11.335 2.982 1.00 0.00 C ATOM 1094 CG LEU A 68 -7.251 -11.395 1.431 1.00 0.00 C ATOM 1095 CD1 LEU A 68 -6.586 -10.108 0.907 1.00 0.00 C ATOM 1096 CD2 LEU A 68 -6.445 -12.649 1.004 1.00 0.00 C ATOM 0 H LEU A 68 -9.883 -11.848 2.719 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.558 -13.452 3.380 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -8.007 -10.441 3.227 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.451 -11.219 3.440 1.00 0.00 H new ATOM 0 HG LEU A 68 -8.242 -11.472 0.984 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -6.470 -10.173 -0.175 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -7.210 -9.249 1.154 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.607 -9.990 1.371 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.337 -12.660 -0.081 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.459 -12.623 1.467 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.972 -13.547 1.325 1.00 0.00 H new ATOM 1108 N LYS A 69 -7.278 -13.124 5.838 1.00 0.00 N ATOM 1109 CA LYS A 69 -7.177 -13.085 7.306 1.00 0.00 C ATOM 1110 C LYS A 69 -6.659 -11.716 7.775 1.00 0.00 C ATOM 1111 O LYS A 69 -6.020 -10.986 7.002 1.00 0.00 O ATOM 1112 CB LYS A 69 -6.249 -14.223 7.821 1.00 0.00 C ATOM 1113 CG LYS A 69 -4.790 -14.156 7.312 1.00 0.00 C ATOM 1114 CD LYS A 69 -3.888 -15.291 7.854 1.00 0.00 C ATOM 1115 CE LYS A 69 -4.387 -16.700 7.482 1.00 0.00 C ATOM 1116 NZ LYS A 69 -4.478 -16.919 6.014 1.00 0.00 N ATOM 0 H LYS A 69 -6.601 -13.745 5.395 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.173 -13.238 7.722 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.239 -14.199 8.911 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -6.677 -15.181 7.527 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.793 -14.195 6.223 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -4.360 -13.195 7.595 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.878 -15.158 7.468 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.827 -15.210 8.939 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.715 -17.442 7.913 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.368 -16.861 7.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.803 -17.889 5.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.153 -16.243 5.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.542 -16.778 5.583 1.00 0.00 H new ATOM 1130 N ARG A 70 -6.932 -11.390 9.051 1.00 0.00 N ATOM 1131 CA ARG A 70 -6.434 -10.152 9.690 1.00 0.00 C ATOM 1132 C ARG A 70 -4.887 -10.072 9.633 1.00 0.00 C ATOM 1133 O ARG A 70 -4.340 -8.986 9.649 1.00 0.00 O ATOM 1134 CB ARG A 70 -6.930 -10.052 11.158 1.00 0.00 C ATOM 1135 CG ARG A 70 -6.434 -11.199 12.061 1.00 0.00 C ATOM 1136 CD ARG A 70 -6.909 -11.085 13.516 1.00 0.00 C ATOM 1137 NE ARG A 70 -6.410 -12.216 14.310 1.00 0.00 N ATOM 1138 CZ ARG A 70 -6.254 -12.238 15.631 1.00 0.00 C ATOM 1139 NH1 ARG A 70 -6.538 -11.187 16.389 1.00 0.00 N ATOM 1140 NH2 ARG A 70 -5.800 -13.337 16.198 1.00 0.00 N ATOM 0 H ARG A 70 -7.500 -11.971 9.668 1.00 0.00 H new ATOM 0 HA ARG A 70 -6.835 -9.307 9.131 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -6.601 -9.102 11.579 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -8.020 -10.043 11.164 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -6.776 -12.148 11.649 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -5.344 -11.218 12.044 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.558 -10.147 13.947 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -7.998 -11.063 13.549 1.00 0.00 H new ATOM 0 HE ARG A 70 -6.160 -13.064 13.801 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.887 -10.329 15.961 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -6.407 -11.237 17.399 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -5.575 -14.151 15.626 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -5.673 -13.374 17.209 1.00 0.00 H new ATOM 1154 N GLY A 71 -4.211 -11.239 9.567 1.00 0.00 N ATOM 1155 CA GLY A 71 -2.758 -11.303 9.359 1.00 0.00 C ATOM 1156 C GLY A 71 -2.306 -10.778 7.993 1.00 0.00 C ATOM 1157 O GLY A 71 -1.316 -10.050 7.911 1.00 0.00 O ATOM 0 H GLY A 71 -4.657 -12.152 9.656 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -2.263 -10.728 10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -2.430 -12.337 9.467 1.00 0.00 H new ATOM 1161 N THR A 72 -3.045 -11.140 6.926 1.00 0.00 N ATOM 1162 CA THR A 72 -2.775 -10.648 5.557 1.00 0.00 C ATOM 1163 C THR A 72 -2.996 -9.129 5.500 1.00 0.00 C ATOM 1164 O THR A 72 -2.136 -8.378 5.023 1.00 0.00 O ATOM 1165 CB THR A 72 -3.695 -11.345 4.498 1.00 0.00 C ATOM 1166 OG1 THR A 72 -3.583 -12.769 4.621 1.00 0.00 O ATOM 1167 CG2 THR A 72 -3.339 -10.919 3.053 1.00 0.00 C ATOM 0 H THR A 72 -3.840 -11.776 6.985 1.00 0.00 H new ATOM 0 HA THR A 72 -1.739 -10.888 5.317 1.00 0.00 H new ATOM 0 HB THR A 72 -4.720 -11.032 4.695 1.00 0.00 H new ATOM 0 HG1 THR A 72 -4.161 -13.201 3.958 1.00 0.00 H new ATOM 0 HG21 THR A 72 -4.001 -11.426 2.351 1.00 0.00 H new ATOM 0 HG22 THR A 72 -3.459 -9.840 2.952 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.306 -11.191 2.838 1.00 0.00 H new ATOM 1175 N ILE A 73 -4.145 -8.705 6.059 1.00 0.00 N ATOM 1176 CA ILE A 73 -4.562 -7.297 6.113 1.00 0.00 C ATOM 1177 C ILE A 73 -3.541 -6.473 6.929 1.00 0.00 C ATOM 1178 O ILE A 73 -3.207 -5.352 6.557 1.00 0.00 O ATOM 1179 CB ILE A 73 -6.011 -7.161 6.730 1.00 0.00 C ATOM 1180 CG1 ILE A 73 -7.034 -8.028 5.921 1.00 0.00 C ATOM 1181 CG2 ILE A 73 -6.468 -5.676 6.800 1.00 0.00 C ATOM 1182 CD1 ILE A 73 -8.447 -8.079 6.501 1.00 0.00 C ATOM 0 H ILE A 73 -4.816 -9.341 6.490 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.594 -6.906 5.096 1.00 0.00 H new ATOM 0 HB ILE A 73 -5.975 -7.535 7.753 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -7.090 -7.640 4.904 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.650 -9.046 5.853 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -7.468 -5.623 7.229 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.775 -5.111 7.424 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -6.481 -5.252 5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -9.078 -8.704 5.868 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -8.413 -8.498 7.506 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -8.860 -7.071 6.542 1.00 0.00 H new ATOM 1194 N GLU A 74 -3.012 -7.086 8.003 1.00 0.00 N ATOM 1195 CA GLU A 74 -2.014 -6.473 8.898 1.00 0.00 C ATOM 1196 C GLU A 74 -0.763 -6.062 8.118 1.00 0.00 C ATOM 1197 O GLU A 74 -0.388 -4.891 8.124 1.00 0.00 O ATOM 1198 CB GLU A 74 -1.637 -7.469 10.023 1.00 0.00 C ATOM 1199 CG GLU A 74 -0.600 -6.961 11.045 1.00 0.00 C ATOM 1200 CD GLU A 74 -0.309 -7.983 12.156 1.00 0.00 C ATOM 1201 OE1 GLU A 74 -1.170 -8.174 13.037 1.00 0.00 O ATOM 1202 OE2 GLU A 74 0.765 -8.616 12.146 1.00 0.00 O ATOM 0 H GLU A 74 -3.269 -8.034 8.277 1.00 0.00 H new ATOM 0 HA GLU A 74 -2.449 -5.577 9.341 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -2.545 -7.743 10.560 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.251 -8.379 9.563 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.328 -6.721 10.526 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -0.962 -6.036 11.494 1.00 0.00 H new ATOM 1209 N LYS A 75 -0.180 -7.047 7.407 1.00 0.00 N ATOM 1210 CA LYS A 75 1.092 -6.892 6.680 1.00 0.00 C ATOM 1211 C LYS A 75 0.968 -5.816 5.600 1.00 0.00 C ATOM 1212 O LYS A 75 1.711 -4.834 5.600 1.00 0.00 O ATOM 1213 CB LYS A 75 1.502 -8.239 6.026 1.00 0.00 C ATOM 1214 CG LYS A 75 1.663 -9.406 7.017 1.00 0.00 C ATOM 1215 CD LYS A 75 1.885 -10.758 6.304 1.00 0.00 C ATOM 1216 CE LYS A 75 1.947 -11.937 7.286 1.00 0.00 C ATOM 1217 NZ LYS A 75 3.082 -11.819 8.238 1.00 0.00 N ATOM 0 H LYS A 75 -0.583 -7.980 7.321 1.00 0.00 H new ATOM 0 HA LYS A 75 1.858 -6.589 7.394 1.00 0.00 H new ATOM 0 HB2 LYS A 75 0.752 -8.511 5.283 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.443 -8.099 5.493 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.506 -9.204 7.678 1.00 0.00 H new ATOM 0 HG3 LYS A 75 0.774 -9.471 7.645 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.078 -10.926 5.590 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.812 -10.716 5.733 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.012 -11.992 7.844 1.00 0.00 H new ATOM 0 HE3 LYS A 75 2.040 -12.868 6.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.124 -12.669 8.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 3.972 -11.725 7.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.946 -10.980 8.838 1.00 0.00 H new ATOM 1231 N ILE A 76 -0.030 -5.998 4.727 1.00 0.00 N ATOM 1232 CA ILE A 76 -0.181 -5.196 3.502 1.00 0.00 C ATOM 1233 C ILE A 76 -0.493 -3.723 3.818 1.00 0.00 C ATOM 1234 O ILE A 76 0.019 -2.842 3.133 1.00 0.00 O ATOM 1235 CB ILE A 76 -1.245 -5.822 2.524 1.00 0.00 C ATOM 1236 CG1 ILE A 76 -2.686 -5.800 3.125 1.00 0.00 C ATOM 1237 CG2 ILE A 76 -0.840 -7.267 2.161 1.00 0.00 C ATOM 1238 CD1 ILE A 76 -3.715 -6.595 2.330 1.00 0.00 C ATOM 0 H ILE A 76 -0.756 -6.704 4.848 1.00 0.00 H new ATOM 0 HA ILE A 76 0.779 -5.215 2.986 1.00 0.00 H new ATOM 0 HB ILE A 76 -1.263 -5.209 1.623 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -2.648 -6.193 4.141 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.021 -4.765 3.196 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.581 -7.693 1.484 1.00 0.00 H new ATOM 0 HG22 ILE A 76 0.135 -7.260 1.674 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.788 -7.869 3.068 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.686 -6.524 2.819 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.787 -6.190 1.321 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -3.409 -7.640 2.281 1.00 0.00 H new ATOM 1250 N ILE A 77 -1.285 -3.462 4.887 1.00 0.00 N ATOM 1251 CA ILE A 77 -1.567 -2.085 5.348 1.00 0.00 C ATOM 1252 C ILE A 77 -0.265 -1.407 5.835 1.00 0.00 C ATOM 1253 O ILE A 77 -0.071 -0.227 5.583 1.00 0.00 O ATOM 1254 CB ILE A 77 -2.698 -2.040 6.458 1.00 0.00 C ATOM 1255 CG1 ILE A 77 -4.086 -2.468 5.861 1.00 0.00 C ATOM 1256 CG2 ILE A 77 -2.806 -0.647 7.154 1.00 0.00 C ATOM 1257 CD1 ILE A 77 -4.577 -1.607 4.713 1.00 0.00 C ATOM 0 H ILE A 77 -1.738 -4.187 5.443 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.953 -1.524 4.497 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.408 -2.756 7.226 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.016 -3.500 5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.830 -2.447 6.657 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.596 -0.675 7.904 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.858 -0.406 7.635 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -3.039 0.114 6.410 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.541 -1.978 4.366 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.685 -0.577 5.051 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.858 -1.647 3.895 1.00 0.00 H new ATOM 1269 N LYS A 78 0.641 -2.176 6.485 1.00 0.00 N ATOM 1270 CA LYS A 78 1.941 -1.634 6.968 1.00 0.00 C ATOM 1271 C LYS A 78 2.861 -1.270 5.787 1.00 0.00 C ATOM 1272 O LYS A 78 3.605 -0.294 5.860 1.00 0.00 O ATOM 1273 CB LYS A 78 2.693 -2.617 7.911 1.00 0.00 C ATOM 1274 CG LYS A 78 1.907 -3.072 9.152 1.00 0.00 C ATOM 1275 CD LYS A 78 1.291 -1.916 9.975 1.00 0.00 C ATOM 1276 CE LYS A 78 0.544 -2.433 11.216 1.00 0.00 C ATOM 1277 NZ LYS A 78 -0.474 -3.468 10.867 1.00 0.00 N ATOM 0 H LYS A 78 0.501 -3.166 6.687 1.00 0.00 H new ATOM 0 HA LYS A 78 1.697 -0.739 7.540 1.00 0.00 H new ATOM 0 HB2 LYS A 78 2.976 -3.500 7.337 1.00 0.00 H new ATOM 0 HB3 LYS A 78 3.617 -2.142 8.241 1.00 0.00 H new ATOM 0 HG2 LYS A 78 1.108 -3.743 8.836 1.00 0.00 H new ATOM 0 HG3 LYS A 78 2.571 -3.648 9.797 1.00 0.00 H new ATOM 0 HD2 LYS A 78 2.079 -1.230 10.285 1.00 0.00 H new ATOM 0 HD3 LYS A 78 0.604 -1.349 9.347 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.261 -2.853 11.921 1.00 0.00 H new ATOM 0 HE3 LYS A 78 0.055 -1.598 11.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -1.078 -3.653 11.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -1.060 -3.126 10.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 0.006 -4.346 10.585 1.00 0.00 H new ATOM 1291 N VAL A 79 2.796 -2.079 4.711 1.00 0.00 N ATOM 1292 CA VAL A 79 3.589 -1.869 3.486 1.00 0.00 C ATOM 1293 C VAL A 79 3.110 -0.594 2.753 1.00 0.00 C ATOM 1294 O VAL A 79 3.932 0.212 2.283 1.00 0.00 O ATOM 1295 CB VAL A 79 3.514 -3.127 2.539 1.00 0.00 C ATOM 1296 CG1 VAL A 79 4.412 -2.959 1.295 1.00 0.00 C ATOM 1297 CG2 VAL A 79 3.883 -4.422 3.299 1.00 0.00 C ATOM 0 H VAL A 79 2.190 -2.898 4.668 1.00 0.00 H new ATOM 0 HA VAL A 79 4.633 -1.734 3.770 1.00 0.00 H new ATOM 0 HB VAL A 79 2.482 -3.209 2.199 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.333 -3.846 0.667 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.090 -2.084 0.729 1.00 0.00 H new ATOM 0 HG13 VAL A 79 5.448 -2.827 1.609 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.822 -5.272 2.620 1.00 0.00 H new ATOM 0 HG22 VAL A 79 4.898 -4.339 3.687 1.00 0.00 H new ATOM 0 HG23 VAL A 79 3.189 -4.568 4.127 1.00 0.00 H new ATOM 1307 N ILE A 80 1.773 -0.412 2.707 1.00 0.00 N ATOM 1308 CA ILE A 80 1.135 0.802 2.150 1.00 0.00 C ATOM 1309 C ILE A 80 1.533 2.033 2.982 1.00 0.00 C ATOM 1310 O ILE A 80 1.925 3.059 2.430 1.00 0.00 O ATOM 1311 CB ILE A 80 -0.440 0.683 2.128 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -0.906 -0.524 1.263 1.00 0.00 C ATOM 1313 CG2 ILE A 80 -1.109 1.988 1.621 1.00 0.00 C ATOM 1314 CD1 ILE A 80 -2.399 -0.817 1.348 1.00 0.00 C ATOM 0 H ILE A 80 1.106 -1.101 3.054 1.00 0.00 H new ATOM 0 HA ILE A 80 1.484 0.910 1.123 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.756 0.516 3.158 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.644 -0.333 0.222 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.355 -1.412 1.573 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.192 1.865 1.621 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.838 2.815 2.277 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -0.768 2.202 0.608 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -2.639 -1.672 0.716 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -2.667 -1.042 2.380 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.961 0.054 1.009 1.00 0.00 H new ATOM 1326 N ARG A 81 1.432 1.888 4.322 1.00 0.00 N ATOM 1327 CA ARG A 81 1.807 2.935 5.294 1.00 0.00 C ATOM 1328 C ARG A 81 3.253 3.387 5.085 1.00 0.00 C ATOM 1329 O ARG A 81 3.517 4.571 4.970 1.00 0.00 O ATOM 1330 CB ARG A 81 1.639 2.447 6.763 1.00 0.00 C ATOM 1331 CG ARG A 81 0.184 2.362 7.263 1.00 0.00 C ATOM 1332 CD ARG A 81 0.078 1.868 8.718 1.00 0.00 C ATOM 1333 NE ARG A 81 0.863 2.718 9.641 1.00 0.00 N ATOM 1334 CZ ARG A 81 0.762 2.732 10.978 1.00 0.00 C ATOM 1335 NH1 ARG A 81 -0.158 2.014 11.598 1.00 0.00 N ATOM 1336 NH2 ARG A 81 1.570 3.507 11.681 1.00 0.00 N ATOM 0 H ARG A 81 1.085 1.035 4.761 1.00 0.00 H new ATOM 0 HA ARG A 81 1.133 3.774 5.122 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.097 1.462 6.857 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.193 3.119 7.418 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -0.280 3.345 7.184 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -0.379 1.691 6.615 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -0.967 1.864 9.026 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.432 0.839 8.780 1.00 0.00 H new ATOM 0 HE ARG A 81 1.543 3.351 9.221 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -0.805 1.438 11.059 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -0.222 2.036 12.616 1.00 0.00 H new ATOM 0 HH21 ARG A 81 2.262 4.087 11.206 1.00 0.00 H new ATOM 0 HH22 ARG A 81 1.502 3.525 12.699 1.00 0.00 H new ATOM 1350 N ASN A 82 4.161 2.413 4.986 1.00 0.00 N ATOM 1351 CA ASN A 82 5.613 2.658 4.898 1.00 0.00 C ATOM 1352 C ASN A 82 5.975 3.355 3.572 1.00 0.00 C ATOM 1353 O ASN A 82 6.892 4.183 3.521 1.00 0.00 O ATOM 1354 CB ASN A 82 6.383 1.322 5.047 1.00 0.00 C ATOM 1355 CG ASN A 82 7.906 1.482 5.155 1.00 0.00 C ATOM 1356 OD1 ASN A 82 8.657 0.643 4.672 1.00 0.00 O ATOM 1357 ND2 ASN A 82 8.379 2.519 5.838 1.00 0.00 N ATOM 0 H ASN A 82 3.913 1.424 4.964 1.00 0.00 H new ATOM 0 HA ASN A 82 5.904 3.323 5.711 1.00 0.00 H new ATOM 0 HB2 ASN A 82 6.020 0.803 5.934 1.00 0.00 H new ATOM 0 HB3 ASN A 82 6.155 0.687 4.191 1.00 0.00 H new ATOM 0 HD21 ASN A 82 9.385 2.628 5.968 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.736 3.206 6.232 1.00 0.00 H new ATOM 1364 N SER A 83 5.218 3.022 2.519 1.00 0.00 N ATOM 1365 CA SER A 83 5.346 3.655 1.200 1.00 0.00 C ATOM 1366 C SER A 83 4.848 5.121 1.258 1.00 0.00 C ATOM 1367 O SER A 83 5.523 6.039 0.776 1.00 0.00 O ATOM 1368 CB SER A 83 4.543 2.831 0.170 1.00 0.00 C ATOM 1369 OG SER A 83 4.763 3.276 -1.157 1.00 0.00 O ATOM 0 H SER A 83 4.496 2.303 2.558 1.00 0.00 H new ATOM 0 HA SER A 83 6.393 3.676 0.897 1.00 0.00 H new ATOM 0 HB2 SER A 83 4.822 1.780 0.250 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.480 2.897 0.403 1.00 0.00 H new ATOM 0 HG SER A 83 5.522 2.791 -1.543 1.00 0.00 H new ATOM 1375 N LEU A 84 3.677 5.325 1.904 1.00 0.00 N ATOM 1376 CA LEU A 84 3.067 6.658 2.080 1.00 0.00 C ATOM 1377 C LEU A 84 3.897 7.546 3.033 1.00 0.00 C ATOM 1378 O LEU A 84 3.852 8.765 2.917 1.00 0.00 O ATOM 1379 CB LEU A 84 1.608 6.552 2.593 1.00 0.00 C ATOM 1380 CG LEU A 84 0.572 5.868 1.642 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -0.850 5.952 2.228 1.00 0.00 C ATOM 1382 CD2 LEU A 84 0.617 6.454 0.214 1.00 0.00 C ATOM 0 H LEU A 84 3.131 4.569 2.317 1.00 0.00 H new ATOM 0 HA LEU A 84 3.056 7.128 1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.618 6.003 3.535 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.252 7.558 2.815 1.00 0.00 H new ATOM 0 HG LEU A 84 0.851 4.817 1.565 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.553 5.470 1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.876 5.448 3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.129 6.998 2.356 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.120 5.948 -0.410 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.391 7.520 0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.611 6.308 -0.208 1.00 0.00 H new ATOM 1394 N GLU A 85 4.653 6.916 3.957 1.00 0.00 N ATOM 1395 CA GLU A 85 5.602 7.614 4.858 1.00 0.00 C ATOM 1396 C GLU A 85 6.686 8.323 4.038 1.00 0.00 C ATOM 1397 O GLU A 85 7.066 9.466 4.327 1.00 0.00 O ATOM 1398 CB GLU A 85 6.261 6.613 5.856 1.00 0.00 C ATOM 1399 CG GLU A 85 5.353 6.164 7.011 1.00 0.00 C ATOM 1400 CD GLU A 85 5.026 7.308 7.986 1.00 0.00 C ATOM 1401 OE1 GLU A 85 5.907 7.692 8.787 1.00 0.00 O ATOM 1402 OE2 GLU A 85 3.894 7.830 7.959 1.00 0.00 O ATOM 0 H GLU A 85 4.624 5.907 4.102 1.00 0.00 H new ATOM 0 HA GLU A 85 5.044 8.355 5.431 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.585 5.731 5.303 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.156 7.074 6.274 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.425 5.762 6.604 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.838 5.355 7.556 1.00 0.00 H new ATOM 1409 N HIS A 86 7.145 7.632 2.985 1.00 0.00 N ATOM 1410 CA HIS A 86 8.173 8.149 2.086 1.00 0.00 C ATOM 1411 C HIS A 86 7.559 9.131 1.065 1.00 0.00 C ATOM 1412 O HIS A 86 8.257 9.989 0.529 1.00 0.00 O ATOM 1413 CB HIS A 86 8.911 6.989 1.379 1.00 0.00 C ATOM 1414 CG HIS A 86 10.072 7.450 0.536 1.00 0.00 C ATOM 1415 ND1 HIS A 86 11.013 8.346 0.993 1.00 0.00 N ATOM 1416 CD2 HIS A 86 10.394 7.198 -0.748 1.00 0.00 C ATOM 1417 CE1 HIS A 86 11.851 8.629 0.031 1.00 0.00 C ATOM 1418 NE2 HIS A 86 11.504 7.948 -1.036 1.00 0.00 N ATOM 0 H HIS A 86 6.811 6.701 2.737 1.00 0.00 H new ATOM 0 HA HIS A 86 8.906 8.699 2.676 1.00 0.00 H new ATOM 0 HB2 HIS A 86 9.272 6.286 2.129 1.00 0.00 H new ATOM 0 HB3 HIS A 86 8.205 6.448 0.749 1.00 0.00 H new ATOM 0 HD2 HIS A 86 9.876 6.532 -1.422 1.00 0.00 H new ATOM 0 HE1 HIS A 86 12.688 9.308 0.102 1.00 0.00 H new ATOM 0 HE2 HIS A 86 11.984 7.973 -1.936 1.00 0.00 H new ATOM 1427 N ALA A 87 6.255 8.993 0.798 1.00 0.00 N ATOM 1428 CA ALA A 87 5.523 9.939 -0.065 1.00 0.00 C ATOM 1429 C ALA A 87 5.310 11.298 0.645 1.00 0.00 C ATOM 1430 O ALA A 87 5.270 12.335 -0.017 1.00 0.00 O ATOM 1431 CB ALA A 87 4.199 9.320 -0.519 1.00 0.00 C ATOM 0 H ALA A 87 5.680 8.235 1.166 1.00 0.00 H new ATOM 0 HA ALA A 87 6.124 10.138 -0.952 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.666 10.027 -1.156 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.398 8.406 -1.078 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.589 9.086 0.353 1.00 0.00 H new ATOM 1437 N ILE A 88 5.161 11.273 1.991 1.00 0.00 N ATOM 1438 CA ILE A 88 5.146 12.502 2.830 1.00 0.00 C ATOM 1439 C ILE A 88 6.552 13.148 2.832 1.00 0.00 C ATOM 1440 O ILE A 88 6.692 14.382 2.795 1.00 0.00 O ATOM 1441 CB ILE A 88 4.701 12.214 4.320 1.00 0.00 C ATOM 1442 CG1 ILE A 88 3.289 11.547 4.383 1.00 0.00 C ATOM 1443 CG2 ILE A 88 4.717 13.511 5.175 1.00 0.00 C ATOM 1444 CD1 ILE A 88 2.818 11.198 5.790 1.00 0.00 C ATOM 0 H ILE A 88 5.049 10.411 2.524 1.00 0.00 H new ATOM 0 HA ILE A 88 4.413 13.181 2.394 1.00 0.00 H new ATOM 0 HB ILE A 88 5.426 11.515 4.737 1.00 0.00 H new ATOM 0 HG12 ILE A 88 2.563 12.219 3.926 1.00 0.00 H new ATOM 0 HG13 ILE A 88 3.303 10.638 3.782 1.00 0.00 H new ATOM 0 HG21 ILE A 88 4.406 13.279 6.194 1.00 0.00 H new ATOM 0 HG22 ILE A 88 5.725 13.925 5.189 1.00 0.00 H new ATOM 0 HG23 ILE A 88 4.031 14.240 4.743 1.00 0.00 H new ATOM 0 HD11 ILE A 88 1.830 10.740 5.740 1.00 0.00 H new ATOM 0 HD12 ILE A 88 3.519 10.499 6.246 1.00 0.00 H new ATOM 0 HD13 ILE A 88 2.767 12.105 6.392 1.00 0.00 H new ATOM 1456 N ASP A 89 7.579 12.279 2.852 1.00 0.00 N ATOM 1457 CA ASP A 89 8.999 12.683 2.774 1.00 0.00 C ATOM 1458 C ASP A 89 9.273 13.439 1.458 1.00 0.00 C ATOM 1459 O ASP A 89 9.928 14.481 1.451 1.00 0.00 O ATOM 1460 CB ASP A 89 9.900 11.425 2.879 1.00 0.00 C ATOM 1461 CG ASP A 89 11.401 11.714 2.731 1.00 0.00 C ATOM 1462 OD1 ASP A 89 12.014 12.224 3.690 1.00 0.00 O ATOM 1463 OD2 ASP A 89 11.967 11.449 1.652 1.00 0.00 O ATOM 0 H ASP A 89 7.448 11.270 2.923 1.00 0.00 H new ATOM 0 HA ASP A 89 9.227 13.354 3.602 1.00 0.00 H new ATOM 0 HB2 ASP A 89 9.726 10.947 3.843 1.00 0.00 H new ATOM 0 HB3 ASP A 89 9.601 10.712 2.111 1.00 0.00 H new ATOM 1468 N LEU A 90 8.714 12.915 0.358 1.00 0.00 N ATOM 1469 CA LEU A 90 8.853 13.501 -0.991 1.00 0.00 C ATOM 1470 C LEU A 90 7.868 14.668 -1.208 1.00 0.00 C ATOM 1471 O LEU A 90 7.961 15.361 -2.226 1.00 0.00 O ATOM 1472 CB LEU A 90 8.628 12.397 -2.055 1.00 0.00 C ATOM 1473 CG LEU A 90 9.662 11.230 -2.045 1.00 0.00 C ATOM 1474 CD1 LEU A 90 9.247 10.108 -3.018 1.00 0.00 C ATOM 1475 CD2 LEU A 90 11.093 11.734 -2.351 1.00 0.00 C ATOM 0 H LEU A 90 8.148 12.067 0.375 1.00 0.00 H new ATOM 0 HA LEU A 90 9.860 13.905 -1.090 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.632 11.977 -1.912 1.00 0.00 H new ATOM 0 HB3 LEU A 90 8.640 12.861 -3.041 1.00 0.00 H new ATOM 0 HG LEU A 90 9.671 10.812 -1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 90 9.987 9.309 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 90 8.275 9.713 -2.724 1.00 0.00 H new ATOM 0 HD13 LEU A 90 9.185 10.508 -4.030 1.00 0.00 H new ATOM 0 HD21 LEU A 90 11.786 10.893 -2.335 1.00 0.00 H new ATOM 0 HD22 LEU A 90 11.111 12.201 -3.336 1.00 0.00 H new ATOM 0 HD23 LEU A 90 11.391 12.463 -1.598 1.00 0.00 H new ATOM 1487 N GLU A 91 6.932 14.856 -0.247 1.00 0.00 N ATOM 1488 CA GLU A 91 5.896 15.915 -0.281 1.00 0.00 C ATOM 1489 C GLU A 91 4.915 15.704 -1.470 1.00 0.00 C ATOM 1490 O GLU A 91 4.288 16.640 -1.956 1.00 0.00 O ATOM 1491 CB GLU A 91 6.562 17.340 -0.274 1.00 0.00 C ATOM 1492 CG GLU A 91 7.516 17.576 0.927 1.00 0.00 C ATOM 1493 CD GLU A 91 8.228 18.944 0.906 1.00 0.00 C ATOM 1494 OE1 GLU A 91 9.098 19.148 0.036 1.00 0.00 O ATOM 1495 OE2 GLU A 91 7.934 19.818 1.756 1.00 0.00 O ATOM 0 H GLU A 91 6.875 14.268 0.585 1.00 0.00 H new ATOM 0 HA GLU A 91 5.292 15.847 0.624 1.00 0.00 H new ATOM 0 HB2 GLU A 91 7.119 17.476 -1.201 1.00 0.00 H new ATOM 0 HB3 GLU A 91 5.778 18.098 -0.259 1.00 0.00 H new ATOM 0 HG2 GLU A 91 6.946 17.489 1.852 1.00 0.00 H new ATOM 0 HG3 GLU A 91 8.268 16.787 0.940 1.00 0.00 H new ATOM 1502 N LEU A 92 4.775 14.434 -1.898 1.00 0.00 N ATOM 1503 CA LEU A 92 3.779 14.005 -2.906 1.00 0.00 C ATOM 1504 C LEU A 92 2.390 13.882 -2.262 1.00 0.00 C ATOM 1505 O LEU A 92 1.360 14.036 -2.932 1.00 0.00 O ATOM 1506 CB LEU A 92 4.222 12.663 -3.536 1.00 0.00 C ATOM 1507 CG LEU A 92 5.471 12.753 -4.472 1.00 0.00 C ATOM 1508 CD1 LEU A 92 5.977 11.355 -4.898 1.00 0.00 C ATOM 1509 CD2 LEU A 92 5.163 13.639 -5.710 1.00 0.00 C ATOM 0 H LEU A 92 5.354 13.669 -1.552 1.00 0.00 H new ATOM 0 HA LEU A 92 3.717 14.754 -3.695 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.437 11.956 -2.735 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.388 12.254 -4.106 1.00 0.00 H new ATOM 0 HG LEU A 92 6.274 13.222 -3.904 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.846 11.465 -5.547 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.256 10.784 -4.013 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.187 10.830 -5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.044 13.690 -6.350 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.333 13.207 -6.269 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.895 14.643 -5.381 1.00 0.00 H new ATOM 1521 N ILE A 93 2.386 13.576 -0.958 1.00 0.00 N ATOM 1522 CA ILE A 93 1.198 13.672 -0.092 1.00 0.00 C ATOM 1523 C ILE A 93 1.588 14.415 1.191 1.00 0.00 C ATOM 1524 O ILE A 93 2.769 14.454 1.564 1.00 0.00 O ATOM 1525 CB ILE A 93 0.557 12.275 0.282 1.00 0.00 C ATOM 1526 CG1 ILE A 93 1.603 11.347 0.961 1.00 0.00 C ATOM 1527 CG2 ILE A 93 -0.071 11.589 -0.956 1.00 0.00 C ATOM 1528 CD1 ILE A 93 1.042 10.051 1.510 1.00 0.00 C ATOM 0 H ILE A 93 3.218 13.250 -0.466 1.00 0.00 H new ATOM 0 HA ILE A 93 0.436 14.211 -0.656 1.00 0.00 H new ATOM 0 HB ILE A 93 -0.245 12.462 0.996 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.383 11.111 0.237 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.079 11.894 1.775 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -0.502 10.632 -0.662 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.852 12.227 -1.368 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.699 11.424 -1.710 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.845 9.470 1.964 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.284 10.272 2.262 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.593 9.477 0.700 1.00 0.00 H new ATOM 1540 N THR A 94 0.596 15.015 1.848 1.00 0.00 N ATOM 1541 CA THR A 94 0.778 15.729 3.124 1.00 0.00 C ATOM 1542 C THR A 94 0.120 14.955 4.286 1.00 0.00 C ATOM 1543 O THR A 94 0.044 15.474 5.407 1.00 0.00 O ATOM 1544 CB THR A 94 0.180 17.177 3.015 1.00 0.00 C ATOM 1545 OG1 THR A 94 -1.170 17.103 2.510 1.00 0.00 O ATOM 1546 CG2 THR A 94 1.029 18.082 2.098 1.00 0.00 C ATOM 0 H THR A 94 -0.367 15.023 1.512 1.00 0.00 H new ATOM 0 HA THR A 94 1.845 15.802 3.333 1.00 0.00 H new ATOM 0 HB THR A 94 0.185 17.618 4.012 1.00 0.00 H new ATOM 0 HG1 THR A 94 -1.544 18.006 2.443 1.00 0.00 H new ATOM 0 HG21 THR A 94 0.581 19.074 2.050 1.00 0.00 H new ATOM 0 HG22 THR A 94 2.040 18.160 2.498 1.00 0.00 H new ATOM 0 HG23 THR A 94 1.067 17.652 1.097 1.00 0.00 H new ATOM 1554 N LYS A 95 -0.325 13.702 4.019 1.00 0.00 N ATOM 1555 CA LYS A 95 -1.015 12.872 5.025 1.00 0.00 C ATOM 1556 C LYS A 95 -1.011 11.391 4.608 1.00 0.00 C ATOM 1557 O LYS A 95 -1.428 11.057 3.491 1.00 0.00 O ATOM 1558 CB LYS A 95 -2.471 13.367 5.220 1.00 0.00 C ATOM 1559 CG LYS A 95 -3.284 12.621 6.303 1.00 0.00 C ATOM 1560 CD LYS A 95 -4.716 13.187 6.460 1.00 0.00 C ATOM 1561 CE LYS A 95 -4.725 14.681 6.842 1.00 0.00 C ATOM 1562 NZ LYS A 95 -6.097 15.223 6.955 1.00 0.00 N ATOM 0 H LYS A 95 -0.216 13.248 3.112 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.479 12.964 5.970 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -2.446 14.427 5.474 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.997 13.279 4.270 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -3.340 11.563 6.047 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -2.762 12.690 7.257 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.261 13.052 5.526 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -5.246 12.617 7.223 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -4.205 14.814 7.790 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.173 15.249 6.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -6.052 16.229 7.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.587 15.121 6.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -6.618 14.700 7.688 1.00 0.00 H new ATOM 1576 N ASN A 96 -0.549 10.523 5.525 1.00 0.00 N ATOM 1577 CA ASN A 96 -0.601 9.065 5.364 1.00 0.00 C ATOM 1578 C ASN A 96 -2.015 8.591 5.754 1.00 0.00 C ATOM 1579 O ASN A 96 -2.318 8.397 6.940 1.00 0.00 O ATOM 1580 CB ASN A 96 0.483 8.394 6.256 1.00 0.00 C ATOM 1581 CG ASN A 96 0.672 6.889 6.021 1.00 0.00 C ATOM 1582 OD1 ASN A 96 -0.240 6.157 5.629 1.00 0.00 O ATOM 1583 ND2 ASN A 96 1.867 6.414 6.281 1.00 0.00 N ATOM 0 H ASN A 96 -0.126 10.819 6.405 1.00 0.00 H new ATOM 0 HA ASN A 96 -0.397 8.784 4.331 1.00 0.00 H new ATOM 0 HB2 ASN A 96 1.435 8.896 6.085 1.00 0.00 H new ATOM 0 HB3 ASN A 96 0.222 8.554 7.302 1.00 0.00 H new ATOM 0 HD21 ASN A 96 2.058 5.419 6.160 1.00 0.00 H new ATOM 0 HD22 ASN A 96 2.605 7.039 6.604 1.00 0.00 H new ATOM 1590 N VAL A 97 -2.876 8.446 4.741 1.00 0.00 N ATOM 1591 CA VAL A 97 -4.284 8.035 4.909 1.00 0.00 C ATOM 1592 C VAL A 97 -4.419 6.537 5.295 1.00 0.00 C ATOM 1593 O VAL A 97 -5.493 6.101 5.721 1.00 0.00 O ATOM 1594 CB VAL A 97 -5.117 8.359 3.607 1.00 0.00 C ATOM 1595 CG1 VAL A 97 -5.210 9.892 3.373 1.00 0.00 C ATOM 1596 CG2 VAL A 97 -4.519 7.652 2.356 1.00 0.00 C ATOM 0 H VAL A 97 -2.617 8.611 3.768 1.00 0.00 H new ATOM 0 HA VAL A 97 -4.692 8.613 5.738 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.124 7.972 3.761 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -5.789 10.088 2.470 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -5.699 10.361 4.227 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.207 10.304 3.258 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.117 7.897 1.479 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.494 7.990 2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -4.526 6.573 2.510 1.00 0.00 H new ATOM 1606 N ALA A 98 -3.318 5.767 5.166 1.00 0.00 N ATOM 1607 CA ALA A 98 -3.275 4.333 5.534 1.00 0.00 C ATOM 1608 C ALA A 98 -2.925 4.171 7.022 1.00 0.00 C ATOM 1609 O ALA A 98 -3.299 3.173 7.644 1.00 0.00 O ATOM 1610 CB ALA A 98 -2.262 3.580 4.664 1.00 0.00 C ATOM 0 H ALA A 98 -2.433 6.121 4.804 1.00 0.00 H new ATOM 0 HA ALA A 98 -4.263 3.906 5.359 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -2.246 2.529 4.951 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -2.548 3.666 3.616 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.270 4.010 4.806 1.00 0.00 H new ATOM 1616 N ALA A 99 -2.187 5.158 7.580 1.00 0.00 N ATOM 1617 CA ALA A 99 -1.857 5.197 9.022 1.00 0.00 C ATOM 1618 C ALA A 99 -3.104 5.556 9.845 1.00 0.00 C ATOM 1619 O ALA A 99 -3.213 5.184 11.018 1.00 0.00 O ATOM 1620 CB ALA A 99 -0.716 6.184 9.290 1.00 0.00 C ATOM 0 H ALA A 99 -1.807 5.942 7.049 1.00 0.00 H new ATOM 0 HA ALA A 99 -1.520 4.207 9.329 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.489 6.197 10.356 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.170 5.876 8.734 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -1.016 7.182 8.970 1.00 0.00 H new ATOM 1626 N LYS A 100 -4.040 6.283 9.207 1.00 0.00 N ATOM 1627 CA LYS A 100 -5.349 6.620 9.800 1.00 0.00 C ATOM 1628 C LYS A 100 -6.320 5.421 9.732 1.00 0.00 C ATOM 1629 O LYS A 100 -7.391 5.444 10.350 1.00 0.00 O ATOM 1630 CB LYS A 100 -5.953 7.859 9.083 1.00 0.00 C ATOM 1631 CG LYS A 100 -5.033 9.106 9.095 1.00 0.00 C ATOM 1632 CD LYS A 100 -4.594 9.515 10.529 1.00 0.00 C ATOM 1633 CE LYS A 100 -3.640 10.724 10.548 1.00 0.00 C ATOM 1634 NZ LYS A 100 -3.194 11.051 11.930 1.00 0.00 N ATOM 0 H LYS A 100 -3.911 6.654 8.266 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.197 6.860 10.852 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -6.176 7.595 8.049 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.900 8.115 9.558 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -4.148 8.905 8.492 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -5.554 9.941 8.627 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -5.479 9.749 11.120 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -4.105 8.667 11.009 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -2.771 10.512 9.926 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -4.140 11.589 10.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -2.553 11.870 11.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -4.022 11.278 12.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -2.695 10.234 12.336 1.00 0.00 H new ATOM 1648 N THR A 101 -5.928 4.379 8.975 1.00 0.00 N ATOM 1649 CA THR A 101 -6.684 3.129 8.847 1.00 0.00 C ATOM 1650 C THR A 101 -6.038 2.056 9.749 1.00 0.00 C ATOM 1651 O THR A 101 -4.886 1.661 9.521 1.00 0.00 O ATOM 1652 CB THR A 101 -6.692 2.653 7.357 1.00 0.00 C ATOM 1653 OG1 THR A 101 -7.129 3.734 6.520 1.00 0.00 O ATOM 1654 CG2 THR A 101 -7.601 1.431 7.135 1.00 0.00 C ATOM 0 H THR A 101 -5.066 4.387 8.430 1.00 0.00 H new ATOM 0 HA THR A 101 -7.716 3.292 9.159 1.00 0.00 H new ATOM 0 HB THR A 101 -5.676 2.352 7.100 1.00 0.00 H new ATOM 0 HG1 THR A 101 -6.396 4.374 6.402 1.00 0.00 H new ATOM 0 HG21 THR A 101 -7.571 1.141 6.085 1.00 0.00 H new ATOM 0 HG22 THR A 101 -7.253 0.602 7.751 1.00 0.00 H new ATOM 0 HG23 THR A 101 -8.624 1.684 7.412 1.00 0.00 H new ATOM 1662 N LYS A 102 -6.773 1.618 10.786 1.00 0.00 N ATOM 1663 CA LYS A 102 -6.310 0.574 11.722 1.00 0.00 C ATOM 1664 C LYS A 102 -6.499 -0.830 11.110 1.00 0.00 C ATOM 1665 O LYS A 102 -7.154 -0.984 10.072 1.00 0.00 O ATOM 1666 CB LYS A 102 -7.082 0.667 13.073 1.00 0.00 C ATOM 1667 CG LYS A 102 -8.569 0.233 12.993 1.00 0.00 C ATOM 1668 CD LYS A 102 -9.298 0.317 14.352 1.00 0.00 C ATOM 1669 CE LYS A 102 -10.735 -0.237 14.279 1.00 0.00 C ATOM 1670 NZ LYS A 102 -11.473 -0.061 15.552 1.00 0.00 N ATOM 0 H LYS A 102 -7.704 1.976 11.000 1.00 0.00 H new ATOM 0 HA LYS A 102 -5.249 0.737 11.909 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -6.574 0.046 13.811 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -7.035 1.694 13.434 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -9.087 0.863 12.270 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -8.623 -0.790 12.621 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -8.734 -0.240 15.100 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -9.327 1.355 14.683 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -11.275 0.266 13.477 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -10.701 -1.297 14.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -12.433 -0.449 15.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -10.974 -0.562 16.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.531 0.951 15.783 1.00 0.00 H new ATOM 1684 N LEU A 103 -5.891 -1.836 11.750 1.00 0.00 N ATOM 1685 CA LEU A 103 -6.177 -3.249 11.467 1.00 0.00 C ATOM 1686 C LEU A 103 -7.538 -3.625 12.095 1.00 0.00 C ATOM 1687 O LEU A 103 -7.718 -3.437 13.304 1.00 0.00 O ATOM 1688 CB LEU A 103 -5.056 -4.156 12.047 1.00 0.00 C ATOM 1689 CG LEU A 103 -5.283 -5.696 11.898 1.00 0.00 C ATOM 1690 CD1 LEU A 103 -5.395 -6.106 10.418 1.00 0.00 C ATOM 1691 CD2 LEU A 103 -4.186 -6.501 12.629 1.00 0.00 C ATOM 0 H LEU A 103 -5.189 -1.695 12.476 1.00 0.00 H new ATOM 0 HA LEU A 103 -6.216 -3.399 10.388 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -4.116 -3.897 11.559 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -4.939 -3.926 13.106 1.00 0.00 H new ATOM 0 HG LEU A 103 -6.233 -5.936 12.375 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.552 -7.182 10.350 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -6.236 -5.586 9.959 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -4.476 -5.840 9.896 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -4.374 -7.568 12.505 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -3.211 -6.253 12.208 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -4.197 -6.251 13.690 1.00 0.00 H new ATOM 1703 N PRO A 104 -8.531 -4.117 11.295 1.00 0.00 N ATOM 1704 CA PRO A 104 -9.759 -4.723 11.842 1.00 0.00 C ATOM 1705 C PRO A 104 -9.568 -6.230 12.133 1.00 0.00 C ATOM 1706 O PRO A 104 -8.659 -6.884 11.587 1.00 0.00 O ATOM 1707 CB PRO A 104 -10.773 -4.495 10.703 1.00 0.00 C ATOM 1708 CG PRO A 104 -9.950 -4.645 9.459 1.00 0.00 C ATOM 1709 CD PRO A 104 -8.567 -4.097 9.801 1.00 0.00 C ATOM 0 HA PRO A 104 -10.068 -4.293 12.795 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -11.584 -5.223 10.737 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -11.229 -3.507 10.765 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -9.891 -5.690 9.154 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -10.393 -4.095 8.629 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -7.776 -4.714 9.374 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -8.430 -3.088 9.412 1.00 0.00 H new