USER MOD reduce.3.24.130724 H: found=0, std=0, add=1045, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 853 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 130 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Set 1.2: A 131 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 115 ASN : amide:sc= 0 K(o=0.37,f=-0.45) USER MOD Set 2.2: A 123 ASN : amide:sc= 0.367 K(o=0.37,f=-3!) USER MOD Single : A 3 SER OG : rot 145:sc= 1.42 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 13 SER OG : rot -94:sc= 1.04 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.145 K(o=-0.15,f=-3.1!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= -0.825 X(o=-0.82,f=-0.45) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0951) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00266) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 MET CE :methyl -175:sc= -0.345 (180deg=-0.454) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.0925 K(o=-0.093,f=-1.2) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= 0.942 K(o=0.94,f=-1.8) USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0921 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0458) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 GLN : amide:sc= -0.117 K(o=-0.12,f=-1.2!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -60:sc= -0.237 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 124 GLN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ -113:sc= 0.714 (180deg=0) USER MOD Single : A 138 MET CE :methyl -165:sc= -0.0541 (180deg=-0.423) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc=-0.000534 X(o=-0.00053,f=0) USER MOD ----------------------------------------------------------------- ATOM 29 N SER A 3 -12.228 16.076 9.732 1.00 0.00 N ATOM 30 CA SER A 3 -11.097 16.521 8.906 1.00 0.00 C ATOM 31 C SER A 3 -11.169 15.959 7.474 1.00 0.00 C ATOM 32 O SER A 3 -11.564 16.666 6.545 1.00 0.00 O ATOM 33 CB SER A 3 -9.796 16.097 9.605 1.00 0.00 C ATOM 34 OG SER A 3 -9.937 14.764 10.087 1.00 0.00 O ATOM 0 HA SER A 3 -11.132 17.606 8.806 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.959 16.159 8.910 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.575 16.774 10.431 1.00 0.00 H new ATOM 0 HG SER A 3 -9.079 14.297 10.014 1.00 0.00 H new ATOM 39 N ILE A 4 -10.806 14.687 7.309 1.00 0.00 N ATOM 40 CA ILE A 4 -10.776 13.965 6.028 1.00 0.00 C ATOM 41 C ILE A 4 -11.101 12.473 6.199 1.00 0.00 C ATOM 42 O ILE A 4 -11.952 11.983 5.459 1.00 0.00 O ATOM 43 CB ILE A 4 -9.436 14.129 5.247 1.00 0.00 C ATOM 44 CG1 ILE A 4 -8.217 14.708 6.012 1.00 0.00 C ATOM 45 CG2 ILE A 4 -9.683 14.890 3.937 1.00 0.00 C ATOM 46 CD1 ILE A 4 -8.020 16.230 6.055 1.00 0.00 C ATOM 0 H ILE A 4 -10.512 14.104 8.093 1.00 0.00 H new ATOM 0 HA ILE A 4 -11.557 14.432 5.428 1.00 0.00 H new ATOM 0 HB ILE A 4 -9.121 13.103 5.058 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.276 14.355 7.041 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.318 14.272 5.577 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -8.742 15.000 3.397 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -10.391 14.335 3.322 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -10.091 15.876 4.160 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -7.123 16.465 6.629 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -7.912 16.612 5.040 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -8.885 16.696 6.527 1.00 0.00 H new ATOM 57 N VAL A 5 -10.480 11.787 7.179 1.00 0.00 N ATOM 58 CA VAL A 5 -10.697 10.362 7.556 1.00 0.00 C ATOM 59 C VAL A 5 -11.000 9.464 6.335 1.00 0.00 C ATOM 60 O VAL A 5 -12.154 9.193 5.997 1.00 0.00 O ATOM 61 CB VAL A 5 -11.742 10.245 8.691 1.00 0.00 C ATOM 62 CG1 VAL A 5 -12.090 8.799 9.083 1.00 0.00 C ATOM 63 CG2 VAL A 5 -11.197 10.922 9.960 1.00 0.00 C ATOM 0 H VAL A 5 -9.773 12.230 7.766 1.00 0.00 H new ATOM 0 HA VAL A 5 -9.760 9.975 7.956 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.643 10.721 8.303 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -12.829 8.807 9.884 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -12.498 8.276 8.218 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.190 8.288 9.424 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -11.932 10.840 10.760 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.272 10.432 10.265 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -10.999 11.974 9.755 1.00 0.00 H new ATOM 73 N LEU A 6 -9.932 9.041 5.647 1.00 0.00 N ATOM 74 CA LEU A 6 -9.972 8.185 4.454 1.00 0.00 C ATOM 75 C LEU A 6 -10.911 6.980 4.631 1.00 0.00 C ATOM 76 O LEU A 6 -10.938 6.340 5.684 1.00 0.00 O ATOM 77 CB LEU A 6 -8.539 7.723 4.128 1.00 0.00 C ATOM 78 CG LEU A 6 -8.036 8.139 2.733 1.00 0.00 C ATOM 79 CD1 LEU A 6 -6.553 8.506 2.792 1.00 0.00 C ATOM 80 CD2 LEU A 6 -8.198 7.006 1.717 1.00 0.00 C ATOM 0 H LEU A 6 -8.981 9.295 5.916 1.00 0.00 H new ATOM 0 HA LEU A 6 -10.374 8.766 3.624 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.861 8.126 4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -8.494 6.637 4.208 1.00 0.00 H new ATOM 0 HG LEU A 6 -8.634 8.996 2.421 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -6.211 8.798 1.799 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -6.411 9.336 3.484 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -5.979 7.646 3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -7.833 7.335 0.744 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -7.625 6.138 2.045 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -9.251 6.737 1.637 1.00 0.00 H new ATOM 91 N GLU A 7 -11.692 6.690 3.588 1.00 0.00 N ATOM 92 CA GLU A 7 -12.702 5.625 3.613 1.00 0.00 C ATOM 93 C GLU A 7 -12.065 4.230 3.832 1.00 0.00 C ATOM 94 O GLU A 7 -10.931 3.998 3.388 1.00 0.00 O ATOM 95 CB GLU A 7 -13.535 5.638 2.311 1.00 0.00 C ATOM 96 CG GLU A 7 -15.028 5.935 2.545 1.00 0.00 C ATOM 97 CD GLU A 7 -15.395 7.393 2.218 1.00 0.00 C ATOM 98 OE1 GLU A 7 -15.513 7.736 1.017 1.00 0.00 O ATOM 99 OE2 GLU A 7 -15.597 8.197 3.159 1.00 0.00 O ATOM 0 H GLU A 7 -11.643 7.188 2.699 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.362 5.821 4.458 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.125 6.387 1.633 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.437 4.672 1.816 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.629 5.265 1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -15.279 5.725 3.585 1.00 0.00 H new ATOM 104 N PRO A 8 -12.787 3.272 4.453 1.00 0.00 N ATOM 105 CA PRO A 8 -12.293 1.907 4.646 1.00 0.00 C ATOM 106 C PRO A 8 -12.222 1.161 3.292 1.00 0.00 C ATOM 107 O PRO A 8 -13.143 1.266 2.473 1.00 0.00 O ATOM 108 CB PRO A 8 -13.281 1.269 5.627 1.00 0.00 C ATOM 109 CG PRO A 8 -14.592 2.031 5.437 1.00 0.00 C ATOM 110 CD PRO A 8 -14.165 3.395 4.913 1.00 0.00 C ATOM 0 HA PRO A 8 -11.278 1.871 5.043 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -13.410 0.207 5.419 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -12.924 1.352 6.654 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -15.249 1.522 4.731 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -15.140 2.119 6.375 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -14.815 3.714 4.098 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -14.243 4.149 5.696 1.00 0.00 H new ATOM 115 N ILE A 9 -11.152 0.387 3.070 1.00 0.00 N ATOM 116 CA ILE A 9 -10.893 -0.361 1.825 1.00 0.00 C ATOM 117 C ILE A 9 -10.827 -1.867 2.098 1.00 0.00 C ATOM 118 O ILE A 9 -9.895 -2.356 2.736 1.00 0.00 O ATOM 119 CB ILE A 9 -9.635 0.128 1.066 1.00 0.00 C ATOM 120 CG1 ILE A 9 -8.398 0.471 1.925 1.00 0.00 C ATOM 121 CG2 ILE A 9 -9.984 1.292 0.150 1.00 0.00 C ATOM 122 CD1 ILE A 9 -8.258 1.887 2.509 1.00 0.00 C ATOM 0 H ILE A 9 -10.420 0.258 3.769 1.00 0.00 H new ATOM 0 HA ILE A 9 -11.737 -0.162 1.165 1.00 0.00 H new ATOM 0 HB ILE A 9 -9.323 -0.743 0.490 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -8.372 -0.231 2.758 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -7.514 0.278 1.318 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -9.088 1.623 -0.375 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -10.733 0.973 -0.575 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -10.381 2.115 0.743 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -7.334 1.954 3.084 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -8.234 2.614 1.698 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.106 2.098 3.160 1.00 0.00 H new ATOM 133 N TYR A 10 -11.822 -2.595 1.586 1.00 0.00 N ATOM 134 CA TYR A 10 -12.115 -4.009 1.882 1.00 0.00 C ATOM 135 C TYR A 10 -11.731 -4.928 0.709 1.00 0.00 C ATOM 136 O TYR A 10 -12.595 -5.514 0.060 1.00 0.00 O ATOM 137 CB TYR A 10 -13.600 -4.170 2.238 1.00 0.00 C ATOM 138 CG TYR A 10 -14.088 -3.347 3.413 1.00 0.00 C ATOM 139 CD1 TYR A 10 -13.881 -3.803 4.730 1.00 0.00 C ATOM 140 CD2 TYR A 10 -14.808 -2.158 3.179 1.00 0.00 C ATOM 141 CE1 TYR A 10 -14.399 -3.072 5.818 1.00 0.00 C ATOM 142 CE2 TYR A 10 -15.338 -1.437 4.262 1.00 0.00 C ATOM 143 CZ TYR A 10 -15.141 -1.892 5.582 1.00 0.00 C ATOM 144 OH TYR A 10 -15.656 -1.181 6.625 1.00 0.00 O ATOM 0 H TYR A 10 -12.483 -2.198 0.918 1.00 0.00 H new ATOM 0 HA TYR A 10 -11.509 -4.310 2.737 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -14.195 -3.908 1.363 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -13.792 -5.222 2.450 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -13.326 -4.712 4.906 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -14.952 -1.802 2.170 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -14.230 -3.412 6.829 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -15.898 -0.531 4.083 1.00 0.00 H new ATOM 0 HH TYR A 10 -16.136 -0.398 6.282 1.00 0.00 H new ATOM 153 N TRP A 11 -10.438 -4.994 0.381 1.00 0.00 N ATOM 154 CA TRP A 11 -9.850 -5.519 -0.870 1.00 0.00 C ATOM 155 C TRP A 11 -10.221 -4.713 -2.121 1.00 0.00 C ATOM 156 O TRP A 11 -9.330 -4.408 -2.915 1.00 0.00 O ATOM 157 CB TRP A 11 -10.138 -7.026 -1.075 1.00 0.00 C ATOM 158 CG TRP A 11 -10.957 -7.431 -2.271 1.00 0.00 C ATOM 159 CD1 TRP A 11 -10.580 -7.315 -3.561 1.00 0.00 C ATOM 160 CD2 TRP A 11 -12.323 -7.998 -2.303 1.00 0.00 C ATOM 161 NE1 TRP A 11 -11.630 -7.667 -4.387 1.00 0.00 N ATOM 162 CE2 TRP A 11 -12.693 -8.154 -3.674 1.00 0.00 C ATOM 163 CE3 TRP A 11 -13.254 -8.369 -1.332 1.00 0.00 C ATOM 164 CZ2 TRP A 11 -13.944 -8.697 -4.052 1.00 0.00 C ATOM 165 CZ3 TRP A 11 -14.528 -8.891 -1.700 1.00 0.00 C ATOM 166 CH2 TRP A 11 -14.848 -9.068 -3.052 1.00 0.00 C ATOM 0 H TRP A 11 -9.718 -4.661 1.022 1.00 0.00 H new ATOM 0 HA TRP A 11 -8.775 -5.398 -0.737 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -9.181 -7.544 -1.134 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -10.645 -7.394 -0.183 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -9.605 -6.995 -3.897 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -11.615 -7.575 -5.403 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -13.006 -8.259 -0.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -14.196 -8.823 -5.095 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -15.247 -9.150 -0.936 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -15.802 -9.495 -3.325 1.00 0.00 H new ATOM 176 N ASN A 12 -11.513 -4.394 -2.289 1.00 0.00 N ATOM 177 CA ASN A 12 -12.125 -3.676 -3.411 1.00 0.00 C ATOM 178 C ASN A 12 -11.275 -2.458 -3.793 1.00 0.00 C ATOM 179 O ASN A 12 -11.343 -1.413 -3.143 1.00 0.00 O ATOM 180 CB ASN A 12 -13.569 -3.259 -3.058 1.00 0.00 C ATOM 181 CG ASN A 12 -14.598 -4.374 -3.201 1.00 0.00 C ATOM 182 OD1 ASN A 12 -14.416 -5.493 -2.749 1.00 0.00 O ATOM 183 ND2 ASN A 12 -15.723 -4.111 -3.834 1.00 0.00 N ATOM 0 H ASN A 12 -12.208 -4.652 -1.589 1.00 0.00 H new ATOM 0 HA ASN A 12 -12.167 -4.341 -4.273 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -13.588 -2.893 -2.032 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -13.861 -2.427 -3.699 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -16.430 -4.839 -3.942 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -15.887 -3.180 -4.216 1.00 0.00 H new ATOM 189 N SER A 13 -10.440 -2.625 -4.819 1.00 0.00 N ATOM 190 CA SER A 13 -9.499 -1.585 -5.224 1.00 0.00 C ATOM 191 C SER A 13 -10.237 -0.316 -5.677 1.00 0.00 C ATOM 192 O SER A 13 -9.725 0.776 -5.479 1.00 0.00 O ATOM 193 CB SER A 13 -8.528 -2.105 -6.290 1.00 0.00 C ATOM 194 OG SER A 13 -7.234 -1.569 -6.070 1.00 0.00 O ATOM 0 H SER A 13 -10.398 -3.473 -5.384 1.00 0.00 H new ATOM 0 HA SER A 13 -8.900 -1.310 -4.356 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.490 -3.194 -6.259 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.882 -1.827 -7.283 1.00 0.00 H new ATOM 0 HG SER A 13 -7.121 -0.756 -6.605 1.00 0.00 H new ATOM 199 N SER A 14 -11.484 -0.458 -6.155 1.00 0.00 N ATOM 200 CA SER A 14 -12.508 0.552 -6.515 1.00 0.00 C ATOM 201 C SER A 14 -12.944 1.547 -5.404 1.00 0.00 C ATOM 202 O SER A 14 -14.118 1.907 -5.301 1.00 0.00 O ATOM 203 CB SER A 14 -13.722 -0.206 -7.093 1.00 0.00 C ATOM 204 OG SER A 14 -14.219 -1.173 -6.172 1.00 0.00 O ATOM 0 H SER A 14 -11.848 -1.396 -6.320 1.00 0.00 H new ATOM 0 HA SER A 14 -12.039 1.215 -7.242 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.512 0.503 -7.339 1.00 0.00 H new ATOM 0 HB3 SER A 14 -13.436 -0.700 -8.022 1.00 0.00 H new ATOM 0 HG SER A 14 -14.988 -1.635 -6.566 1.00 0.00 H new ATOM 209 N ASN A 15 -12.018 2.000 -4.559 1.00 0.00 N ATOM 210 CA ASN A 15 -12.244 3.031 -3.540 1.00 0.00 C ATOM 211 C ASN A 15 -12.621 4.411 -4.137 1.00 0.00 C ATOM 212 O ASN A 15 -12.349 4.698 -5.302 1.00 0.00 O ATOM 213 CB ASN A 15 -10.970 3.136 -2.684 1.00 0.00 C ATOM 214 CG ASN A 15 -11.191 3.990 -1.450 1.00 0.00 C ATOM 215 OD1 ASN A 15 -10.656 5.077 -1.322 1.00 0.00 O ATOM 216 ND2 ASN A 15 -12.079 3.605 -0.563 1.00 0.00 N ATOM 0 H ASN A 15 -11.060 1.650 -4.563 1.00 0.00 H new ATOM 0 HA ASN A 15 -13.100 2.735 -2.934 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -10.651 2.138 -2.383 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -10.164 3.562 -3.282 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -12.313 4.214 0.221 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -12.535 2.697 -0.658 1.00 0.00 H new ATOM 222 N SER A 16 -13.150 5.311 -3.303 1.00 0.00 N ATOM 223 CA SER A 16 -13.345 6.731 -3.642 1.00 0.00 C ATOM 224 C SER A 16 -12.036 7.441 -4.058 1.00 0.00 C ATOM 225 O SER A 16 -12.026 8.186 -5.039 1.00 0.00 O ATOM 226 CB SER A 16 -13.985 7.433 -2.439 1.00 0.00 C ATOM 227 OG SER A 16 -14.264 8.787 -2.742 1.00 0.00 O ATOM 0 H SER A 16 -13.460 5.075 -2.360 1.00 0.00 H new ATOM 0 HA SER A 16 -14.000 6.786 -4.512 1.00 0.00 H new ATOM 0 HB2 SER A 16 -14.905 6.920 -2.159 1.00 0.00 H new ATOM 0 HB3 SER A 16 -13.316 7.377 -1.580 1.00 0.00 H new ATOM 0 HG SER A 16 -14.673 9.219 -1.963 1.00 0.00 H new ATOM 232 N LYS A 17 -10.913 7.171 -3.368 1.00 0.00 N ATOM 233 CA LYS A 17 -9.576 7.738 -3.665 1.00 0.00 C ATOM 234 C LYS A 17 -8.790 6.986 -4.759 1.00 0.00 C ATOM 235 O LYS A 17 -7.717 7.437 -5.168 1.00 0.00 O ATOM 236 CB LYS A 17 -8.749 7.843 -2.357 1.00 0.00 C ATOM 237 CG LYS A 17 -8.448 9.292 -1.963 1.00 0.00 C ATOM 238 CD LYS A 17 -9.701 10.076 -1.526 1.00 0.00 C ATOM 239 CE LYS A 17 -9.812 11.439 -2.226 1.00 0.00 C ATOM 240 NZ LYS A 17 -8.765 12.396 -1.772 1.00 0.00 N ATOM 0 H LYS A 17 -10.905 6.538 -2.568 1.00 0.00 H new ATOM 0 HA LYS A 17 -9.750 8.731 -4.079 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -9.293 7.356 -1.548 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.811 7.302 -2.481 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.722 9.297 -1.150 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.984 9.802 -2.807 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.591 9.485 -1.744 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.675 10.226 -0.447 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.730 11.299 -3.304 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.797 11.864 -2.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.881 13.300 -2.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -8.858 12.552 -0.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.824 12.005 -1.978 1.00 0.00 H new ATOM 250 N PHE A 18 -9.291 5.836 -5.219 1.00 0.00 N ATOM 251 CA PHE A 18 -8.730 5.059 -6.335 1.00 0.00 C ATOM 252 C PHE A 18 -8.952 5.780 -7.673 1.00 0.00 C ATOM 253 O PHE A 18 -10.032 5.713 -8.264 1.00 0.00 O ATOM 254 CB PHE A 18 -9.298 3.638 -6.342 1.00 0.00 C ATOM 255 CG PHE A 18 -8.622 2.687 -7.317 1.00 0.00 C ATOM 256 CD1 PHE A 18 -7.432 2.029 -6.942 1.00 0.00 C ATOM 257 CD2 PHE A 18 -9.233 2.363 -8.544 1.00 0.00 C ATOM 258 CE1 PHE A 18 -6.839 1.087 -7.799 1.00 0.00 C ATOM 259 CE2 PHE A 18 -8.652 1.400 -9.388 1.00 0.00 C ATOM 260 CZ PHE A 18 -7.454 0.768 -9.019 1.00 0.00 C ATOM 0 H PHE A 18 -10.123 5.405 -4.815 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.652 4.976 -6.194 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -9.217 3.224 -5.337 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -10.360 3.687 -6.581 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -6.974 2.251 -5.990 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -10.149 2.855 -8.837 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.912 0.609 -7.519 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -9.129 1.146 -10.323 1.00 0.00 H new ATOM 0 HZ PHE A 18 -7.006 0.036 -9.674 1.00 0.00 H new ATOM 269 N LEU A 19 -7.943 6.531 -8.118 1.00 0.00 N ATOM 270 CA LEU A 19 -8.017 7.408 -9.287 1.00 0.00 C ATOM 271 C LEU A 19 -7.483 6.687 -10.550 1.00 0.00 C ATOM 272 O LEU A 19 -6.352 6.187 -10.517 1.00 0.00 O ATOM 273 CB LEU A 19 -7.258 8.718 -8.974 1.00 0.00 C ATOM 274 CG LEU A 19 -8.038 9.966 -9.440 1.00 0.00 C ATOM 275 CD1 LEU A 19 -8.040 11.027 -8.343 1.00 0.00 C ATOM 276 CD2 LEU A 19 -7.434 10.565 -10.708 1.00 0.00 C ATOM 0 H LEU A 19 -7.030 6.546 -7.664 1.00 0.00 H new ATOM 0 HA LEU A 19 -9.054 7.662 -9.505 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.077 8.784 -7.901 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.283 8.697 -9.461 1.00 0.00 H new ATOM 0 HG LEU A 19 -9.058 9.649 -9.656 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.593 11.902 -8.684 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -8.514 10.624 -7.448 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -7.014 11.314 -8.112 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -8.009 11.442 -11.006 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -6.401 10.857 -10.516 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -7.460 9.825 -11.508 1.00 0.00 H new ATOM 287 N PRO A 20 -8.267 6.612 -11.651 1.00 0.00 N ATOM 288 CA PRO A 20 -7.904 5.835 -12.837 1.00 0.00 C ATOM 289 C PRO A 20 -6.683 6.449 -13.553 1.00 0.00 C ATOM 290 O PRO A 20 -6.789 7.495 -14.199 1.00 0.00 O ATOM 291 CB PRO A 20 -9.173 5.786 -13.700 1.00 0.00 C ATOM 292 CG PRO A 20 -9.975 7.016 -13.274 1.00 0.00 C ATOM 293 CD PRO A 20 -9.567 7.248 -11.824 1.00 0.00 C ATOM 0 HA PRO A 20 -7.584 4.822 -12.593 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -8.932 5.818 -14.762 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -9.734 4.867 -13.528 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.740 7.879 -13.896 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -11.047 6.842 -13.363 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -9.509 8.314 -11.603 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.302 6.820 -11.142 1.00 0.00 H new ATOM 298 N GLY A 21 -5.521 5.794 -13.440 1.00 0.00 N ATOM 299 CA GLY A 21 -4.275 6.183 -14.117 1.00 0.00 C ATOM 300 C GLY A 21 -3.009 5.614 -13.466 1.00 0.00 C ATOM 301 O GLY A 21 -2.240 4.917 -14.126 1.00 0.00 O ATOM 0 H GLY A 21 -5.417 4.960 -12.862 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -4.318 5.852 -15.154 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -4.206 7.271 -14.132 1.00 0.00 H new ATOM 304 N GLN A 22 -2.821 5.857 -12.164 1.00 0.00 N ATOM 305 CA GLN A 22 -1.706 5.318 -11.361 1.00 0.00 C ATOM 306 C GLN A 22 -2.147 4.205 -10.403 1.00 0.00 C ATOM 307 O GLN A 22 -1.403 3.239 -10.221 1.00 0.00 O ATOM 308 CB GLN A 22 -1.014 6.445 -10.568 1.00 0.00 C ATOM 309 CG GLN A 22 0.217 6.978 -11.315 1.00 0.00 C ATOM 310 CD GLN A 22 0.786 8.222 -10.641 1.00 0.00 C ATOM 311 OE1 GLN A 22 1.364 8.173 -9.566 1.00 0.00 O ATOM 312 NE2 GLN A 22 0.649 9.387 -11.239 1.00 0.00 N ATOM 0 H GLN A 22 -3.452 6.447 -11.622 1.00 0.00 H new ATOM 0 HA GLN A 22 -1.001 4.879 -12.067 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -1.719 7.259 -10.398 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -0.715 6.072 -9.588 1.00 0.00 H new ATOM 0 HG2 GLN A 22 0.982 6.203 -11.356 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -0.054 7.213 -12.344 1.00 0.00 H new ATOM 0 HE21 GLN A 22 0.169 9.446 -12.137 1.00 0.00 H new ATOM 0 HE22 GLN A 22 1.023 10.231 -10.804 1.00 0.00 H new ATOM 319 N GLY A 23 -3.350 4.322 -9.834 1.00 0.00 N ATOM 320 CA GLY A 23 -3.982 3.339 -8.946 1.00 0.00 C ATOM 321 C GLY A 23 -4.762 4.040 -7.835 1.00 0.00 C ATOM 322 O GLY A 23 -5.939 4.353 -7.998 1.00 0.00 O ATOM 0 H GLY A 23 -3.938 5.142 -9.986 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -4.652 2.700 -9.521 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.221 2.692 -8.510 1.00 0.00 H new ATOM 325 N LEU A 24 -4.091 4.368 -6.732 1.00 0.00 N ATOM 326 CA LEU A 24 -4.680 4.989 -5.536 1.00 0.00 C ATOM 327 C LEU A 24 -3.881 6.250 -5.148 1.00 0.00 C ATOM 328 O LEU A 24 -2.659 6.258 -5.229 1.00 0.00 O ATOM 329 CB LEU A 24 -4.732 3.895 -4.440 1.00 0.00 C ATOM 330 CG LEU A 24 -5.050 4.353 -3.007 1.00 0.00 C ATOM 331 CD1 LEU A 24 -6.419 5.009 -2.861 1.00 0.00 C ATOM 332 CD2 LEU A 24 -5.022 3.160 -2.049 1.00 0.00 C ATOM 0 H LEU A 24 -3.088 4.205 -6.638 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.696 5.346 -5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.480 3.158 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.769 3.384 -4.426 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.284 5.090 -2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.572 5.305 -1.823 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.471 5.890 -3.501 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -7.195 4.301 -3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.249 3.500 -1.038 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.765 2.426 -2.360 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.032 2.704 -2.065 1.00 0.00 H new ATOM 343 N VAL A 25 -4.543 7.324 -4.719 1.00 0.00 N ATOM 344 CA VAL A 25 -3.867 8.516 -4.182 1.00 0.00 C ATOM 345 C VAL A 25 -4.030 8.511 -2.662 1.00 0.00 C ATOM 346 O VAL A 25 -5.148 8.402 -2.156 1.00 0.00 O ATOM 347 CB VAL A 25 -4.415 9.811 -4.815 1.00 0.00 C ATOM 348 CG1 VAL A 25 -3.706 11.048 -4.248 1.00 0.00 C ATOM 349 CG2 VAL A 25 -4.180 9.804 -6.331 1.00 0.00 C ATOM 0 H VAL A 25 -5.560 7.397 -4.732 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.807 8.485 -4.434 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.480 9.853 -4.587 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.113 11.946 -4.713 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.862 11.095 -3.170 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.638 10.983 -4.458 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.572 10.724 -6.764 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -3.111 9.734 -6.533 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.690 8.949 -6.774 1.00 0.00 H new ATOM 359 N LEU A 26 -2.918 8.657 -1.937 1.00 0.00 N ATOM 360 CA LEU A 26 -2.898 8.841 -0.480 1.00 0.00 C ATOM 361 C LEU A 26 -2.455 10.267 -0.129 1.00 0.00 C ATOM 362 O LEU A 26 -1.892 11.000 -0.945 1.00 0.00 O ATOM 363 CB LEU A 26 -1.970 7.805 0.206 1.00 0.00 C ATOM 364 CG LEU A 26 -2.588 6.495 0.727 1.00 0.00 C ATOM 365 CD1 LEU A 26 -3.632 6.756 1.803 1.00 0.00 C ATOM 366 CD2 LEU A 26 -3.254 5.664 -0.356 1.00 0.00 C ATOM 0 H LEU A 26 -1.987 8.651 -2.353 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.910 8.683 -0.108 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.186 7.542 -0.504 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.486 8.300 1.047 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.742 5.939 1.130 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.046 5.808 2.146 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -3.168 7.274 2.642 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.431 7.373 1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.667 4.756 0.084 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.056 6.241 -0.816 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.518 5.397 -1.114 1.00 0.00 H new ATOM 377 N TYR A 27 -2.669 10.615 1.131 1.00 0.00 N ATOM 378 CA TYR A 27 -2.333 11.896 1.726 1.00 0.00 C ATOM 379 C TYR A 27 -1.703 11.606 3.100 1.00 0.00 C ATOM 380 O TYR A 27 -2.425 11.257 4.036 1.00 0.00 O ATOM 381 CB TYR A 27 -3.595 12.780 1.794 1.00 0.00 C ATOM 382 CG TYR A 27 -3.421 14.122 1.103 1.00 0.00 C ATOM 383 CD1 TYR A 27 -3.289 14.176 -0.301 1.00 0.00 C ATOM 384 CD2 TYR A 27 -3.410 15.310 1.859 1.00 0.00 C ATOM 385 CE1 TYR A 27 -3.150 15.419 -0.950 1.00 0.00 C ATOM 386 CE2 TYR A 27 -3.274 16.552 1.212 1.00 0.00 C ATOM 387 CZ TYR A 27 -3.142 16.610 -0.191 1.00 0.00 C ATOM 388 OH TYR A 27 -3.023 17.816 -0.805 1.00 0.00 O ATOM 0 H TYR A 27 -3.104 9.978 1.798 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.611 12.457 1.132 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -4.429 12.248 1.336 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -3.858 12.947 2.838 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -3.295 13.264 -0.879 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -3.506 15.268 2.934 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -3.050 15.461 -2.025 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -3.271 17.463 1.791 1.00 0.00 H new ATOM 0 HH TYR A 27 -3.037 18.528 -0.132 1.00 0.00 H new ATOM 397 N PRO A 28 -0.365 11.640 3.240 1.00 0.00 N ATOM 398 CA PRO A 28 0.294 11.435 4.524 1.00 0.00 C ATOM 399 C PRO A 28 0.258 12.759 5.308 1.00 0.00 C ATOM 400 O PRO A 28 1.255 13.468 5.400 1.00 0.00 O ATOM 401 CB PRO A 28 1.691 10.930 4.169 1.00 0.00 C ATOM 402 CG PRO A 28 2.007 11.659 2.865 1.00 0.00 C ATOM 403 CD PRO A 28 0.637 11.841 2.197 1.00 0.00 C ATOM 0 HA PRO A 28 -0.183 10.707 5.180 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.415 11.168 4.948 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.707 9.848 4.039 1.00 0.00 H new ATOM 0 HG2 PRO A 28 2.490 12.618 3.051 1.00 0.00 H new ATOM 0 HG3 PRO A 28 2.683 11.078 2.237 1.00 0.00 H new ATOM 0 HD2 PRO A 28 0.548 12.836 1.760 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.502 11.124 1.387 1.00 0.00 H new ATOM 408 N GLN A 29 -0.914 13.132 5.824 1.00 0.00 N ATOM 409 CA GLN A 29 -1.093 14.308 6.678 1.00 0.00 C ATOM 410 C GLN A 29 -1.616 13.908 8.064 1.00 0.00 C ATOM 411 O GLN A 29 -2.255 12.870 8.253 1.00 0.00 O ATOM 412 CB GLN A 29 -2.009 15.355 6.009 1.00 0.00 C ATOM 413 CG GLN A 29 -1.210 16.463 5.299 1.00 0.00 C ATOM 414 CD GLN A 29 -1.985 17.775 5.149 1.00 0.00 C ATOM 415 OE1 GLN A 29 -3.181 17.813 4.890 1.00 0.00 O ATOM 416 NE2 GLN A 29 -1.342 18.914 5.325 1.00 0.00 N ATOM 0 H GLN A 29 -1.779 12.618 5.658 1.00 0.00 H new ATOM 0 HA GLN A 29 -0.116 14.772 6.814 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -2.657 14.859 5.287 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -2.656 15.803 6.763 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -0.293 16.654 5.857 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -0.914 16.110 4.311 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -0.345 18.909 5.542 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -1.842 19.800 5.244 1.00 0.00 H new ATOM 423 N ILE A 30 -1.310 14.747 9.055 1.00 0.00 N ATOM 424 CA ILE A 30 -1.725 14.535 10.439 1.00 0.00 C ATOM 425 C ILE A 30 -3.111 15.164 10.638 1.00 0.00 C ATOM 426 O ILE A 30 -3.304 16.368 10.451 1.00 0.00 O ATOM 427 CB ILE A 30 -0.679 15.073 11.433 1.00 0.00 C ATOM 428 CG1 ILE A 30 0.748 14.540 11.147 1.00 0.00 C ATOM 429 CG2 ILE A 30 -1.069 14.715 12.880 1.00 0.00 C ATOM 430 CD1 ILE A 30 0.885 13.017 10.987 1.00 0.00 C ATOM 0 H ILE A 30 -0.764 15.597 8.917 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.796 13.467 10.643 1.00 0.00 H new ATOM 0 HB ILE A 30 -0.665 16.155 11.305 1.00 0.00 H new ATOM 0 HG12 ILE A 30 1.115 15.014 10.237 1.00 0.00 H new ATOM 0 HG13 ILE A 30 1.402 14.859 11.959 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.317 15.104 13.566 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.038 15.156 13.115 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.128 13.632 12.983 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.927 12.764 10.790 1.00 0.00 H new ATOM 0 HD12 ILE A 30 0.558 12.524 11.903 1.00 0.00 H new ATOM 0 HD13 ILE A 30 0.267 12.682 10.154 1.00 0.00 H new ATOM 441 N GLY A 31 -4.082 14.314 10.973 1.00 0.00 N ATOM 442 CA GLY A 31 -5.517 14.625 11.013 1.00 0.00 C ATOM 443 C GLY A 31 -6.380 13.549 10.337 1.00 0.00 C ATOM 444 O GLY A 31 -7.593 13.562 10.513 1.00 0.00 O ATOM 0 H GLY A 31 -3.885 13.348 11.236 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -5.831 14.736 12.051 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.690 15.583 10.523 1.00 0.00 H new ATOM 447 N ASP A 32 -5.775 12.617 9.597 1.00 0.00 N ATOM 448 CA ASP A 32 -6.457 11.600 8.799 1.00 0.00 C ATOM 449 C ASP A 32 -5.896 10.196 9.069 1.00 0.00 C ATOM 450 O ASP A 32 -4.741 9.994 9.452 1.00 0.00 O ATOM 451 CB ASP A 32 -6.442 11.912 7.283 1.00 0.00 C ATOM 452 CG ASP A 32 -5.302 12.812 6.769 1.00 0.00 C ATOM 453 OD1 ASP A 32 -5.202 13.996 7.165 1.00 0.00 O ATOM 454 OD2 ASP A 32 -4.552 12.345 5.885 1.00 0.00 O ATOM 0 H ASP A 32 -4.759 12.549 9.536 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.499 11.621 9.118 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -6.398 10.967 6.742 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.390 12.384 7.024 1.00 0.00 H new ATOM 458 N LYS A 33 -6.758 9.204 8.845 1.00 0.00 N ATOM 459 CA LYS A 33 -6.523 7.786 9.120 1.00 0.00 C ATOM 460 C LYS A 33 -7.097 6.949 7.992 1.00 0.00 C ATOM 461 O LYS A 33 -8.090 7.337 7.371 1.00 0.00 O ATOM 462 CB LYS A 33 -7.100 7.402 10.496 1.00 0.00 C ATOM 463 CG LYS A 33 -8.528 7.897 10.769 1.00 0.00 C ATOM 464 CD LYS A 33 -9.259 6.943 11.715 1.00 0.00 C ATOM 465 CE LYS A 33 -10.521 7.603 12.271 1.00 0.00 C ATOM 466 NZ LYS A 33 -11.542 6.593 12.662 1.00 0.00 N ATOM 0 H LYS A 33 -7.682 9.375 8.448 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.452 7.589 9.165 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.086 6.316 10.588 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.442 7.796 11.271 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -8.495 8.895 11.205 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.076 7.977 9.830 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.523 6.028 11.185 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -8.599 6.658 12.535 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -10.262 8.213 13.136 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.941 8.274 11.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.384 7.077 13.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.807 6.028 11.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.149 5.968 13.395 1.00 0.00 H new ATOM 476 N LEU A 34 -6.465 5.809 7.745 1.00 0.00 N ATOM 477 CA LEU A 34 -6.803 4.881 6.665 1.00 0.00 C ATOM 478 C LEU A 34 -6.598 3.444 7.172 1.00 0.00 C ATOM 479 O LEU A 34 -5.634 3.136 7.876 1.00 0.00 O ATOM 480 CB LEU A 34 -5.992 5.186 5.381 1.00 0.00 C ATOM 481 CG LEU A 34 -4.565 5.780 5.388 1.00 0.00 C ATOM 482 CD1 LEU A 34 -4.472 7.237 5.860 1.00 0.00 C ATOM 483 CD2 LEU A 34 -3.575 4.942 6.178 1.00 0.00 C ATOM 0 H LEU A 34 -5.676 5.491 8.308 1.00 0.00 H new ATOM 0 HA LEU A 34 -7.849 5.003 6.384 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.930 4.248 4.829 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.603 5.866 4.788 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.295 5.763 4.332 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.433 7.564 5.830 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.071 7.870 5.205 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -4.847 7.313 6.881 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.592 5.412 6.144 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.906 4.867 7.214 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.515 3.944 5.744 1.00 0.00 H new ATOM 494 N ASP A 35 -7.511 2.562 6.788 1.00 0.00 N ATOM 495 CA ASP A 35 -7.535 1.173 7.227 1.00 0.00 C ATOM 496 C ASP A 35 -7.704 0.240 6.028 1.00 0.00 C ATOM 497 O ASP A 35 -8.717 0.250 5.324 1.00 0.00 O ATOM 498 CB ASP A 35 -8.537 0.928 8.371 1.00 0.00 C ATOM 499 CG ASP A 35 -9.975 1.423 8.114 1.00 0.00 C ATOM 500 OD1 ASP A 35 -10.221 2.652 8.220 1.00 0.00 O ATOM 501 OD2 ASP A 35 -10.863 0.563 7.900 1.00 0.00 O ATOM 0 H ASP A 35 -8.271 2.797 6.150 1.00 0.00 H new ATOM 0 HA ASP A 35 -6.569 0.934 7.672 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -8.571 -0.142 8.577 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.160 1.414 9.271 1.00 0.00 H new ATOM 505 N ILE A 36 -6.632 -0.521 5.791 1.00 0.00 N ATOM 506 CA ILE A 36 -6.409 -1.407 4.649 1.00 0.00 C ATOM 507 C ILE A 36 -6.737 -2.838 5.059 1.00 0.00 C ATOM 508 O ILE A 36 -6.105 -3.382 5.962 1.00 0.00 O ATOM 509 CB ILE A 36 -4.971 -1.294 4.053 1.00 0.00 C ATOM 510 CG1 ILE A 36 -4.045 -0.273 4.764 1.00 0.00 C ATOM 511 CG2 ILE A 36 -5.094 -0.975 2.552 1.00 0.00 C ATOM 512 CD1 ILE A 36 -2.670 -0.078 4.118 1.00 0.00 C ATOM 0 H ILE A 36 -5.843 -0.534 6.438 1.00 0.00 H new ATOM 0 HA ILE A 36 -7.075 -1.093 3.845 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.482 -2.254 4.216 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.553 0.691 4.798 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.902 -0.594 5.796 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.099 -0.892 2.115 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.643 -1.774 2.054 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -5.627 -0.033 2.423 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.100 0.654 4.690 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -2.134 -1.027 4.109 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.796 0.278 3.095 1.00 0.00 H new ATOM 523 N ILE A 37 -7.728 -3.433 4.399 1.00 0.00 N ATOM 524 CA ILE A 37 -8.197 -4.794 4.646 1.00 0.00 C ATOM 525 C ILE A 37 -8.018 -5.607 3.362 1.00 0.00 C ATOM 526 O ILE A 37 -8.255 -5.121 2.254 1.00 0.00 O ATOM 527 CB ILE A 37 -9.666 -4.773 5.141 1.00 0.00 C ATOM 528 CG1 ILE A 37 -9.798 -4.039 6.500 1.00 0.00 C ATOM 529 CG2 ILE A 37 -10.272 -6.184 5.249 1.00 0.00 C ATOM 530 CD1 ILE A 37 -10.497 -2.686 6.357 1.00 0.00 C ATOM 0 H ILE A 37 -8.243 -2.966 3.653 1.00 0.00 H new ATOM 0 HA ILE A 37 -7.613 -5.268 5.435 1.00 0.00 H new ATOM 0 HB ILE A 37 -10.230 -4.224 4.387 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -10.357 -4.664 7.196 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.807 -3.891 6.930 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -11.301 -6.112 5.600 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.255 -6.663 4.270 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -9.689 -6.777 5.954 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -10.567 -2.208 7.334 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.924 -2.050 5.682 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -11.498 -2.835 5.953 1.00 0.00 H new ATOM 541 N CYS A 38 -7.612 -6.860 3.524 1.00 0.00 N ATOM 542 CA CYS A 38 -7.401 -7.824 2.454 1.00 0.00 C ATOM 543 C CYS A 38 -7.838 -9.223 2.954 1.00 0.00 C ATOM 544 O CYS A 38 -7.368 -9.672 4.007 1.00 0.00 O ATOM 545 CB CYS A 38 -5.924 -7.777 2.056 1.00 0.00 C ATOM 546 SG CYS A 38 -5.370 -9.103 0.948 1.00 0.00 S ATOM 0 H CYS A 38 -7.412 -7.248 4.446 1.00 0.00 H new ATOM 0 HA CYS A 38 -7.996 -7.591 1.571 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -5.726 -6.819 1.575 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -5.320 -7.809 2.963 1.00 0.00 H new ATOM 550 N PRO A 39 -8.761 -9.904 2.246 1.00 0.00 N ATOM 551 CA PRO A 39 -9.229 -11.245 2.581 1.00 0.00 C ATOM 552 C PRO A 39 -8.135 -12.294 2.311 1.00 0.00 C ATOM 553 O PRO A 39 -7.005 -11.976 1.928 1.00 0.00 O ATOM 554 CB PRO A 39 -10.485 -11.445 1.717 1.00 0.00 C ATOM 555 CG PRO A 39 -10.216 -10.613 0.468 1.00 0.00 C ATOM 556 CD PRO A 39 -9.375 -9.462 1.008 1.00 0.00 C ATOM 0 HA PRO A 39 -9.464 -11.363 3.639 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.636 -12.496 1.471 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -11.383 -11.107 2.235 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -9.682 -11.184 -0.292 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -11.140 -10.260 0.010 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -8.612 -9.174 0.285 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -9.997 -8.584 1.182 1.00 0.00 H new ATOM 561 N LYS A 40 -8.497 -13.566 2.475 1.00 0.00 N ATOM 562 CA LYS A 40 -7.633 -14.708 2.190 1.00 0.00 C ATOM 563 C LYS A 40 -8.171 -15.437 0.949 1.00 0.00 C ATOM 564 O LYS A 40 -9.248 -16.032 0.989 1.00 0.00 O ATOM 565 CB LYS A 40 -7.521 -15.571 3.461 1.00 0.00 C ATOM 566 CG LYS A 40 -6.179 -16.310 3.569 1.00 0.00 C ATOM 567 CD LYS A 40 -6.070 -17.544 2.661 1.00 0.00 C ATOM 568 CE LYS A 40 -4.663 -18.158 2.676 1.00 0.00 C ATOM 569 NZ LYS A 40 -3.831 -17.681 1.534 1.00 0.00 N ATOM 0 H LYS A 40 -9.419 -13.836 2.817 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.614 -14.412 1.941 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.651 -14.936 4.337 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -8.332 -16.299 3.472 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.374 -15.618 3.322 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -6.028 -16.618 4.603 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -6.794 -18.293 2.982 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -6.331 -17.265 1.640 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.168 -17.907 3.614 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -4.742 -19.244 2.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -2.849 -17.996 1.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -4.205 -18.071 0.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -3.859 -16.642 1.494 1.00 0.00 H new ATOM 579 N VAL A 41 -7.406 -15.358 -0.144 1.00 0.00 N ATOM 580 CA VAL A 41 -7.553 -16.151 -1.379 1.00 0.00 C ATOM 581 C VAL A 41 -7.854 -17.623 -1.049 1.00 0.00 C ATOM 582 O VAL A 41 -6.990 -18.339 -0.545 1.00 0.00 O ATOM 583 CB VAL A 41 -6.326 -15.985 -2.309 1.00 0.00 C ATOM 584 CG1 VAL A 41 -4.978 -15.932 -1.586 1.00 0.00 C ATOM 585 CG2 VAL A 41 -6.223 -17.085 -3.368 1.00 0.00 C ATOM 0 H VAL A 41 -6.624 -14.705 -0.199 1.00 0.00 H new ATOM 0 HA VAL A 41 -8.409 -15.767 -1.934 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.516 -15.018 -2.775 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.178 -15.815 -2.317 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.967 -15.087 -0.897 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.828 -16.856 -1.029 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.343 -16.912 -3.988 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.137 -18.055 -2.878 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -7.115 -17.072 -3.994 1.00 0.00 H new ATOM 595 N ASP A 42 -9.089 -18.044 -1.331 1.00 0.00 N ATOM 596 CA ASP A 42 -9.653 -19.403 -1.184 1.00 0.00 C ATOM 597 C ASP A 42 -11.185 -19.365 -1.355 1.00 0.00 C ATOM 598 O ASP A 42 -11.729 -19.973 -2.279 1.00 0.00 O ATOM 599 CB ASP A 42 -9.328 -20.040 0.188 1.00 0.00 C ATOM 600 CG ASP A 42 -8.078 -20.948 0.206 1.00 0.00 C ATOM 601 OD1 ASP A 42 -7.761 -21.594 -0.825 1.00 0.00 O ATOM 602 OD2 ASP A 42 -7.463 -21.088 1.291 1.00 0.00 O ATOM 0 H ASP A 42 -9.784 -17.395 -1.699 1.00 0.00 H new ATOM 0 HA ASP A 42 -9.192 -20.013 -1.960 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -9.190 -19.243 0.918 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -10.188 -20.625 0.513 1.00 0.00 H new ATOM 606 N SER A 43 -11.876 -18.616 -0.485 1.00 0.00 N ATOM 607 CA SER A 43 -13.342 -18.441 -0.508 1.00 0.00 C ATOM 608 C SER A 43 -13.767 -17.317 -1.476 1.00 0.00 C ATOM 609 O SER A 43 -14.748 -17.456 -2.214 1.00 0.00 O ATOM 610 CB SER A 43 -13.825 -18.136 0.918 1.00 0.00 C ATOM 611 OG SER A 43 -15.204 -17.805 0.946 1.00 0.00 O ATOM 0 H SER A 43 -11.425 -18.102 0.272 1.00 0.00 H new ATOM 0 HA SER A 43 -13.801 -19.362 -0.868 1.00 0.00 H new ATOM 0 HB2 SER A 43 -13.646 -19.002 1.556 1.00 0.00 H new ATOM 0 HB3 SER A 43 -13.244 -17.311 1.330 1.00 0.00 H new ATOM 0 HG SER A 43 -15.477 -17.619 1.869 1.00 0.00 H new ATOM 616 N LYS A 44 -12.999 -16.215 -1.507 1.00 0.00 N ATOM 617 CA LYS A 44 -13.258 -15.030 -2.354 1.00 0.00 C ATOM 618 C LYS A 44 -12.818 -15.209 -3.817 1.00 0.00 C ATOM 619 O LYS A 44 -13.391 -14.586 -4.708 1.00 0.00 O ATOM 620 CB LYS A 44 -12.563 -13.794 -1.748 1.00 0.00 C ATOM 621 CG LYS A 44 -13.027 -13.443 -0.324 1.00 0.00 C ATOM 622 CD LYS A 44 -14.524 -13.094 -0.226 1.00 0.00 C ATOM 623 CE LYS A 44 -14.748 -11.660 0.264 1.00 0.00 C ATOM 624 NZ LYS A 44 -14.736 -11.551 1.750 1.00 0.00 N ATOM 0 H LYS A 44 -12.162 -16.117 -0.933 1.00 0.00 H new ATOM 0 HA LYS A 44 -14.339 -14.893 -2.371 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.487 -13.966 -1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.741 -12.937 -2.397 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.816 -14.285 0.335 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.442 -12.599 0.041 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.990 -13.220 -1.203 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.015 -13.790 0.454 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.974 -11.014 -0.150 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.703 -11.296 -0.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.892 -10.561 2.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.492 -12.145 2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -13.816 -11.871 2.114 1.00 0.00 H new ATOM 634 N THR A 45 -11.806 -16.050 -4.052 1.00 0.00 N ATOM 635 CA THR A 45 -11.265 -16.408 -5.385 1.00 0.00 C ATOM 636 C THR A 45 -10.885 -15.176 -6.238 1.00 0.00 C ATOM 637 O THR A 45 -11.064 -15.154 -7.455 1.00 0.00 O ATOM 638 CB THR A 45 -12.227 -17.391 -6.099 1.00 0.00 C ATOM 639 OG1 THR A 45 -12.701 -18.362 -5.179 1.00 0.00 O ATOM 640 CG2 THR A 45 -11.570 -18.202 -7.220 1.00 0.00 C ATOM 0 H THR A 45 -11.315 -16.524 -3.294 1.00 0.00 H new ATOM 0 HA THR A 45 -10.317 -16.926 -5.240 1.00 0.00 H new ATOM 0 HB THR A 45 -13.011 -16.756 -6.512 1.00 0.00 H new ATOM 0 HG1 THR A 45 -13.309 -18.978 -5.638 1.00 0.00 H new ATOM 0 HG21 THR A 45 -12.308 -18.866 -7.670 1.00 0.00 H new ATOM 0 HG22 THR A 45 -11.181 -17.524 -7.980 1.00 0.00 H new ATOM 0 HG23 THR A 45 -10.752 -18.794 -6.809 1.00 0.00 H new ATOM 705 N GLU A 50 -1.200 -17.297 -4.821 1.00 0.00 N ATOM 706 CA GLU A 50 -0.663 -17.745 -3.527 1.00 0.00 C ATOM 707 C GLU A 50 -0.970 -16.686 -2.449 1.00 0.00 C ATOM 708 O GLU A 50 -1.835 -16.894 -1.595 1.00 0.00 O ATOM 709 CB GLU A 50 0.864 -18.008 -3.616 1.00 0.00 C ATOM 710 CG GLU A 50 1.203 -19.457 -3.250 1.00 0.00 C ATOM 711 CD GLU A 50 2.718 -19.717 -3.292 1.00 0.00 C ATOM 712 OE1 GLU A 50 3.497 -18.821 -2.893 1.00 0.00 O ATOM 713 OE2 GLU A 50 3.134 -20.827 -3.710 1.00 0.00 O ATOM 0 HA GLU A 50 -1.143 -18.685 -3.255 1.00 0.00 H new ATOM 0 HB2 GLU A 50 1.213 -17.795 -4.626 1.00 0.00 H new ATOM 0 HB3 GLU A 50 1.392 -17.329 -2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 50 0.824 -19.678 -2.252 1.00 0.00 H new ATOM 0 HG3 GLU A 50 0.699 -20.134 -3.940 1.00 0.00 H new ATOM 718 N TYR A 51 -0.288 -15.536 -2.537 1.00 0.00 N ATOM 719 CA TYR A 51 -0.144 -14.513 -1.490 1.00 0.00 C ATOM 720 C TYR A 51 -0.059 -13.112 -2.133 1.00 0.00 C ATOM 721 O TYR A 51 0.225 -12.999 -3.332 1.00 0.00 O ATOM 722 CB TYR A 51 1.135 -14.790 -0.669 1.00 0.00 C ATOM 723 CG TYR A 51 1.321 -16.214 -0.139 1.00 0.00 C ATOM 724 CD1 TYR A 51 0.267 -16.902 0.494 1.00 0.00 C ATOM 725 CD2 TYR A 51 2.559 -16.869 -0.303 1.00 0.00 C ATOM 726 CE1 TYR A 51 0.426 -18.232 0.928 1.00 0.00 C ATOM 727 CE2 TYR A 51 2.730 -18.199 0.140 1.00 0.00 C ATOM 728 CZ TYR A 51 1.659 -18.888 0.746 1.00 0.00 C ATOM 729 OH TYR A 51 1.793 -20.184 1.140 1.00 0.00 O ATOM 0 H TYR A 51 0.207 -15.279 -3.391 1.00 0.00 H new ATOM 0 HA TYR A 51 -1.011 -14.549 -0.831 1.00 0.00 H new ATOM 0 HB2 TYR A 51 1.997 -14.543 -1.289 1.00 0.00 H new ATOM 0 HB3 TYR A 51 1.148 -14.107 0.180 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -0.677 -16.402 0.649 1.00 0.00 H new ATOM 0 HD2 TYR A 51 3.382 -16.350 -0.771 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -0.397 -18.749 1.400 1.00 0.00 H new ATOM 0 HE2 TYR A 51 3.684 -18.690 0.014 1.00 0.00 H new ATOM 0 HH TYR A 51 2.702 -20.493 0.945 1.00 0.00 H new ATOM 738 N TYR A 52 -0.249 -12.040 -1.353 1.00 0.00 N ATOM 739 CA TYR A 52 -0.218 -10.652 -1.847 1.00 0.00 C ATOM 740 C TYR A 52 0.577 -9.729 -0.920 1.00 0.00 C ATOM 741 O TYR A 52 0.228 -9.525 0.244 1.00 0.00 O ATOM 742 CB TYR A 52 -1.646 -10.114 -2.030 1.00 0.00 C ATOM 743 CG TYR A 52 -2.308 -10.469 -3.351 1.00 0.00 C ATOM 744 CD1 TYR A 52 -1.761 -9.993 -4.562 1.00 0.00 C ATOM 745 CD2 TYR A 52 -3.509 -11.209 -3.368 1.00 0.00 C ATOM 746 CE1 TYR A 52 -2.412 -10.252 -5.783 1.00 0.00 C ATOM 747 CE2 TYR A 52 -4.169 -11.459 -4.591 1.00 0.00 C ATOM 748 CZ TYR A 52 -3.622 -10.974 -5.800 1.00 0.00 C ATOM 749 OH TYR A 52 -4.264 -11.169 -6.983 1.00 0.00 O ATOM 0 H TYR A 52 -0.430 -12.110 -0.352 1.00 0.00 H new ATOM 0 HA TYR A 52 0.288 -10.665 -2.812 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -2.266 -10.493 -1.218 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -1.623 -9.028 -1.934 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -0.840 -9.428 -4.552 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.924 -11.585 -2.444 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -1.983 -9.897 -6.708 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -5.091 -12.021 -4.602 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.083 -11.685 -6.830 1.00 0.00 H new ATOM 758 N LYS A 53 1.623 -9.105 -1.475 1.00 0.00 N ATOM 759 CA LYS A 53 2.426 -8.078 -0.797 1.00 0.00 C ATOM 760 C LYS A 53 2.611 -6.845 -1.673 1.00 0.00 C ATOM 761 O LYS A 53 2.707 -6.941 -2.897 1.00 0.00 O ATOM 762 CB LYS A 53 3.782 -8.643 -0.326 1.00 0.00 C ATOM 763 CG LYS A 53 3.608 -9.560 0.890 1.00 0.00 C ATOM 764 CD LYS A 53 3.676 -11.060 0.584 1.00 0.00 C ATOM 765 CE LYS A 53 5.063 -11.615 0.938 1.00 0.00 C ATOM 766 NZ LYS A 53 4.965 -12.713 1.934 1.00 0.00 N ATOM 0 H LYS A 53 1.941 -9.302 -2.424 1.00 0.00 H new ATOM 0 HA LYS A 53 1.875 -7.767 0.091 1.00 0.00 H new ATOM 0 HB2 LYS A 53 4.250 -9.198 -1.139 1.00 0.00 H new ATOM 0 HB3 LYS A 53 4.453 -7.822 -0.073 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.379 -9.318 1.622 1.00 0.00 H new ATOM 0 HG3 LYS A 53 2.647 -9.343 1.356 1.00 0.00 H new ATOM 0 HD2 LYS A 53 2.910 -11.589 1.151 1.00 0.00 H new ATOM 0 HD3 LYS A 53 3.467 -11.232 -0.472 1.00 0.00 H new ATOM 0 HE2 LYS A 53 5.552 -11.982 0.035 1.00 0.00 H new ATOM 0 HE3 LYS A 53 5.687 -10.815 1.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 5.919 -13.045 2.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 4.489 -12.364 2.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 4.418 -13.500 1.531 1.00 0.00 H new ATOM 776 N VAL A 54 2.675 -5.701 -1.003 1.00 0.00 N ATOM 777 CA VAL A 54 2.784 -4.366 -1.599 1.00 0.00 C ATOM 778 C VAL A 54 4.064 -3.714 -1.075 1.00 0.00 C ATOM 779 O VAL A 54 4.374 -3.820 0.116 1.00 0.00 O ATOM 780 CB VAL A 54 1.558 -3.507 -1.241 1.00 0.00 C ATOM 781 CG1 VAL A 54 1.663 -2.106 -1.831 1.00 0.00 C ATOM 782 CG2 VAL A 54 0.234 -4.107 -1.724 1.00 0.00 C ATOM 0 H VAL A 54 2.652 -5.672 0.016 1.00 0.00 H new ATOM 0 HA VAL A 54 2.821 -4.448 -2.685 1.00 0.00 H new ATOM 0 HB VAL A 54 1.557 -3.472 -0.152 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.780 -1.529 -1.557 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.554 -1.613 -1.442 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.731 -2.173 -2.917 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.588 -3.451 -1.438 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.256 -4.210 -2.809 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.091 -5.087 -1.269 1.00 0.00 H new ATOM 792 N TYR A 55 4.793 -3.033 -1.964 1.00 0.00 N ATOM 793 CA TYR A 55 6.180 -2.623 -1.751 1.00 0.00 C ATOM 794 C TYR A 55 6.357 -1.112 -1.953 1.00 0.00 C ATOM 795 O TYR A 55 5.684 -0.500 -2.782 1.00 0.00 O ATOM 796 CB TYR A 55 7.068 -3.407 -2.726 1.00 0.00 C ATOM 797 CG TYR A 55 6.805 -4.903 -2.836 1.00 0.00 C ATOM 798 CD1 TYR A 55 7.013 -5.753 -1.731 1.00 0.00 C ATOM 799 CD2 TYR A 55 6.364 -5.442 -4.061 1.00 0.00 C ATOM 800 CE1 TYR A 55 6.795 -7.137 -1.857 1.00 0.00 C ATOM 801 CE2 TYR A 55 6.153 -6.830 -4.191 1.00 0.00 C ATOM 802 CZ TYR A 55 6.370 -7.682 -3.088 1.00 0.00 C ATOM 803 OH TYR A 55 6.181 -9.023 -3.201 1.00 0.00 O ATOM 0 H TYR A 55 4.425 -2.746 -2.871 1.00 0.00 H new ATOM 0 HA TYR A 55 6.467 -2.841 -0.722 1.00 0.00 H new ATOM 0 HB2 TYR A 55 6.956 -2.968 -3.717 1.00 0.00 H new ATOM 0 HB3 TYR A 55 8.107 -3.265 -2.430 1.00 0.00 H new ATOM 0 HD1 TYR A 55 7.340 -5.342 -0.787 1.00 0.00 H new ATOM 0 HD2 TYR A 55 6.187 -4.790 -4.903 1.00 0.00 H new ATOM 0 HE1 TYR A 55 6.953 -7.786 -1.008 1.00 0.00 H new ATOM 0 HE2 TYR A 55 5.825 -7.241 -5.135 1.00 0.00 H new ATOM 0 HH TYR A 55 5.888 -9.236 -4.111 1.00 0.00 H new ATOM 812 N MET A 56 7.285 -0.487 -1.227 1.00 0.00 N ATOM 813 CA MET A 56 7.496 0.975 -1.258 1.00 0.00 C ATOM 814 C MET A 56 8.735 1.322 -2.096 1.00 0.00 C ATOM 815 O MET A 56 9.817 0.784 -1.852 1.00 0.00 O ATOM 816 CB MET A 56 7.607 1.554 0.159 1.00 0.00 C ATOM 817 CG MET A 56 6.460 1.099 1.064 1.00 0.00 C ATOM 818 SD MET A 56 6.450 1.885 2.695 1.00 0.00 S ATOM 819 CE MET A 56 5.593 3.433 2.280 1.00 0.00 C ATOM 0 H MET A 56 7.919 -0.977 -0.595 1.00 0.00 H new ATOM 0 HA MET A 56 6.626 1.432 -1.729 1.00 0.00 H new ATOM 0 HB2 MET A 56 8.557 1.251 0.600 1.00 0.00 H new ATOM 0 HB3 MET A 56 7.614 2.643 0.105 1.00 0.00 H new ATOM 0 HG2 MET A 56 5.513 1.308 0.566 1.00 0.00 H new ATOM 0 HG3 MET A 56 6.520 0.018 1.193 1.00 0.00 H new ATOM 0 HE1 MET A 56 5.576 4.085 3.153 1.00 0.00 H new ATOM 0 HE2 MET A 56 6.117 3.932 1.465 1.00 0.00 H new ATOM 0 HE3 MET A 56 4.571 3.212 1.972 1.00 0.00 H new ATOM 827 N VAL A 57 8.556 2.177 -3.108 1.00 0.00 N ATOM 828 CA VAL A 57 9.529 2.460 -4.185 1.00 0.00 C ATOM 829 C VAL A 57 9.069 3.642 -5.038 1.00 0.00 C ATOM 830 O VAL A 57 7.876 3.832 -5.247 1.00 0.00 O ATOM 831 CB VAL A 57 9.664 1.278 -5.174 1.00 0.00 C ATOM 832 CG1 VAL A 57 10.978 0.525 -5.006 1.00 0.00 C ATOM 833 CG2 VAL A 57 8.521 0.267 -5.151 1.00 0.00 C ATOM 0 H VAL A 57 7.696 2.716 -3.210 1.00 0.00 H new ATOM 0 HA VAL A 57 10.473 2.657 -3.677 1.00 0.00 H new ATOM 0 HB VAL A 57 9.631 1.776 -6.143 1.00 0.00 H new ATOM 0 HG11 VAL A 57 11.022 -0.294 -5.724 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.812 1.205 -5.180 1.00 0.00 H new ATOM 0 HG13 VAL A 57 11.041 0.125 -3.994 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.716 -0.519 -5.881 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.444 -0.172 -4.157 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.586 0.769 -5.399 1.00 0.00 H new ATOM 843 N ASP A 58 10.027 4.403 -5.568 1.00 0.00 N ATOM 844 CA ASP A 58 9.836 5.681 -6.282 1.00 0.00 C ATOM 845 C ASP A 58 8.976 5.574 -7.564 1.00 0.00 C ATOM 846 O ASP A 58 8.975 4.539 -8.225 1.00 0.00 O ATOM 847 CB ASP A 58 11.213 6.257 -6.662 1.00 0.00 C ATOM 848 CG ASP A 58 12.251 6.133 -5.532 1.00 0.00 C ATOM 849 OD1 ASP A 58 12.888 5.056 -5.426 1.00 0.00 O ATOM 850 OD2 ASP A 58 12.416 7.096 -4.746 1.00 0.00 O ATOM 0 H ASP A 58 11.010 4.137 -5.512 1.00 0.00 H new ATOM 0 HA ASP A 58 9.294 6.331 -5.596 1.00 0.00 H new ATOM 0 HB2 ASP A 58 11.585 5.741 -7.547 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.100 7.308 -6.930 1.00 0.00 H new ATOM 854 N LYS A 59 8.339 6.659 -8.024 1.00 0.00 N ATOM 855 CA LYS A 59 7.648 6.677 -9.334 1.00 0.00 C ATOM 856 C LYS A 59 8.556 6.247 -10.510 1.00 0.00 C ATOM 857 O LYS A 59 8.093 5.613 -11.453 1.00 0.00 O ATOM 858 CB LYS A 59 7.067 8.084 -9.548 1.00 0.00 C ATOM 859 CG LYS A 59 6.217 8.263 -10.820 1.00 0.00 C ATOM 860 CD LYS A 59 4.706 8.416 -10.565 1.00 0.00 C ATOM 861 CE LYS A 59 4.096 9.358 -11.608 1.00 0.00 C ATOM 862 NZ LYS A 59 4.195 10.782 -11.180 1.00 0.00 N ATOM 0 H LYS A 59 8.284 7.540 -7.513 1.00 0.00 H new ATOM 0 HA LYS A 59 6.848 5.937 -9.316 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.455 8.341 -8.684 1.00 0.00 H new ATOM 0 HB3 LYS A 59 7.890 8.798 -9.579 1.00 0.00 H new ATOM 0 HG2 LYS A 59 6.572 9.142 -11.358 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.377 7.404 -11.472 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.219 7.442 -10.613 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.535 8.809 -9.563 1.00 0.00 H new ATOM 0 HE2 LYS A 59 4.607 9.227 -12.562 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.050 9.097 -11.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.773 11.393 -11.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 3.686 10.911 -10.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 5.195 11.037 -11.051 1.00 0.00 H new ATOM 872 N ASP A 60 9.860 6.520 -10.440 1.00 0.00 N ATOM 873 CA ASP A 60 10.852 6.086 -11.439 1.00 0.00 C ATOM 874 C ASP A 60 10.983 4.548 -11.549 1.00 0.00 C ATOM 875 O ASP A 60 11.307 4.014 -12.610 1.00 0.00 O ATOM 876 CB ASP A 60 12.206 6.720 -11.092 1.00 0.00 C ATOM 877 CG ASP A 60 13.136 6.881 -12.311 1.00 0.00 C ATOM 878 OD1 ASP A 60 12.680 7.364 -13.374 1.00 0.00 O ATOM 879 OD2 ASP A 60 14.345 6.573 -12.191 1.00 0.00 O ATOM 0 H ASP A 60 10.269 7.058 -9.676 1.00 0.00 H new ATOM 0 HA ASP A 60 10.507 6.422 -12.417 1.00 0.00 H new ATOM 0 HB2 ASP A 60 12.036 7.698 -10.642 1.00 0.00 H new ATOM 0 HB3 ASP A 60 12.705 6.106 -10.342 1.00 0.00 H new ATOM 883 N GLN A 61 10.706 3.826 -10.456 1.00 0.00 N ATOM 884 CA GLN A 61 10.587 2.366 -10.397 1.00 0.00 C ATOM 885 C GLN A 61 9.250 1.901 -11.026 1.00 0.00 C ATOM 886 O GLN A 61 9.232 0.957 -11.820 1.00 0.00 O ATOM 887 CB GLN A 61 10.786 1.953 -8.916 1.00 0.00 C ATOM 888 CG GLN A 61 12.257 1.981 -8.465 1.00 0.00 C ATOM 889 CD GLN A 61 13.108 0.885 -9.106 1.00 0.00 C ATOM 890 OE1 GLN A 61 13.189 -0.237 -8.627 1.00 0.00 O ATOM 891 NE2 GLN A 61 13.808 1.158 -10.187 1.00 0.00 N ATOM 0 H GLN A 61 10.552 4.265 -9.548 1.00 0.00 H new ATOM 0 HA GLN A 61 11.351 1.864 -10.992 1.00 0.00 H new ATOM 0 HB2 GLN A 61 10.206 2.621 -8.279 1.00 0.00 H new ATOM 0 HB3 GLN A 61 10.388 0.949 -8.770 1.00 0.00 H new ATOM 0 HG2 GLN A 61 12.686 2.953 -8.708 1.00 0.00 H new ATOM 0 HG3 GLN A 61 12.299 1.877 -7.381 1.00 0.00 H new ATOM 0 HE21 GLN A 61 13.758 2.087 -10.606 1.00 0.00 H new ATOM 0 HE22 GLN A 61 14.400 0.441 -10.606 1.00 0.00 H new ATOM 898 N ALA A 62 8.143 2.622 -10.798 1.00 0.00 N ATOM 899 CA ALA A 62 6.848 2.339 -11.442 1.00 0.00 C ATOM 900 C ALA A 62 6.875 2.538 -12.965 1.00 0.00 C ATOM 901 O ALA A 62 6.165 1.841 -13.690 1.00 0.00 O ATOM 902 CB ALA A 62 5.747 3.247 -10.875 1.00 0.00 C ATOM 0 H ALA A 62 8.118 3.419 -10.162 1.00 0.00 H new ATOM 0 HA ALA A 62 6.642 1.290 -11.229 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.800 3.020 -11.365 1.00 0.00 H new ATOM 0 HB2 ALA A 62 5.651 3.076 -9.803 1.00 0.00 H new ATOM 0 HB3 ALA A 62 6.008 4.290 -11.054 1.00 0.00 H new ATOM 908 N ASP A 63 7.692 3.477 -13.447 1.00 0.00 N ATOM 909 CA ASP A 63 7.863 3.817 -14.870 1.00 0.00 C ATOM 910 C ASP A 63 8.313 2.610 -15.726 1.00 0.00 C ATOM 911 O ASP A 63 7.936 2.476 -16.891 1.00 0.00 O ATOM 912 CB ASP A 63 8.878 4.974 -14.964 1.00 0.00 C ATOM 913 CG ASP A 63 8.708 5.887 -16.193 1.00 0.00 C ATOM 914 OD1 ASP A 63 7.799 5.673 -17.030 1.00 0.00 O ATOM 915 OD2 ASP A 63 9.483 6.865 -16.312 1.00 0.00 O ATOM 0 H ASP A 63 8.278 4.047 -12.836 1.00 0.00 H new ATOM 0 HA ASP A 63 6.898 4.119 -15.277 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.798 5.583 -14.063 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.884 4.555 -14.977 1.00 0.00 H new ATOM 919 N ARG A 64 9.076 1.695 -15.113 1.00 0.00 N ATOM 920 CA ARG A 64 9.530 0.411 -15.683 1.00 0.00 C ATOM 921 C ARG A 64 8.706 -0.790 -15.188 1.00 0.00 C ATOM 922 O ARG A 64 8.923 -1.907 -15.651 1.00 0.00 O ATOM 923 CB ARG A 64 11.029 0.234 -15.349 1.00 0.00 C ATOM 924 CG ARG A 64 11.935 1.222 -16.093 1.00 0.00 C ATOM 925 CD ARG A 64 12.148 0.796 -17.560 1.00 0.00 C ATOM 926 NE ARG A 64 13.506 0.263 -17.776 1.00 0.00 N ATOM 927 CZ ARG A 64 13.957 -0.349 -18.857 1.00 0.00 C ATOM 928 NH1 ARG A 64 13.188 -0.627 -19.877 1.00 0.00 N ATOM 929 NH2 ARG A 64 15.212 -0.700 -18.942 1.00 0.00 N ATOM 0 H ARG A 64 9.412 1.833 -14.160 1.00 0.00 H new ATOM 0 HA ARG A 64 9.382 0.441 -16.763 1.00 0.00 H new ATOM 0 HB2 ARG A 64 11.172 0.357 -14.276 1.00 0.00 H new ATOM 0 HB3 ARG A 64 11.332 -0.783 -15.596 1.00 0.00 H new ATOM 0 HG2 ARG A 64 11.492 2.218 -16.062 1.00 0.00 H new ATOM 0 HG3 ARG A 64 12.899 1.286 -15.588 1.00 0.00 H new ATOM 0 HD2 ARG A 64 11.412 0.039 -17.831 1.00 0.00 H new ATOM 0 HD3 ARG A 64 11.983 1.651 -18.216 1.00 0.00 H new ATOM 0 HE ARG A 64 14.168 0.379 -17.009 1.00 0.00 H new ATOM 0 HH11 ARG A 64 12.201 -0.370 -19.857 1.00 0.00 H new ATOM 0 HH12 ARG A 64 13.575 -1.101 -20.693 1.00 0.00 H new ATOM 0 HH21 ARG A 64 15.850 -0.502 -18.171 1.00 0.00 H new ATOM 0 HH22 ARG A 64 15.554 -1.172 -19.779 1.00 0.00 H new ATOM 940 N CYS A 65 7.763 -0.573 -14.267 1.00 0.00 N ATOM 941 CA CYS A 65 7.138 -1.609 -13.434 1.00 0.00 C ATOM 942 C CYS A 65 8.192 -2.544 -12.804 1.00 0.00 C ATOM 943 O CYS A 65 8.124 -3.768 -12.913 1.00 0.00 O ATOM 944 CB CYS A 65 6.035 -2.318 -14.233 1.00 0.00 C ATOM 945 SG CYS A 65 5.122 -3.638 -13.386 1.00 0.00 S ATOM 0 H CYS A 65 7.400 0.360 -14.073 1.00 0.00 H new ATOM 0 HA CYS A 65 6.645 -1.151 -12.576 1.00 0.00 H new ATOM 0 HB2 CYS A 65 5.317 -1.566 -14.560 1.00 0.00 H new ATOM 0 HB3 CYS A 65 6.486 -2.740 -15.131 1.00 0.00 H new ATOM 949 N THR A 66 9.207 -1.960 -12.165 1.00 0.00 N ATOM 950 CA THR A 66 10.244 -2.712 -11.452 1.00 0.00 C ATOM 951 C THR A 66 10.364 -2.201 -10.022 1.00 0.00 C ATOM 952 O THR A 66 10.252 -1.006 -9.783 1.00 0.00 O ATOM 953 CB THR A 66 11.601 -2.719 -12.175 1.00 0.00 C ATOM 954 OG1 THR A 66 12.209 -1.449 -12.199 1.00 0.00 O ATOM 955 CG2 THR A 66 11.494 -3.137 -13.645 1.00 0.00 C ATOM 0 H THR A 66 9.334 -0.949 -12.127 1.00 0.00 H new ATOM 0 HA THR A 66 9.930 -3.756 -11.430 1.00 0.00 H new ATOM 0 HB THR A 66 12.190 -3.436 -11.602 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.068 -1.506 -12.667 1.00 0.00 H new ATOM 0 HG21 THR A 66 12.484 -3.122 -14.100 1.00 0.00 H new ATOM 0 HG22 THR A 66 11.081 -4.144 -13.708 1.00 0.00 H new ATOM 0 HG23 THR A 66 10.841 -2.443 -14.174 1.00 0.00 H new ATOM 963 N ILE A 67 10.516 -3.091 -9.042 1.00 0.00 N ATOM 964 CA ILE A 67 10.658 -2.754 -7.608 1.00 0.00 C ATOM 965 C ILE A 67 12.148 -2.895 -7.254 1.00 0.00 C ATOM 966 O ILE A 67 12.844 -3.736 -7.825 1.00 0.00 O ATOM 967 CB ILE A 67 9.782 -3.686 -6.730 1.00 0.00 C ATOM 968 CG1 ILE A 67 8.390 -3.963 -7.348 1.00 0.00 C ATOM 969 CG2 ILE A 67 9.586 -3.205 -5.293 1.00 0.00 C ATOM 970 CD1 ILE A 67 7.559 -2.749 -7.774 1.00 0.00 C ATOM 0 H ILE A 67 10.546 -4.095 -9.218 1.00 0.00 H new ATOM 0 HA ILE A 67 10.317 -1.736 -7.417 1.00 0.00 H new ATOM 0 HB ILE A 67 10.362 -4.609 -6.699 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.529 -4.600 -8.221 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.807 -4.535 -6.626 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.962 -3.917 -4.753 1.00 0.00 H new ATOM 0 HG22 ILE A 67 10.555 -3.126 -4.800 1.00 0.00 H new ATOM 0 HG23 ILE A 67 9.101 -2.229 -5.299 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.609 -3.086 -8.190 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.371 -2.114 -6.908 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.104 -2.181 -8.528 1.00 0.00 H new ATOM 981 N LYS A 68 12.641 -2.114 -6.296 1.00 0.00 N ATOM 982 CA LYS A 68 14.020 -2.198 -5.824 1.00 0.00 C ATOM 983 C LYS A 68 14.073 -3.207 -4.680 1.00 0.00 C ATOM 984 O LYS A 68 13.136 -3.252 -3.887 1.00 0.00 O ATOM 985 CB LYS A 68 14.492 -0.797 -5.383 1.00 0.00 C ATOM 986 CG LYS A 68 16.005 -0.627 -5.575 1.00 0.00 C ATOM 987 CD LYS A 68 16.363 -0.464 -7.062 1.00 0.00 C ATOM 988 CE LYS A 68 17.850 -0.731 -7.292 1.00 0.00 C ATOM 989 NZ LYS A 68 18.194 -0.671 -8.741 1.00 0.00 N ATOM 0 H LYS A 68 12.090 -1.399 -5.822 1.00 0.00 H new ATOM 0 HA LYS A 68 14.690 -2.536 -6.614 1.00 0.00 H new ATOM 0 HB2 LYS A 68 13.964 -0.036 -5.958 1.00 0.00 H new ATOM 0 HB3 LYS A 68 14.237 -0.639 -4.335 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.349 0.244 -5.018 1.00 0.00 H new ATOM 0 HG3 LYS A 68 16.526 -1.493 -5.166 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.768 -1.152 -7.662 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.114 0.544 -7.393 1.00 0.00 H new ATOM 0 HE2 LYS A 68 18.442 0.003 -6.745 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.111 -1.712 -6.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 19.210 -0.856 -8.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.646 -1.388 -9.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 17.967 0.273 -9.113 1.00 0.00 H new ATOM 999 N LYS A 69 15.159 -3.974 -4.511 1.00 0.00 N ATOM 1000 CA LYS A 69 15.336 -4.851 -3.325 1.00 0.00 C ATOM 1001 C LYS A 69 15.356 -4.074 -1.993 1.00 0.00 C ATOM 1002 O LYS A 69 15.065 -4.637 -0.943 1.00 0.00 O ATOM 1003 CB LYS A 69 16.584 -5.734 -3.492 1.00 0.00 C ATOM 1004 CG LYS A 69 17.887 -4.922 -3.549 1.00 0.00 C ATOM 1005 CD LYS A 69 19.090 -5.734 -3.056 1.00 0.00 C ATOM 1006 CE LYS A 69 20.253 -4.773 -2.791 1.00 0.00 C ATOM 1007 NZ LYS A 69 21.456 -5.491 -2.292 1.00 0.00 N ATOM 0 H LYS A 69 15.932 -4.011 -5.175 1.00 0.00 H new ATOM 0 HA LYS A 69 14.460 -5.497 -3.271 1.00 0.00 H new ATOM 0 HB2 LYS A 69 16.637 -6.440 -2.663 1.00 0.00 H new ATOM 0 HB3 LYS A 69 16.488 -6.322 -4.405 1.00 0.00 H new ATOM 0 HG2 LYS A 69 18.066 -4.594 -4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 69 17.782 -4.024 -2.941 1.00 0.00 H new ATOM 0 HD2 LYS A 69 18.833 -6.277 -2.146 1.00 0.00 H new ATOM 0 HD3 LYS A 69 19.375 -6.477 -3.801 1.00 0.00 H new ATOM 0 HE2 LYS A 69 20.502 -4.240 -3.709 1.00 0.00 H new ATOM 0 HE3 LYS A 69 19.947 -4.024 -2.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 22.223 -4.809 -2.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 21.225 -5.979 -1.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 21.763 -6.188 -3.000 1.00 0.00 H new ATOM 1017 N GLU A 70 15.656 -2.776 -2.061 1.00 0.00 N ATOM 1018 CA GLU A 70 15.594 -1.809 -0.958 1.00 0.00 C ATOM 1019 C GLU A 70 14.155 -1.379 -0.579 1.00 0.00 C ATOM 1020 O GLU A 70 13.975 -0.537 0.306 1.00 0.00 O ATOM 1021 CB GLU A 70 16.457 -0.580 -1.300 1.00 0.00 C ATOM 1022 CG GLU A 70 17.931 -0.960 -1.521 1.00 0.00 C ATOM 1023 CD GLU A 70 18.883 0.206 -1.179 1.00 0.00 C ATOM 1024 OE1 GLU A 70 19.021 0.550 0.019 1.00 0.00 O ATOM 1025 OE2 GLU A 70 19.522 0.770 -2.101 1.00 0.00 O ATOM 0 H GLU A 70 15.966 -2.346 -2.932 1.00 0.00 H new ATOM 0 HA GLU A 70 15.989 -2.314 -0.076 1.00 0.00 H new ATOM 0 HB2 GLU A 70 16.067 -0.100 -2.198 1.00 0.00 H new ATOM 0 HB3 GLU A 70 16.387 0.149 -0.493 1.00 0.00 H new ATOM 0 HG2 GLU A 70 18.179 -1.824 -0.905 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.078 -1.256 -2.560 1.00 0.00 H new ATOM 1030 N ASN A 71 13.125 -1.950 -1.220 1.00 0.00 N ATOM 1031 CA ASN A 71 11.739 -1.870 -0.755 1.00 0.00 C ATOM 1032 C ASN A 71 11.540 -2.445 0.662 1.00 0.00 C ATOM 1033 O ASN A 71 12.448 -3.018 1.268 1.00 0.00 O ATOM 1034 CB ASN A 71 10.797 -2.526 -1.789 1.00 0.00 C ATOM 1035 CG ASN A 71 10.674 -4.050 -1.690 1.00 0.00 C ATOM 1036 OD1 ASN A 71 10.030 -4.587 -0.806 1.00 0.00 O ATOM 1037 ND2 ASN A 71 11.238 -4.799 -2.606 1.00 0.00 N ATOM 0 H ASN A 71 13.235 -2.484 -2.082 1.00 0.00 H new ATOM 0 HA ASN A 71 11.481 -0.814 -0.671 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.804 -2.090 -1.679 1.00 0.00 H new ATOM 0 HB3 ASN A 71 11.148 -2.271 -2.789 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.134 -5.813 -2.571 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.781 -4.368 -3.354 1.00 0.00 H new ATOM 1043 N THR A 72 10.307 -2.347 1.155 1.00 0.00 N ATOM 1044 CA THR A 72 9.868 -2.984 2.401 1.00 0.00 C ATOM 1045 C THR A 72 8.503 -3.665 2.187 1.00 0.00 C ATOM 1046 O THR A 72 7.710 -3.149 1.387 1.00 0.00 O ATOM 1047 CB THR A 72 9.855 -1.930 3.525 1.00 0.00 C ATOM 1048 OG1 THR A 72 10.091 -2.541 4.773 1.00 0.00 O ATOM 1049 CG2 THR A 72 8.561 -1.117 3.618 1.00 0.00 C ATOM 0 H THR A 72 9.570 -1.814 0.694 1.00 0.00 H new ATOM 0 HA THR A 72 10.560 -3.770 2.702 1.00 0.00 H new ATOM 0 HB THR A 72 10.652 -1.232 3.267 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.082 -1.860 5.478 1.00 0.00 H new ATOM 0 HG21 THR A 72 8.640 -0.400 4.435 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.399 -0.583 2.682 1.00 0.00 H new ATOM 0 HG23 THR A 72 7.722 -1.788 3.803 1.00 0.00 H new ATOM 1057 N PRO A 73 8.198 -4.786 2.875 1.00 0.00 N ATOM 1058 CA PRO A 73 6.878 -5.418 2.843 1.00 0.00 C ATOM 1059 C PRO A 73 5.871 -4.588 3.675 1.00 0.00 C ATOM 1060 O PRO A 73 5.492 -4.964 4.790 1.00 0.00 O ATOM 1061 CB PRO A 73 7.097 -6.846 3.356 1.00 0.00 C ATOM 1062 CG PRO A 73 8.290 -6.713 4.301 1.00 0.00 C ATOM 1063 CD PRO A 73 9.097 -5.550 3.732 1.00 0.00 C ATOM 0 HA PRO A 73 6.439 -5.459 1.846 1.00 0.00 H new ATOM 0 HB2 PRO A 73 6.216 -7.225 3.874 1.00 0.00 H new ATOM 0 HB3 PRO A 73 7.308 -7.537 2.540 1.00 0.00 H new ATOM 0 HG2 PRO A 73 7.967 -6.511 5.322 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.879 -7.630 4.329 1.00 0.00 H new ATOM 0 HD2 PRO A 73 9.490 -4.925 4.534 1.00 0.00 H new ATOM 0 HD3 PRO A 73 9.953 -5.916 3.164 1.00 0.00 H new ATOM 1068 N LEU A 74 5.463 -3.422 3.149 1.00 0.00 N ATOM 1069 CA LEU A 74 4.453 -2.532 3.744 1.00 0.00 C ATOM 1070 C LEU A 74 3.160 -3.304 4.042 1.00 0.00 C ATOM 1071 O LEU A 74 2.736 -3.372 5.194 1.00 0.00 O ATOM 1072 CB LEU A 74 4.231 -1.325 2.804 1.00 0.00 C ATOM 1073 CG LEU A 74 2.814 -0.716 2.759 1.00 0.00 C ATOM 1074 CD1 LEU A 74 2.258 -0.173 4.079 1.00 0.00 C ATOM 1075 CD2 LEU A 74 2.804 0.452 1.788 1.00 0.00 C ATOM 0 H LEU A 74 5.838 -3.062 2.272 1.00 0.00 H new ATOM 0 HA LEU A 74 4.804 -2.149 4.702 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.927 -0.538 3.094 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.499 -1.631 1.793 1.00 0.00 H new ATOM 0 HG LEU A 74 2.182 -1.555 2.469 1.00 0.00 H new ATOM 0 HD11 LEU A 74 1.257 0.227 3.915 1.00 0.00 H new ATOM 0 HD12 LEU A 74 2.211 -0.978 4.813 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.909 0.619 4.450 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.805 0.887 1.752 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.516 1.207 2.120 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.083 0.102 0.794 1.00 0.00 H new ATOM 1086 N LEU A 75 2.583 -3.933 3.014 1.00 0.00 N ATOM 1087 CA LEU A 75 1.352 -4.704 3.144 1.00 0.00 C ATOM 1088 C LEU A 75 1.701 -6.179 2.995 1.00 0.00 C ATOM 1089 O LEU A 75 2.401 -6.570 2.061 1.00 0.00 O ATOM 1090 CB LEU A 75 0.310 -4.220 2.112 1.00 0.00 C ATOM 1091 CG LEU A 75 -1.182 -4.370 2.473 1.00 0.00 C ATOM 1092 CD1 LEU A 75 -1.700 -5.804 2.371 1.00 0.00 C ATOM 1093 CD2 LEU A 75 -1.501 -3.836 3.873 1.00 0.00 C ATOM 0 H LEU A 75 2.961 -3.919 2.067 1.00 0.00 H new ATOM 0 HA LEU A 75 0.896 -4.559 4.123 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.502 -3.166 1.911 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.485 -4.759 1.181 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.696 -3.768 1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.756 -5.829 2.640 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.577 -6.164 1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.137 -6.443 3.051 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.564 -3.965 4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.919 -4.385 4.613 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.247 -2.777 3.925 1.00 0.00 H new ATOM 1104 N ASN A 76 1.203 -6.975 3.931 1.00 0.00 N ATOM 1105 CA ASN A 76 1.404 -8.412 4.013 1.00 0.00 C ATOM 1106 C ASN A 76 0.040 -9.050 4.276 1.00 0.00 C ATOM 1107 O ASN A 76 -0.382 -9.175 5.425 1.00 0.00 O ATOM 1108 CB ASN A 76 2.463 -8.711 5.089 1.00 0.00 C ATOM 1109 CG ASN A 76 2.586 -10.196 5.375 1.00 0.00 C ATOM 1110 OD1 ASN A 76 2.762 -11.015 4.484 1.00 0.00 O ATOM 1111 ND2 ASN A 76 2.484 -10.597 6.619 1.00 0.00 N ATOM 0 H ASN A 76 0.621 -6.618 4.689 1.00 0.00 H new ATOM 0 HA ASN A 76 1.793 -8.840 3.089 1.00 0.00 H new ATOM 0 HB2 ASN A 76 3.429 -8.324 4.763 1.00 0.00 H new ATOM 0 HB3 ASN A 76 2.203 -8.186 6.008 1.00 0.00 H new ATOM 0 HD21 ASN A 76 2.551 -11.590 6.842 1.00 0.00 H new ATOM 0 HD22 ASN A 76 2.337 -9.916 7.364 1.00 0.00 H new ATOM 1117 N CYS A 77 -0.652 -9.454 3.210 1.00 0.00 N ATOM 1118 CA CYS A 77 -1.913 -10.194 3.289 1.00 0.00 C ATOM 1119 C CYS A 77 -1.853 -11.505 2.497 1.00 0.00 C ATOM 1120 O CYS A 77 -0.939 -11.734 1.701 1.00 0.00 O ATOM 1121 CB CYS A 77 -3.084 -9.302 2.846 1.00 0.00 C ATOM 1122 SG CYS A 77 -3.339 -8.983 1.082 1.00 0.00 S ATOM 0 H CYS A 77 -0.348 -9.274 2.253 1.00 0.00 H new ATOM 0 HA CYS A 77 -2.081 -10.473 4.329 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -4.000 -9.748 3.234 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -2.965 -8.337 3.339 1.00 0.00 H new ATOM 1126 N ALA A 78 -2.835 -12.376 2.747 1.00 0.00 N ATOM 1127 CA ALA A 78 -2.877 -13.756 2.266 1.00 0.00 C ATOM 1128 C ALA A 78 -1.630 -14.573 2.687 1.00 0.00 C ATOM 1129 O ALA A 78 -0.577 -14.446 2.077 1.00 0.00 O ATOM 1130 CB ALA A 78 -3.158 -13.760 0.756 1.00 0.00 C ATOM 0 H ALA A 78 -3.649 -12.129 3.309 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.701 -14.280 2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.190 -14.788 0.395 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.116 -13.278 0.563 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.368 -13.217 0.237 1.00 0.00 H new ATOM 1136 N LYS A 79 -1.773 -15.417 3.723 1.00 0.00 N ATOM 1137 CA LYS A 79 -0.764 -16.361 4.286 1.00 0.00 C ATOM 1138 C LYS A 79 -1.305 -17.157 5.491 1.00 0.00 C ATOM 1139 O LYS A 79 -1.212 -18.387 5.458 1.00 0.00 O ATOM 1140 CB LYS A 79 0.548 -15.636 4.686 1.00 0.00 C ATOM 1141 CG LYS A 79 1.681 -15.965 3.703 1.00 0.00 C ATOM 1142 CD LYS A 79 2.796 -14.914 3.671 1.00 0.00 C ATOM 1143 CE LYS A 79 3.904 -15.135 4.710 1.00 0.00 C ATOM 1144 NZ LYS A 79 4.752 -16.314 4.374 1.00 0.00 N ATOM 0 H LYS A 79 -2.655 -15.469 4.232 1.00 0.00 H new ATOM 0 HA LYS A 79 -0.545 -17.067 3.485 1.00 0.00 H new ATOM 0 HB2 LYS A 79 0.381 -14.559 4.706 1.00 0.00 H new ATOM 0 HB3 LYS A 79 0.839 -15.933 5.694 1.00 0.00 H new ATOM 0 HG2 LYS A 79 2.112 -16.930 3.969 1.00 0.00 H new ATOM 0 HG3 LYS A 79 1.263 -16.068 2.702 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.243 -14.906 2.677 1.00 0.00 H new ATOM 0 HD3 LYS A 79 2.356 -13.930 3.831 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.529 -14.244 4.770 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.456 -15.278 5.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.576 -16.341 5.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.196 -17.186 4.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.076 -16.239 3.389 1.00 0.00 H new ATOM 1154 N PRO A 80 -1.887 -16.501 6.522 1.00 0.00 N ATOM 1155 CA PRO A 80 -2.547 -17.195 7.629 1.00 0.00 C ATOM 1156 C PRO A 80 -3.941 -17.718 7.216 1.00 0.00 C ATOM 1157 O PRO A 80 -4.335 -17.654 6.049 1.00 0.00 O ATOM 1158 CB PRO A 80 -2.585 -16.171 8.771 1.00 0.00 C ATOM 1159 CG PRO A 80 -2.679 -14.831 8.060 1.00 0.00 C ATOM 1160 CD PRO A 80 -1.991 -15.053 6.718 1.00 0.00 C ATOM 0 HA PRO A 80 -2.014 -18.093 7.941 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -3.440 -16.336 9.427 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -1.691 -16.232 9.392 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -3.717 -14.526 7.927 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -2.186 -14.044 8.632 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -2.563 -14.595 5.911 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -1.004 -14.591 6.710 1.00 0.00 H new ATOM 1165 N ASP A 81 -4.703 -18.211 8.190 1.00 0.00 N ATOM 1166 CA ASP A 81 -6.059 -18.775 8.053 1.00 0.00 C ATOM 1167 C ASP A 81 -7.163 -17.771 8.478 1.00 0.00 C ATOM 1168 O ASP A 81 -8.232 -18.154 8.962 1.00 0.00 O ATOM 1169 CB ASP A 81 -6.109 -20.137 8.777 1.00 0.00 C ATOM 1170 CG ASP A 81 -5.523 -20.105 10.205 1.00 0.00 C ATOM 1171 OD1 ASP A 81 -6.235 -19.714 11.158 1.00 0.00 O ATOM 1172 OD2 ASP A 81 -4.334 -20.472 10.370 1.00 0.00 O ATOM 0 H ASP A 81 -4.378 -18.232 9.157 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.280 -18.960 7.002 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.144 -20.474 8.827 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.563 -20.872 8.186 1.00 0.00 H new ATOM 1176 N GLN A 82 -6.905 -16.470 8.283 1.00 0.00 N ATOM 1177 CA GLN A 82 -7.821 -15.364 8.585 1.00 0.00 C ATOM 1178 C GLN A 82 -7.648 -14.172 7.620 1.00 0.00 C ATOM 1179 O GLN A 82 -6.655 -14.071 6.897 1.00 0.00 O ATOM 1180 CB GLN A 82 -7.617 -14.905 10.048 1.00 0.00 C ATOM 1181 CG GLN A 82 -8.906 -15.077 10.866 1.00 0.00 C ATOM 1182 CD GLN A 82 -8.835 -14.349 12.207 1.00 0.00 C ATOM 1183 OE1 GLN A 82 -8.031 -14.658 13.079 1.00 0.00 O ATOM 1184 NE2 GLN A 82 -9.669 -13.354 12.432 1.00 0.00 N ATOM 0 H GLN A 82 -6.018 -16.148 7.896 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.838 -15.733 8.451 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -6.813 -15.482 10.505 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -7.309 -13.860 10.065 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -9.752 -14.699 10.293 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -9.087 -16.138 11.039 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.345 -13.083 11.717 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -9.639 -12.854 13.321 1.00 0.00 H new ATOM 1191 N ASP A 83 -8.610 -13.249 7.643 1.00 0.00 N ATOM 1192 CA ASP A 83 -8.505 -11.918 7.037 1.00 0.00 C ATOM 1193 C ASP A 83 -7.356 -11.094 7.658 1.00 0.00 C ATOM 1194 O ASP A 83 -7.126 -11.148 8.870 1.00 0.00 O ATOM 1195 CB ASP A 83 -9.847 -11.179 7.192 1.00 0.00 C ATOM 1196 CG ASP A 83 -10.296 -11.012 8.662 1.00 0.00 C ATOM 1197 OD1 ASP A 83 -10.621 -12.031 9.318 1.00 0.00 O ATOM 1198 OD2 ASP A 83 -10.365 -9.855 9.142 1.00 0.00 O ATOM 0 H ASP A 83 -9.510 -13.410 8.096 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.275 -12.040 5.979 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.765 -10.194 6.732 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.617 -11.723 6.645 1.00 0.00 H new ATOM 1202 N ILE A 84 -6.671 -10.298 6.835 1.00 0.00 N ATOM 1203 CA ILE A 84 -5.671 -9.316 7.273 1.00 0.00 C ATOM 1204 C ILE A 84 -6.281 -7.913 7.209 1.00 0.00 C ATOM 1205 O ILE A 84 -7.011 -7.563 6.278 1.00 0.00 O ATOM 1206 CB ILE A 84 -4.352 -9.463 6.463 1.00 0.00 C ATOM 1207 CG1 ILE A 84 -3.235 -10.124 7.301 1.00 0.00 C ATOM 1208 CG2 ILE A 84 -3.776 -8.128 5.945 1.00 0.00 C ATOM 1209 CD1 ILE A 84 -3.600 -11.470 7.935 1.00 0.00 C ATOM 0 H ILE A 84 -6.797 -10.317 5.823 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.393 -9.500 8.311 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.641 -10.083 5.614 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -2.362 -10.266 6.664 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -2.943 -9.435 8.094 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.857 -8.319 5.391 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -4.502 -7.649 5.289 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.561 -7.472 6.789 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.749 -11.848 8.501 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.451 -11.338 8.604 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.861 -12.182 7.152 1.00 0.00 H new ATOM 1220 N LYS A 85 -5.958 -7.109 8.221 1.00 0.00 N ATOM 1221 CA LYS A 85 -6.406 -5.723 8.385 1.00 0.00 C ATOM 1222 C LYS A 85 -5.346 -4.899 9.125 1.00 0.00 C ATOM 1223 O LYS A 85 -4.764 -5.357 10.113 1.00 0.00 O ATOM 1224 CB LYS A 85 -7.775 -5.705 9.091 1.00 0.00 C ATOM 1225 CG LYS A 85 -7.760 -6.291 10.520 1.00 0.00 C ATOM 1226 CD LYS A 85 -9.138 -6.812 10.965 1.00 0.00 C ATOM 1227 CE LYS A 85 -9.988 -5.765 11.694 1.00 0.00 C ATOM 1228 NZ LYS A 85 -9.679 -5.729 13.151 1.00 0.00 N ATOM 0 H LYS A 85 -5.352 -7.416 8.982 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.534 -5.256 7.408 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -8.134 -4.677 9.136 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.489 -6.266 8.488 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.037 -7.105 10.566 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.423 -5.525 11.218 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -9.683 -7.164 10.089 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -8.997 -7.672 11.620 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.809 -4.782 11.259 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -11.045 -5.989 11.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.271 -5.010 13.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.874 -6.661 13.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -8.676 -5.491 13.287 1.00 0.00 H new ATOM 1238 N PHE A 86 -5.103 -3.693 8.624 1.00 0.00 N ATOM 1239 CA PHE A 86 -4.073 -2.763 9.085 1.00 0.00 C ATOM 1240 C PHE A 86 -4.676 -1.359 9.141 1.00 0.00 C ATOM 1241 O PHE A 86 -4.923 -0.751 8.103 1.00 0.00 O ATOM 1242 CB PHE A 86 -2.851 -2.823 8.149 1.00 0.00 C ATOM 1243 CG PHE A 86 -1.771 -3.777 8.630 1.00 0.00 C ATOM 1244 CD1 PHE A 86 -1.910 -5.168 8.449 1.00 0.00 C ATOM 1245 CD2 PHE A 86 -0.635 -3.273 9.297 1.00 0.00 C ATOM 1246 CE1 PHE A 86 -0.929 -6.046 8.945 1.00 0.00 C ATOM 1247 CE2 PHE A 86 0.348 -4.152 9.782 1.00 0.00 C ATOM 1248 CZ PHE A 86 0.199 -5.539 9.613 1.00 0.00 C ATOM 0 H PHE A 86 -5.645 -3.317 7.846 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.729 -3.037 10.082 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.178 -3.127 7.155 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.427 -1.824 8.053 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.771 -5.560 7.929 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -0.520 -2.208 9.435 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -1.043 -7.112 8.812 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.220 -3.761 10.286 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.950 -6.214 9.996 1.00 0.00 H new ATOM 1257 N THR A 87 -4.922 -0.853 10.349 1.00 0.00 N ATOM 1258 CA THR A 87 -5.375 0.527 10.567 1.00 0.00 C ATOM 1259 C THR A 87 -4.187 1.411 10.941 1.00 0.00 C ATOM 1260 O THR A 87 -3.430 1.105 11.868 1.00 0.00 O ATOM 1261 CB THR A 87 -6.523 0.589 11.592 1.00 0.00 C ATOM 1262 OG1 THR A 87 -6.969 1.925 11.702 1.00 0.00 O ATOM 1263 CG2 THR A 87 -6.195 0.084 12.999 1.00 0.00 C ATOM 0 H THR A 87 -4.813 -1.389 11.210 1.00 0.00 H new ATOM 0 HA THR A 87 -5.791 0.918 9.638 1.00 0.00 H new ATOM 0 HB THR A 87 -7.282 -0.089 11.201 1.00 0.00 H new ATOM 0 HG1 THR A 87 -7.701 1.973 12.352 1.00 0.00 H new ATOM 0 HG21 THR A 87 -7.077 0.176 13.633 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.891 -0.962 12.949 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.383 0.678 13.419 1.00 0.00 H new ATOM 1271 N ILE A 88 -4.007 2.499 10.199 1.00 0.00 N ATOM 1272 CA ILE A 88 -3.057 3.568 10.493 1.00 0.00 C ATOM 1273 C ILE A 88 -3.856 4.792 10.935 1.00 0.00 C ATOM 1274 O ILE A 88 -4.720 5.284 10.205 1.00 0.00 O ATOM 1275 CB ILE A 88 -2.132 3.844 9.278 1.00 0.00 C ATOM 1276 CG1 ILE A 88 -0.885 2.948 9.414 1.00 0.00 C ATOM 1277 CG2 ILE A 88 -1.702 5.329 9.142 1.00 0.00 C ATOM 1278 CD1 ILE A 88 0.082 2.991 8.223 1.00 0.00 C ATOM 0 H ILE A 88 -4.538 2.667 9.345 1.00 0.00 H new ATOM 0 HA ILE A 88 -2.385 3.280 11.301 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.697 3.616 8.374 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.343 3.241 10.313 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.211 1.918 9.560 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -1.057 5.443 8.270 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.587 5.955 9.023 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -1.160 5.634 10.037 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.926 2.328 8.415 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.437 2.666 7.321 1.00 0.00 H new ATOM 0 HD13 ILE A 88 0.445 4.010 8.086 1.00 0.00 H new ATOM 1289 N LYS A 89 -3.530 5.279 12.134 1.00 0.00 N ATOM 1290 CA LYS A 89 -3.948 6.585 12.642 1.00 0.00 C ATOM 1291 C LYS A 89 -2.816 7.601 12.412 1.00 0.00 C ATOM 1292 O LYS A 89 -1.635 7.249 12.418 1.00 0.00 O ATOM 1293 CB LYS A 89 -4.399 6.504 14.115 1.00 0.00 C ATOM 1294 CG LYS A 89 -3.430 5.847 15.121 1.00 0.00 C ATOM 1295 CD LYS A 89 -3.667 4.340 15.315 1.00 0.00 C ATOM 1296 CE LYS A 89 -2.896 3.844 16.543 1.00 0.00 C ATOM 1297 NZ LYS A 89 -3.070 2.380 16.757 1.00 0.00 N ATOM 0 H LYS A 89 -2.952 4.761 12.796 1.00 0.00 H new ATOM 0 HA LYS A 89 -4.824 6.928 12.092 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.606 7.517 14.460 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -5.341 5.957 14.149 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.406 6.004 14.781 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.526 6.348 16.084 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.732 4.144 15.440 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -3.344 3.795 14.428 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -1.836 4.069 16.421 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -3.237 4.383 17.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -2.532 2.086 17.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -4.078 2.167 16.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -2.721 1.864 15.924 1.00 0.00 H new ATOM 1307 N PHE A 90 -3.196 8.864 12.221 1.00 0.00 N ATOM 1308 CA PHE A 90 -2.320 10.034 12.115 1.00 0.00 C ATOM 1309 C PHE A 90 -1.294 10.089 13.264 1.00 0.00 C ATOM 1310 O PHE A 90 -1.623 10.489 14.383 1.00 0.00 O ATOM 1311 CB PHE A 90 -3.164 11.322 12.036 1.00 0.00 C ATOM 1312 CG PHE A 90 -4.270 11.490 13.076 1.00 0.00 C ATOM 1313 CD1 PHE A 90 -5.509 10.832 12.920 1.00 0.00 C ATOM 1314 CD2 PHE A 90 -4.044 12.280 14.221 1.00 0.00 C ATOM 1315 CE1 PHE A 90 -6.479 10.911 13.935 1.00 0.00 C ATOM 1316 CE2 PHE A 90 -5.019 12.361 15.226 1.00 0.00 C ATOM 1317 CZ PHE A 90 -6.232 11.667 15.093 1.00 0.00 C ATOM 0 H PHE A 90 -4.181 9.114 12.131 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.744 9.947 11.194 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.490 12.175 12.117 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.619 11.369 11.047 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -5.712 10.268 12.022 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.117 12.825 14.325 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.418 10.388 13.824 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.836 12.960 16.106 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.972 11.714 15.878 1.00 0.00 H new ATOM 1326 N GLN A 91 -0.052 9.674 13.000 1.00 0.00 N ATOM 1327 CA GLN A 91 0.998 9.612 14.011 1.00 0.00 C ATOM 1328 C GLN A 91 2.359 9.983 13.393 1.00 0.00 C ATOM 1329 O GLN A 91 2.839 9.328 12.467 1.00 0.00 O ATOM 1330 CB GLN A 91 1.009 8.205 14.656 1.00 0.00 C ATOM 1331 CG GLN A 91 1.342 8.261 16.153 1.00 0.00 C ATOM 1332 CD GLN A 91 0.211 8.871 16.989 1.00 0.00 C ATOM 1333 OE1 GLN A 91 -0.921 8.402 17.004 1.00 0.00 O ATOM 1334 NE2 GLN A 91 0.460 9.929 17.735 1.00 0.00 N ATOM 0 H GLN A 91 0.251 9.371 12.074 1.00 0.00 H new ATOM 0 HA GLN A 91 0.799 10.339 14.798 1.00 0.00 H new ATOM 0 HB2 GLN A 91 0.035 7.736 14.519 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.740 7.578 14.145 1.00 0.00 H new ATOM 0 HG2 GLN A 91 1.551 7.253 16.512 1.00 0.00 H new ATOM 0 HG3 GLN A 91 2.251 8.846 16.297 1.00 0.00 H new ATOM 0 HE21 GLN A 91 1.393 10.340 17.742 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -0.281 10.337 18.306 1.00 0.00 H new ATOM 1341 N GLU A 92 2.978 11.053 13.893 1.00 0.00 N ATOM 1342 CA GLU A 92 4.303 11.511 13.452 1.00 0.00 C ATOM 1343 C GLU A 92 5.429 10.909 14.318 1.00 0.00 C ATOM 1344 O GLU A 92 6.509 10.596 13.813 1.00 0.00 O ATOM 1345 CB GLU A 92 4.341 13.044 13.532 1.00 0.00 C ATOM 1346 CG GLU A 92 5.522 13.640 12.753 1.00 0.00 C ATOM 1347 CD GLU A 92 5.831 15.094 13.157 1.00 0.00 C ATOM 1348 OE1 GLU A 92 4.899 15.874 13.469 1.00 0.00 O ATOM 1349 OE2 GLU A 92 7.026 15.476 13.156 1.00 0.00 O ATOM 0 H GLU A 92 2.571 11.636 14.625 1.00 0.00 H new ATOM 0 HA GLU A 92 4.468 11.178 12.427 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.408 13.449 13.139 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.407 13.349 14.576 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.407 13.026 12.918 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.303 13.603 11.686 1.00 0.00 H new ATOM 1354 N PHE A 93 5.151 10.704 15.610 1.00 0.00 N ATOM 1355 CA PHE A 93 6.076 10.201 16.624 1.00 0.00 C ATOM 1356 C PHE A 93 5.381 9.105 17.439 1.00 0.00 C ATOM 1357 O PHE A 93 4.259 9.300 17.916 1.00 0.00 O ATOM 1358 CB PHE A 93 6.543 11.362 17.523 1.00 0.00 C ATOM 1359 CG PHE A 93 8.047 11.452 17.674 1.00 0.00 C ATOM 1360 CD1 PHE A 93 8.712 10.736 18.691 1.00 0.00 C ATOM 1361 CD2 PHE A 93 8.792 12.271 16.798 1.00 0.00 C ATOM 1362 CE1 PHE A 93 10.110 10.839 18.829 1.00 0.00 C ATOM 1363 CE2 PHE A 93 10.188 12.373 16.940 1.00 0.00 C ATOM 1364 CZ PHE A 93 10.847 11.656 17.954 1.00 0.00 C ATOM 0 H PHE A 93 4.225 10.895 15.994 1.00 0.00 H new ATOM 0 HA PHE A 93 6.958 9.770 16.149 1.00 0.00 H new ATOM 0 HB2 PHE A 93 6.172 12.300 17.111 1.00 0.00 H new ATOM 0 HB3 PHE A 93 6.094 11.248 18.510 1.00 0.00 H new ATOM 0 HD1 PHE A 93 8.148 10.108 19.365 1.00 0.00 H new ATOM 0 HD2 PHE A 93 8.289 12.821 16.016 1.00 0.00 H new ATOM 0 HE1 PHE A 93 10.617 10.289 19.608 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.754 13.003 16.269 1.00 0.00 H new ATOM 0 HZ PHE A 93 11.919 11.733 18.061 1.00 0.00 H new ATOM 1373 N SER A 94 6.055 7.970 17.623 1.00 0.00 N ATOM 1374 CA SER A 94 5.523 6.788 18.329 1.00 0.00 C ATOM 1375 C SER A 94 6.542 6.300 19.374 1.00 0.00 C ATOM 1376 O SER A 94 7.738 6.268 19.069 1.00 0.00 O ATOM 1377 CB SER A 94 5.223 5.642 17.346 1.00 0.00 C ATOM 1378 OG SER A 94 4.404 6.070 16.266 1.00 0.00 O ATOM 0 H SER A 94 7.007 7.836 17.281 1.00 0.00 H new ATOM 0 HA SER A 94 4.595 7.080 18.820 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.160 5.244 16.956 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.728 4.829 17.877 1.00 0.00 H new ATOM 0 HG SER A 94 4.237 5.316 15.663 1.00 0.00 H new ATOM 1383 N PRO A 95 6.114 5.924 20.595 1.00 0.00 N ATOM 1384 CA PRO A 95 7.040 5.488 21.641 1.00 0.00 C ATOM 1385 C PRO A 95 7.617 4.089 21.342 1.00 0.00 C ATOM 1386 O PRO A 95 8.821 3.874 21.511 1.00 0.00 O ATOM 1387 CB PRO A 95 6.229 5.525 22.938 1.00 0.00 C ATOM 1388 CG PRO A 95 4.770 5.379 22.497 1.00 0.00 C ATOM 1389 CD PRO A 95 4.737 5.941 21.077 1.00 0.00 C ATOM 0 HA PRO A 95 7.914 6.136 21.709 1.00 0.00 H new ATOM 0 HB2 PRO A 95 6.521 4.718 23.609 1.00 0.00 H new ATOM 0 HB3 PRO A 95 6.387 6.460 23.476 1.00 0.00 H new ATOM 0 HG2 PRO A 95 4.452 4.337 22.518 1.00 0.00 H new ATOM 0 HG3 PRO A 95 4.100 5.930 23.157 1.00 0.00 H new ATOM 0 HD2 PRO A 95 4.094 5.338 20.436 1.00 0.00 H new ATOM 0 HD3 PRO A 95 4.335 6.954 21.070 1.00 0.00 H new ATOM 1394 N ASN A 96 6.776 3.157 20.876 1.00 0.00 N ATOM 1395 CA ASN A 96 7.157 1.814 20.422 1.00 0.00 C ATOM 1396 C ASN A 96 5.978 1.180 19.648 1.00 0.00 C ATOM 1397 O ASN A 96 4.909 0.947 20.218 1.00 0.00 O ATOM 1398 CB ASN A 96 7.568 0.956 21.640 1.00 0.00 C ATOM 1399 CG ASN A 96 8.788 0.104 21.337 1.00 0.00 C ATOM 1400 OD1 ASN A 96 8.850 -0.608 20.345 1.00 0.00 O ATOM 1401 ND2 ASN A 96 9.808 0.167 22.164 1.00 0.00 N ATOM 0 H ASN A 96 5.773 3.325 20.802 1.00 0.00 H new ATOM 0 HA ASN A 96 8.011 1.871 19.748 1.00 0.00 H new ATOM 0 HB2 ASN A 96 7.779 1.606 22.489 1.00 0.00 H new ATOM 0 HB3 ASN A 96 6.737 0.313 21.930 1.00 0.00 H new ATOM 0 HD21 ASN A 96 10.650 -0.378 21.978 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.757 0.761 22.992 1.00 0.00 H new ATOM 1407 N LEU A 97 6.142 0.943 18.343 1.00 0.00 N ATOM 1408 CA LEU A 97 5.110 0.398 17.438 1.00 0.00 C ATOM 1409 C LEU A 97 5.751 -0.170 16.150 1.00 0.00 C ATOM 1410 O LEU A 97 6.976 -0.182 16.022 1.00 0.00 O ATOM 1411 CB LEU A 97 4.054 1.505 17.163 1.00 0.00 C ATOM 1412 CG LEU A 97 2.639 1.115 17.651 1.00 0.00 C ATOM 1413 CD1 LEU A 97 1.814 2.368 17.947 1.00 0.00 C ATOM 1414 CD2 LEU A 97 1.894 0.268 16.615 1.00 0.00 C ATOM 0 H LEU A 97 7.024 1.129 17.866 1.00 0.00 H new ATOM 0 HA LEU A 97 4.599 -0.443 17.906 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.363 2.427 17.656 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.021 1.712 16.093 1.00 0.00 H new ATOM 0 HG LEU A 97 2.765 0.525 18.559 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.821 2.077 18.289 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.308 2.954 18.722 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.724 2.967 17.041 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.905 0.015 16.996 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.793 0.833 15.688 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.454 -0.647 16.423 1.00 0.00 H new ATOM 1425 N TRP A 98 4.932 -0.615 15.191 1.00 0.00 N ATOM 1426 CA TRP A 98 5.371 -1.130 13.881 1.00 0.00 C ATOM 1427 C TRP A 98 6.174 -0.133 13.019 1.00 0.00 C ATOM 1428 O TRP A 98 6.798 -0.538 12.037 1.00 0.00 O ATOM 1429 CB TRP A 98 4.150 -1.651 13.106 1.00 0.00 C ATOM 1430 CG TRP A 98 3.808 -3.075 13.411 1.00 0.00 C ATOM 1431 CD1 TRP A 98 3.022 -3.514 14.416 1.00 0.00 C ATOM 1432 CD2 TRP A 98 4.289 -4.280 12.715 1.00 0.00 C ATOM 1433 NE1 TRP A 98 2.982 -4.896 14.405 1.00 0.00 N ATOM 1434 CE2 TRP A 98 3.743 -5.417 13.388 1.00 0.00 C ATOM 1435 CE3 TRP A 98 5.121 -4.506 11.616 1.00 0.00 C ATOM 1436 CZ2 TRP A 98 4.036 -6.734 12.970 1.00 0.00 C ATOM 1437 CZ3 TRP A 98 5.419 -5.828 11.182 1.00 0.00 C ATOM 1438 CH2 TRP A 98 4.873 -6.925 11.864 1.00 0.00 C ATOM 0 H TRP A 98 3.918 -0.629 15.303 1.00 0.00 H new ATOM 0 HA TRP A 98 6.073 -1.936 14.095 1.00 0.00 H new ATOM 0 HB2 TRP A 98 3.290 -1.023 13.336 1.00 0.00 H new ATOM 0 HB3 TRP A 98 4.340 -1.553 12.037 1.00 0.00 H new ATOM 0 HD1 TRP A 98 2.503 -2.882 15.122 1.00 0.00 H new ATOM 0 HE1 TRP A 98 2.452 -5.459 15.070 1.00 0.00 H new ATOM 0 HE3 TRP A 98 5.545 -3.665 11.088 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 3.621 -7.581 13.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 6.064 -5.986 10.330 1.00 0.00 H new ATOM 0 HH2 TRP A 98 5.100 -7.927 11.533 1.00 0.00 H new ATOM 1448 N GLY A 99 6.161 1.159 13.361 1.00 0.00 N ATOM 1449 CA GLY A 99 6.882 2.225 12.645 1.00 0.00 C ATOM 1450 C GLY A 99 5.936 3.148 11.874 1.00 0.00 C ATOM 1451 O GLY A 99 6.156 3.407 10.691 1.00 0.00 O ATOM 0 H GLY A 99 5.636 1.505 14.164 1.00 0.00 H new ATOM 0 HA2 GLY A 99 7.459 2.813 13.359 1.00 0.00 H new ATOM 0 HA3 GLY A 99 7.594 1.777 11.952 1.00 0.00 H new ATOM 1454 N LEU A 100 4.829 3.560 12.507 1.00 0.00 N ATOM 1455 CA LEU A 100 3.808 4.438 11.909 1.00 0.00 C ATOM 1456 C LEU A 100 4.336 5.867 11.637 1.00 0.00 C ATOM 1457 O LEU A 100 3.711 6.604 10.869 1.00 0.00 O ATOM 1458 CB LEU A 100 2.555 4.527 12.805 1.00 0.00 C ATOM 1459 CG LEU A 100 2.056 3.219 13.462 1.00 0.00 C ATOM 1460 CD1 LEU A 100 0.889 3.539 14.387 1.00 0.00 C ATOM 1461 CD2 LEU A 100 1.595 2.163 12.450 1.00 0.00 C ATOM 0 H LEU A 100 4.612 3.289 13.466 1.00 0.00 H new ATOM 0 HA LEU A 100 3.546 3.984 10.953 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.759 5.246 13.598 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.741 4.935 12.206 1.00 0.00 H new ATOM 0 HG LEU A 100 2.903 2.801 14.006 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.532 2.621 14.854 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.217 4.235 15.159 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.081 3.991 13.811 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.258 1.273 12.981 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.774 2.563 11.855 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.425 1.902 11.793 1.00 0.00 H new ATOM 1472 N GLU A 101 5.471 6.244 12.247 1.00 0.00 N ATOM 1473 CA GLU A 101 6.117 7.548 12.087 1.00 0.00 C ATOM 1474 C GLU A 101 6.295 7.938 10.613 1.00 0.00 C ATOM 1475 O GLU A 101 6.734 7.151 9.769 1.00 0.00 O ATOM 1476 CB GLU A 101 7.484 7.589 12.792 1.00 0.00 C ATOM 1477 CG GLU A 101 7.393 7.469 14.317 1.00 0.00 C ATOM 1478 CD GLU A 101 7.690 6.039 14.798 1.00 0.00 C ATOM 1479 OE1 GLU A 101 6.944 5.104 14.422 1.00 0.00 O ATOM 1480 OE2 GLU A 101 8.675 5.847 15.549 1.00 0.00 O ATOM 0 H GLU A 101 5.976 5.628 12.884 1.00 0.00 H new ATOM 0 HA GLU A 101 5.449 8.272 12.553 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.105 6.779 12.409 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.986 8.523 12.539 1.00 0.00 H new ATOM 0 HG2 GLU A 101 8.098 8.161 14.778 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.396 7.763 14.646 1.00 0.00 H new ATOM 1485 N PHE A 102 6.005 9.205 10.343 1.00 0.00 N ATOM 1486 CA PHE A 102 6.029 9.838 9.029 1.00 0.00 C ATOM 1487 C PHE A 102 6.746 11.201 9.156 1.00 0.00 C ATOM 1488 O PHE A 102 6.818 11.773 10.247 1.00 0.00 O ATOM 1489 CB PHE A 102 4.575 9.937 8.520 1.00 0.00 C ATOM 1490 CG PHE A 102 4.238 11.248 7.850 1.00 0.00 C ATOM 1491 CD1 PHE A 102 4.518 11.448 6.485 1.00 0.00 C ATOM 1492 CD2 PHE A 102 3.761 12.321 8.628 1.00 0.00 C ATOM 1493 CE1 PHE A 102 4.308 12.710 5.905 1.00 0.00 C ATOM 1494 CE2 PHE A 102 3.539 13.581 8.046 1.00 0.00 C ATOM 1495 CZ PHE A 102 3.820 13.772 6.687 1.00 0.00 C ATOM 0 H PHE A 102 5.731 9.857 11.078 1.00 0.00 H new ATOM 0 HA PHE A 102 6.587 9.260 8.292 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.393 9.125 7.816 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.897 9.787 9.361 1.00 0.00 H new ATOM 0 HD1 PHE A 102 4.894 10.633 5.885 1.00 0.00 H new ATOM 0 HD2 PHE A 102 3.564 12.174 9.680 1.00 0.00 H new ATOM 0 HE1 PHE A 102 4.521 12.865 4.858 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.155 14.396 8.642 1.00 0.00 H new ATOM 0 HZ PHE A 102 3.661 14.741 6.237 1.00 0.00 H new ATOM 1504 N GLN A 103 7.267 11.726 8.045 1.00 0.00 N ATOM 1505 CA GLN A 103 7.914 13.039 7.974 1.00 0.00 C ATOM 1506 C GLN A 103 7.262 13.878 6.867 1.00 0.00 C ATOM 1507 O GLN A 103 7.174 13.432 5.722 1.00 0.00 O ATOM 1508 CB GLN A 103 9.424 12.898 7.692 1.00 0.00 C ATOM 1509 CG GLN A 103 10.183 11.881 8.577 1.00 0.00 C ATOM 1510 CD GLN A 103 10.638 10.602 7.858 1.00 0.00 C ATOM 1511 OE1 GLN A 103 10.774 10.520 6.644 1.00 0.00 O ATOM 1512 NE2 GLN A 103 10.922 9.536 8.578 1.00 0.00 N ATOM 0 H GLN A 103 7.251 11.239 7.149 1.00 0.00 H new ATOM 0 HA GLN A 103 7.787 13.535 8.937 1.00 0.00 H new ATOM 0 HB2 GLN A 103 9.554 12.611 6.649 1.00 0.00 H new ATOM 0 HB3 GLN A 103 9.890 13.876 7.814 1.00 0.00 H new ATOM 0 HG2 GLN A 103 11.059 12.373 8.999 1.00 0.00 H new ATOM 0 HG3 GLN A 103 9.542 11.601 9.413 1.00 0.00 H new ATOM 0 HE21 GLN A 103 10.822 9.564 9.593 1.00 0.00 H new ATOM 0 HE22 GLN A 103 11.242 8.682 8.121 1.00 0.00 H new ATOM 1519 N LYS A 104 6.826 15.102 7.192 1.00 0.00 N ATOM 1520 CA LYS A 104 6.356 16.108 6.213 1.00 0.00 C ATOM 1521 C LYS A 104 7.457 16.507 5.210 1.00 0.00 C ATOM 1522 O LYS A 104 8.635 16.208 5.410 1.00 0.00 O ATOM 1523 CB LYS A 104 5.795 17.340 6.955 1.00 0.00 C ATOM 1524 CG LYS A 104 6.877 18.034 7.805 1.00 0.00 C ATOM 1525 CD LYS A 104 6.666 19.549 7.930 1.00 0.00 C ATOM 1526 CE LYS A 104 8.009 20.186 8.307 1.00 0.00 C ATOM 1527 NZ LYS A 104 7.904 21.660 8.465 1.00 0.00 N ATOM 0 H LYS A 104 6.787 15.433 8.156 1.00 0.00 H new ATOM 0 HA LYS A 104 5.557 15.657 5.625 1.00 0.00 H new ATOM 0 HB2 LYS A 104 5.391 18.048 6.231 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.969 17.034 7.597 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.887 17.591 8.801 1.00 0.00 H new ATOM 0 HG3 LYS A 104 7.855 17.845 7.362 1.00 0.00 H new ATOM 0 HD2 LYS A 104 6.299 19.961 6.990 1.00 0.00 H new ATOM 0 HD3 LYS A 104 5.914 19.768 8.689 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.370 19.747 9.237 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.747 19.956 7.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.834 22.049 8.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.585 22.083 7.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.219 21.881 9.216 1.00 0.00 H new ATOM 1537 N ASN A 105 7.074 17.233 4.155 1.00 0.00 N ATOM 1538 CA ASN A 105 7.960 17.653 3.058 1.00 0.00 C ATOM 1539 C ASN A 105 8.728 16.472 2.420 1.00 0.00 C ATOM 1540 O ASN A 105 9.907 16.569 2.068 1.00 0.00 O ATOM 1541 CB ASN A 105 8.829 18.842 3.529 1.00 0.00 C ATOM 1542 CG ASN A 105 9.241 19.781 2.398 1.00 0.00 C ATOM 1543 OD1 ASN A 105 9.456 19.400 1.258 1.00 0.00 O ATOM 1544 ND2 ASN A 105 9.319 21.066 2.663 1.00 0.00 N ATOM 0 H ASN A 105 6.114 17.555 4.035 1.00 0.00 H new ATOM 0 HA ASN A 105 7.363 18.020 2.223 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.278 19.409 4.279 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.725 18.457 4.015 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.556 21.726 1.922 1.00 0.00 H new ATOM 0 HD22 ASN A 105 9.143 21.403 3.609 1.00 0.00 H new ATOM 1550 N LYS A 106 8.035 15.338 2.279 1.00 0.00 N ATOM 1551 CA LYS A 106 8.525 14.084 1.688 1.00 0.00 C ATOM 1552 C LYS A 106 7.416 13.464 0.843 1.00 0.00 C ATOM 1553 O LYS A 106 6.290 13.272 1.303 1.00 0.00 O ATOM 1554 CB LYS A 106 8.975 13.085 2.775 1.00 0.00 C ATOM 1555 CG LYS A 106 10.496 12.962 2.926 1.00 0.00 C ATOM 1556 CD LYS A 106 11.130 14.018 3.849 1.00 0.00 C ATOM 1557 CE LYS A 106 12.270 14.778 3.155 1.00 0.00 C ATOM 1558 NZ LYS A 106 13.472 14.912 4.024 1.00 0.00 N ATOM 0 H LYS A 106 7.066 15.264 2.590 1.00 0.00 H new ATOM 0 HA LYS A 106 9.391 14.310 1.066 1.00 0.00 H new ATOM 0 HB2 LYS A 106 8.550 13.390 3.731 1.00 0.00 H new ATOM 0 HB3 LYS A 106 8.564 12.103 2.542 1.00 0.00 H new ATOM 0 HG2 LYS A 106 10.732 11.970 3.313 1.00 0.00 H new ATOM 0 HG3 LYS A 106 10.954 13.037 1.940 1.00 0.00 H new ATOM 0 HD2 LYS A 106 10.365 14.725 4.170 1.00 0.00 H new ATOM 0 HD3 LYS A 106 11.512 13.532 4.747 1.00 0.00 H new ATOM 0 HE2 LYS A 106 12.544 14.258 2.237 1.00 0.00 H new ATOM 0 HE3 LYS A 106 11.920 15.769 2.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 14.214 15.431 3.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 13.219 15.431 4.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 13.824 13.967 4.278 1.00 0.00 H new ATOM 1568 N ASP A 107 7.761 13.129 -0.393 1.00 0.00 N ATOM 1569 CA ASP A 107 6.896 12.369 -1.294 1.00 0.00 C ATOM 1570 C ASP A 107 6.989 10.875 -0.929 1.00 0.00 C ATOM 1571 O ASP A 107 8.069 10.375 -0.589 1.00 0.00 O ATOM 1572 CB ASP A 107 7.278 12.594 -2.773 1.00 0.00 C ATOM 1573 CG ASP A 107 8.072 13.888 -3.029 1.00 0.00 C ATOM 1574 OD1 ASP A 107 7.464 14.982 -3.114 1.00 0.00 O ATOM 1575 OD2 ASP A 107 9.320 13.814 -3.133 1.00 0.00 O ATOM 0 H ASP A 107 8.660 13.379 -0.806 1.00 0.00 H new ATOM 0 HA ASP A 107 5.870 12.716 -1.174 1.00 0.00 H new ATOM 0 HB2 ASP A 107 7.868 11.745 -3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 107 6.368 12.614 -3.373 1.00 0.00 H new ATOM 1579 N TYR A 108 5.876 10.151 -1.035 1.00 0.00 N ATOM 1580 CA TYR A 108 5.820 8.699 -0.836 1.00 0.00 C ATOM 1581 C TYR A 108 5.256 8.039 -2.098 1.00 0.00 C ATOM 1582 O TYR A 108 4.353 8.567 -2.752 1.00 0.00 O ATOM 1583 CB TYR A 108 4.993 8.332 0.416 1.00 0.00 C ATOM 1584 CG TYR A 108 5.744 7.775 1.616 1.00 0.00 C ATOM 1585 CD1 TYR A 108 6.715 6.759 1.471 1.00 0.00 C ATOM 1586 CD2 TYR A 108 5.392 8.224 2.906 1.00 0.00 C ATOM 1587 CE1 TYR A 108 7.360 6.232 2.609 1.00 0.00 C ATOM 1588 CE2 TYR A 108 6.024 7.686 4.042 1.00 0.00 C ATOM 1589 CZ TYR A 108 7.013 6.691 3.897 1.00 0.00 C ATOM 1590 OH TYR A 108 7.612 6.170 5.000 1.00 0.00 O ATOM 0 H TYR A 108 4.971 10.561 -1.265 1.00 0.00 H new ATOM 0 HA TYR A 108 6.829 8.324 -0.662 1.00 0.00 H new ATOM 0 HB2 TYR A 108 4.458 9.225 0.739 1.00 0.00 H new ATOM 0 HB3 TYR A 108 4.242 7.600 0.120 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.963 6.386 0.488 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.634 8.984 3.022 1.00 0.00 H new ATOM 0 HE1 TYR A 108 8.122 5.475 2.494 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.751 8.036 5.027 1.00 0.00 H new ATOM 0 HH TYR A 108 7.253 6.603 5.803 1.00 0.00 H new ATOM 1599 N TYR A 109 5.784 6.863 -2.420 1.00 0.00 N ATOM 1600 CA TYR A 109 5.410 6.087 -3.598 1.00 0.00 C ATOM 1601 C TYR A 109 5.406 4.597 -3.235 1.00 0.00 C ATOM 1602 O TYR A 109 6.277 4.110 -2.509 1.00 0.00 O ATOM 1603 CB TYR A 109 6.390 6.386 -4.738 1.00 0.00 C ATOM 1604 CG TYR A 109 6.393 7.811 -5.263 1.00 0.00 C ATOM 1605 CD1 TYR A 109 5.251 8.328 -5.905 1.00 0.00 C ATOM 1606 CD2 TYR A 109 7.555 8.606 -5.157 1.00 0.00 C ATOM 1607 CE1 TYR A 109 5.267 9.636 -6.429 1.00 0.00 C ATOM 1608 CE2 TYR A 109 7.577 9.905 -5.702 1.00 0.00 C ATOM 1609 CZ TYR A 109 6.429 10.427 -6.331 1.00 0.00 C ATOM 1610 OH TYR A 109 6.439 11.676 -6.863 1.00 0.00 O ATOM 0 H TYR A 109 6.503 6.411 -1.855 1.00 0.00 H new ATOM 0 HA TYR A 109 4.410 6.361 -3.934 1.00 0.00 H new ATOM 0 HB2 TYR A 109 7.397 6.145 -4.397 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.165 5.716 -5.568 1.00 0.00 H new ATOM 0 HD1 TYR A 109 4.362 7.721 -5.996 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.430 8.217 -4.657 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.385 10.034 -6.908 1.00 0.00 H new ATOM 0 HE2 TYR A 109 8.475 10.502 -5.638 1.00 0.00 H new ATOM 0 HH TYR A 109 7.314 12.090 -6.710 1.00 0.00 H new ATOM 1619 N ILE A 110 4.387 3.887 -3.712 1.00 0.00 N ATOM 1620 CA ILE A 110 4.128 2.474 -3.400 1.00 0.00 C ATOM 1621 C ILE A 110 3.699 1.800 -4.713 1.00 0.00 C ATOM 1622 O ILE A 110 2.974 2.408 -5.505 1.00 0.00 O ATOM 1623 CB ILE A 110 3.047 2.328 -2.302 1.00 0.00 C ATOM 1624 CG1 ILE A 110 3.301 3.179 -1.035 1.00 0.00 C ATOM 1625 CG2 ILE A 110 2.911 0.852 -1.918 1.00 0.00 C ATOM 1626 CD1 ILE A 110 2.185 3.227 0.013 1.00 0.00 C ATOM 0 H ILE A 110 3.695 4.286 -4.346 1.00 0.00 H new ATOM 0 HA ILE A 110 5.023 1.996 -3.001 1.00 0.00 H new ATOM 0 HB ILE A 110 2.122 2.710 -2.733 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.202 2.803 -0.551 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.511 4.201 -1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.150 0.746 -1.145 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.620 0.273 -2.795 1.00 0.00 H new ATOM 0 HG23 ILE A 110 3.865 0.485 -1.541 1.00 0.00 H new ATOM 0 HD11 ILE A 110 2.495 3.857 0.846 1.00 0.00 H new ATOM 0 HD12 ILE A 110 1.281 3.638 -0.436 1.00 0.00 H new ATOM 0 HD13 ILE A 110 1.983 2.219 0.376 1.00 0.00 H new ATOM 1637 N ILE A 111 4.165 0.576 -4.950 1.00 0.00 N ATOM 1638 CA ILE A 111 4.058 -0.144 -6.222 1.00 0.00 C ATOM 1639 C ILE A 111 3.918 -1.634 -5.898 1.00 0.00 C ATOM 1640 O ILE A 111 4.554 -2.129 -4.965 1.00 0.00 O ATOM 1641 CB ILE A 111 5.319 0.118 -7.076 1.00 0.00 C ATOM 1642 CG1 ILE A 111 5.670 1.624 -7.208 1.00 0.00 C ATOM 1643 CG2 ILE A 111 5.186 -0.491 -8.495 1.00 0.00 C ATOM 1644 CD1 ILE A 111 6.982 1.905 -7.916 1.00 0.00 C ATOM 0 H ILE A 111 4.648 0.034 -4.233 1.00 0.00 H new ATOM 0 HA ILE A 111 3.193 0.194 -6.793 1.00 0.00 H new ATOM 0 HB ILE A 111 6.131 -0.372 -6.538 1.00 0.00 H new ATOM 0 HG12 ILE A 111 4.866 2.125 -7.747 1.00 0.00 H new ATOM 0 HG13 ILE A 111 5.708 2.064 -6.211 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.092 -0.286 -9.065 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.043 -1.569 -8.416 1.00 0.00 H new ATOM 0 HG23 ILE A 111 4.330 -0.047 -9.003 1.00 0.00 H new ATOM 0 HD11 ILE A 111 7.147 2.981 -7.963 1.00 0.00 H new ATOM 0 HD12 ILE A 111 7.799 1.437 -7.367 1.00 0.00 H new ATOM 0 HD13 ILE A 111 6.944 1.499 -8.927 1.00 0.00 H new ATOM 1655 N SER A 112 3.117 -2.359 -6.671 1.00 0.00 N ATOM 1656 CA SER A 112 2.935 -3.796 -6.494 1.00 0.00 C ATOM 1657 C SER A 112 3.195 -4.558 -7.785 1.00 0.00 C ATOM 1658 O SER A 112 2.953 -4.073 -8.890 1.00 0.00 O ATOM 1659 CB SER A 112 1.522 -4.085 -6.002 1.00 0.00 C ATOM 1660 OG SER A 112 1.480 -5.388 -5.457 1.00 0.00 O ATOM 0 H SER A 112 2.574 -1.966 -7.440 1.00 0.00 H new ATOM 0 HA SER A 112 3.659 -4.133 -5.752 1.00 0.00 H new ATOM 0 HB2 SER A 112 1.229 -3.353 -5.250 1.00 0.00 H new ATOM 0 HB3 SER A 112 0.812 -3.998 -6.825 1.00 0.00 H new ATOM 0 HG SER A 112 0.574 -5.580 -5.137 1.00 0.00 H new ATOM 1665 N THR A 113 3.655 -5.793 -7.620 1.00 0.00 N ATOM 1666 CA THR A 113 4.109 -6.683 -8.697 1.00 0.00 C ATOM 1667 C THR A 113 3.588 -8.096 -8.417 1.00 0.00 C ATOM 1668 O THR A 113 4.217 -8.864 -7.697 1.00 0.00 O ATOM 1669 CB THR A 113 5.647 -6.677 -8.838 1.00 0.00 C ATOM 1670 OG1 THR A 113 6.104 -5.357 -8.824 1.00 0.00 O ATOM 1671 CG2 THR A 113 6.135 -7.204 -10.187 1.00 0.00 C ATOM 0 H THR A 113 3.727 -6.224 -6.698 1.00 0.00 H new ATOM 0 HA THR A 113 3.710 -6.323 -9.646 1.00 0.00 H new ATOM 0 HB THR A 113 6.012 -7.300 -8.021 1.00 0.00 H new ATOM 0 HG1 THR A 113 5.701 -4.863 -9.568 1.00 0.00 H new ATOM 0 HG21 THR A 113 7.224 -7.172 -10.218 1.00 0.00 H new ATOM 0 HG22 THR A 113 5.799 -8.232 -10.319 1.00 0.00 H new ATOM 0 HG23 THR A 113 5.731 -6.584 -10.987 1.00 0.00 H new ATOM 1679 N SER A 114 2.420 -8.429 -8.967 1.00 0.00 N ATOM 1680 CA SER A 114 1.832 -9.776 -8.924 1.00 0.00 C ATOM 1681 C SER A 114 2.758 -10.863 -9.497 1.00 0.00 C ATOM 1682 O SER A 114 2.628 -12.033 -9.146 1.00 0.00 O ATOM 1683 CB SER A 114 0.509 -9.782 -9.695 1.00 0.00 C ATOM 1684 OG SER A 114 -0.426 -8.966 -9.004 1.00 0.00 O ATOM 0 H SER A 114 1.839 -7.756 -9.468 1.00 0.00 H new ATOM 0 HA SER A 114 1.672 -10.015 -7.873 1.00 0.00 H new ATOM 0 HB2 SER A 114 0.660 -9.408 -10.708 1.00 0.00 H new ATOM 0 HB3 SER A 114 0.129 -10.800 -9.784 1.00 0.00 H new ATOM 0 HG SER A 114 -1.277 -8.961 -9.490 1.00 0.00 H new ATOM 1689 N ASN A 115 3.718 -10.491 -10.361 1.00 0.00 N ATOM 1690 CA ASN A 115 4.832 -11.349 -10.820 1.00 0.00 C ATOM 1691 C ASN A 115 5.821 -11.757 -9.690 1.00 0.00 C ATOM 1692 O ASN A 115 6.676 -12.619 -9.889 1.00 0.00 O ATOM 1693 CB ASN A 115 5.543 -10.618 -11.976 1.00 0.00 C ATOM 1694 CG ASN A 115 5.842 -11.538 -13.140 1.00 0.00 C ATOM 1695 OD1 ASN A 115 6.835 -12.247 -13.178 1.00 0.00 O ATOM 1696 ND2 ASN A 115 4.981 -11.565 -14.134 1.00 0.00 N ATOM 0 H ASN A 115 3.744 -9.558 -10.773 1.00 0.00 H new ATOM 0 HA ASN A 115 4.420 -12.298 -11.163 1.00 0.00 H new ATOM 0 HB2 ASN A 115 4.919 -9.793 -12.319 1.00 0.00 H new ATOM 0 HB3 ASN A 115 6.474 -10.184 -11.611 1.00 0.00 H new ATOM 0 HD21 ASN A 115 5.144 -12.177 -14.933 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.150 -10.974 -14.105 1.00 0.00 H new ATOM 1702 N GLY A 116 5.679 -11.156 -8.501 1.00 0.00 N ATOM 1703 CA GLY A 116 6.319 -11.519 -7.230 1.00 0.00 C ATOM 1704 C GLY A 116 5.758 -12.808 -6.591 1.00 0.00 C ATOM 1705 O GLY A 116 5.673 -12.893 -5.366 1.00 0.00 O ATOM 0 H GLY A 116 5.070 -10.345 -8.395 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.389 -11.644 -7.396 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.200 -10.695 -6.526 1.00 0.00 H new ATOM 1784 N ASN A 123 12.196 -11.865 -7.783 1.00 0.00 N ATOM 1785 CA ASN A 123 11.791 -11.090 -8.950 1.00 0.00 C ATOM 1786 C ASN A 123 10.994 -9.853 -8.520 1.00 0.00 C ATOM 1787 O ASN A 123 10.332 -9.800 -7.481 1.00 0.00 O ATOM 1788 CB ASN A 123 10.981 -11.947 -9.947 1.00 0.00 C ATOM 1789 CG ASN A 123 10.802 -11.298 -11.316 1.00 0.00 C ATOM 1790 OD1 ASN A 123 11.535 -10.405 -11.718 1.00 0.00 O ATOM 1791 ND2 ASN A 123 9.799 -11.687 -12.070 1.00 0.00 N ATOM 0 HA ASN A 123 12.695 -10.761 -9.463 1.00 0.00 H new ATOM 0 HB2 ASN A 123 11.479 -12.908 -10.074 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.999 -12.151 -9.521 1.00 0.00 H new ATOM 0 HD21 ASN A 123 9.641 -11.246 -12.976 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.178 -12.430 -11.750 1.00 0.00 H new ATOM 1797 N GLN A 124 11.085 -8.842 -9.364 1.00 0.00 N ATOM 1798 CA GLN A 124 10.661 -7.485 -9.085 1.00 0.00 C ATOM 1799 C GLN A 124 10.575 -6.681 -10.388 1.00 0.00 C ATOM 1800 O GLN A 124 10.897 -5.502 -10.385 1.00 0.00 O ATOM 1801 CB GLN A 124 11.644 -6.885 -8.054 1.00 0.00 C ATOM 1802 CG GLN A 124 13.141 -6.858 -8.437 1.00 0.00 C ATOM 1803 CD GLN A 124 14.083 -6.603 -7.253 1.00 0.00 C ATOM 1804 OE1 GLN A 124 13.616 -6.174 -6.098 1.00 0.00 O flip ATOM 1805 NE2 GLN A 124 15.288 -6.795 -7.341 1.00 0.00 N flip ATOM 0 H GLN A 124 11.473 -8.950 -10.301 1.00 0.00 H new ATOM 0 HA GLN A 124 9.660 -7.457 -8.654 1.00 0.00 H new ATOM 0 HB2 GLN A 124 11.331 -5.862 -7.844 1.00 0.00 H new ATOM 0 HB3 GLN A 124 11.543 -7.446 -7.125 1.00 0.00 H new ATOM 0 HG2 GLN A 124 13.404 -7.809 -8.899 1.00 0.00 H new ATOM 0 HG3 GLN A 124 13.300 -6.084 -9.188 1.00 0.00 H new ATOM 0 HE21 GLN A 124 15.689 -7.127 -8.218 1.00 0.00 H new ATOM 0 HE22 GLN A 124 15.892 -6.623 -6.537 1.00 0.00 H new ATOM 1812 N GLU A 125 10.234 -7.311 -11.519 1.00 0.00 N ATOM 1813 CA GLU A 125 10.297 -6.684 -12.843 1.00 0.00 C ATOM 1814 C GLU A 125 9.187 -7.180 -13.788 1.00 0.00 C ATOM 1815 O GLU A 125 9.122 -8.365 -14.132 1.00 0.00 O ATOM 1816 CB GLU A 125 11.668 -6.929 -13.509 1.00 0.00 C ATOM 1817 CG GLU A 125 12.902 -6.581 -12.658 1.00 0.00 C ATOM 1818 CD GLU A 125 14.223 -6.804 -13.428 1.00 0.00 C ATOM 1819 OE1 GLU A 125 14.405 -6.228 -14.527 1.00 0.00 O ATOM 1820 OE2 GLU A 125 15.106 -7.540 -12.920 1.00 0.00 O ATOM 0 H GLU A 125 9.905 -8.276 -11.540 1.00 0.00 H new ATOM 0 HA GLU A 125 10.151 -5.617 -12.676 1.00 0.00 H new ATOM 0 HB2 GLU A 125 11.730 -7.980 -13.791 1.00 0.00 H new ATOM 0 HB3 GLU A 125 11.711 -6.349 -14.431 1.00 0.00 H new ATOM 0 HG2 GLU A 125 12.840 -5.540 -12.340 1.00 0.00 H new ATOM 0 HG3 GLU A 125 12.902 -7.191 -11.755 1.00 0.00 H new ATOM 1825 N GLY A 126 8.328 -6.250 -14.230 1.00 0.00 N ATOM 1826 CA GLY A 126 7.097 -6.491 -14.997 1.00 0.00 C ATOM 1827 C GLY A 126 5.990 -7.116 -14.131 1.00 0.00 C ATOM 1828 O GLY A 126 6.275 -7.912 -13.240 1.00 0.00 O ATOM 0 H GLY A 126 8.481 -5.257 -14.053 1.00 0.00 H new ATOM 0 HA2 GLY A 126 6.741 -5.550 -15.416 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.316 -7.151 -15.836 1.00 0.00 H new ATOM 1831 N GLY A 127 4.727 -6.747 -14.355 1.00 0.00 N ATOM 1832 CA GLY A 127 3.619 -7.118 -13.464 1.00 0.00 C ATOM 1833 C GLY A 127 2.399 -6.197 -13.589 1.00 0.00 C ATOM 1834 O GLY A 127 2.257 -5.464 -14.568 1.00 0.00 O ATOM 0 H GLY A 127 4.441 -6.184 -15.156 1.00 0.00 H new ATOM 0 HA2 GLY A 127 3.315 -8.142 -13.682 1.00 0.00 H new ATOM 0 HA3 GLY A 127 3.972 -7.103 -12.433 1.00 0.00 H new ATOM 1837 N VAL A 128 1.520 -6.206 -12.581 1.00 0.00 N ATOM 1838 CA VAL A 128 0.323 -5.340 -12.522 1.00 0.00 C ATOM 1839 C VAL A 128 0.637 -3.840 -12.538 1.00 0.00 C ATOM 1840 O VAL A 128 -0.163 -3.057 -13.047 1.00 0.00 O ATOM 1841 CB VAL A 128 -0.587 -5.704 -11.340 1.00 0.00 C ATOM 1842 CG1 VAL A 128 -1.275 -7.046 -11.610 1.00 0.00 C ATOM 1843 CG2 VAL A 128 0.140 -5.742 -9.994 1.00 0.00 C ATOM 0 H VAL A 128 1.615 -6.819 -11.771 1.00 0.00 H new ATOM 0 HA VAL A 128 -0.219 -5.540 -13.446 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.328 -4.909 -11.260 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.920 -7.300 -10.769 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -1.875 -6.971 -12.517 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -0.521 -7.823 -11.737 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.566 -6.006 -9.206 1.00 0.00 H new ATOM 0 HG22 VAL A 128 0.936 -6.485 -10.031 1.00 0.00 H new ATOM 0 HG23 VAL A 128 0.568 -4.762 -9.784 1.00 0.00 H new ATOM 1853 N CYS A 129 1.818 -3.406 -12.089 1.00 0.00 N ATOM 1854 CA CYS A 129 2.288 -2.031 -12.299 1.00 0.00 C ATOM 1855 C CYS A 129 2.445 -1.609 -13.782 1.00 0.00 C ATOM 1856 O CYS A 129 2.552 -0.413 -14.040 1.00 0.00 O ATOM 1857 CB CYS A 129 3.557 -1.790 -11.461 1.00 0.00 C ATOM 1858 SG CYS A 129 4.865 -3.042 -11.452 1.00 0.00 S ATOM 0 H CYS A 129 2.473 -3.993 -11.572 1.00 0.00 H new ATOM 0 HA CYS A 129 1.498 -1.368 -11.947 1.00 0.00 H new ATOM 0 HB2 CYS A 129 4.001 -0.855 -11.801 1.00 0.00 H new ATOM 0 HB3 CYS A 129 3.243 -1.637 -10.428 1.00 0.00 H new ATOM 1862 N GLN A 130 2.445 -2.547 -14.737 1.00 0.00 N ATOM 1863 CA GLN A 130 2.703 -2.299 -16.161 1.00 0.00 C ATOM 1864 C GLN A 130 1.423 -1.901 -16.936 1.00 0.00 C ATOM 1865 O GLN A 130 1.487 -1.044 -17.820 1.00 0.00 O ATOM 1866 CB GLN A 130 3.367 -3.563 -16.758 1.00 0.00 C ATOM 1867 CG GLN A 130 4.459 -3.310 -17.817 1.00 0.00 C ATOM 1868 CD GLN A 130 4.028 -3.567 -19.261 1.00 0.00 C ATOM 1869 OE1 GLN A 130 2.942 -3.229 -19.702 1.00 0.00 O ATOM 1870 NE2 GLN A 130 4.868 -4.183 -20.071 1.00 0.00 N ATOM 0 H GLN A 130 2.260 -3.529 -14.534 1.00 0.00 H new ATOM 0 HA GLN A 130 3.374 -1.446 -16.259 1.00 0.00 H new ATOM 0 HB2 GLN A 130 3.804 -4.140 -15.943 1.00 0.00 H new ATOM 0 HB3 GLN A 130 2.589 -4.182 -17.206 1.00 0.00 H new ATOM 0 HG2 GLN A 130 4.794 -2.276 -17.732 1.00 0.00 H new ATOM 0 HG3 GLN A 130 5.317 -3.943 -17.591 1.00 0.00 H new ATOM 0 HE21 GLN A 130 5.783 -4.477 -19.729 1.00 0.00 H new ATOM 0 HE22 GLN A 130 4.602 -4.365 -21.039 1.00 0.00 H new ATOM 1877 N THR A 131 0.259 -2.456 -16.554 1.00 0.00 N ATOM 1878 CA THR A 131 -1.052 -2.202 -17.208 1.00 0.00 C ATOM 1879 C THR A 131 -2.207 -2.040 -16.213 1.00 0.00 C ATOM 1880 O THR A 131 -3.008 -1.119 -16.365 1.00 0.00 O ATOM 1881 CB THR A 131 -1.416 -3.335 -18.189 1.00 0.00 C ATOM 1882 OG1 THR A 131 -0.422 -3.473 -19.183 1.00 0.00 O ATOM 1883 CG2 THR A 131 -2.743 -3.098 -18.918 1.00 0.00 C ATOM 0 H THR A 131 0.194 -3.105 -15.770 1.00 0.00 H new ATOM 0 HA THR A 131 -0.925 -1.260 -17.741 1.00 0.00 H new ATOM 0 HB THR A 131 -1.500 -4.231 -17.574 1.00 0.00 H new ATOM 0 HG1 THR A 131 -0.670 -4.197 -19.795 1.00 0.00 H new ATOM 0 HG21 THR A 131 -2.941 -3.931 -19.593 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.550 -3.022 -18.189 1.00 0.00 H new ATOM 0 HG23 THR A 131 -2.683 -2.173 -19.491 1.00 0.00 H new ATOM 1891 N ARG A 132 -2.298 -2.893 -15.178 1.00 0.00 N ATOM 1892 CA ARG A 132 -3.317 -2.797 -14.106 1.00 0.00 C ATOM 1893 C ARG A 132 -3.292 -1.451 -13.375 1.00 0.00 C ATOM 1894 O ARG A 132 -4.305 -1.039 -12.811 1.00 0.00 O ATOM 1895 CB ARG A 132 -3.105 -3.914 -13.060 1.00 0.00 C ATOM 1896 CG ARG A 132 -4.390 -4.617 -12.612 1.00 0.00 C ATOM 1897 CD ARG A 132 -4.602 -5.928 -13.391 1.00 0.00 C ATOM 1898 NE ARG A 132 -6.014 -6.141 -13.741 1.00 0.00 N ATOM 1899 CZ ARG A 132 -6.560 -7.281 -14.119 1.00 0.00 C ATOM 1900 NH1 ARG A 132 -5.901 -8.408 -14.118 1.00 0.00 N ATOM 1901 NH2 ARG A 132 -7.801 -7.314 -14.513 1.00 0.00 N ATOM 0 H ARG A 132 -1.660 -3.680 -15.056 1.00 0.00 H new ATOM 0 HA ARG A 132 -4.283 -2.901 -14.601 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -2.424 -4.658 -13.474 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -2.616 -3.487 -12.185 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -4.340 -4.829 -11.544 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -5.243 -3.956 -12.766 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -4.002 -5.910 -14.301 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -4.247 -6.767 -12.792 1.00 0.00 H new ATOM 0 HE ARG A 132 -6.630 -5.330 -13.686 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -4.927 -8.429 -13.817 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -6.361 -9.268 -14.418 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -8.354 -6.457 -14.530 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -8.220 -8.197 -14.805 1.00 0.00 H new ATOM 1912 N ALA A 133 -2.121 -0.808 -13.372 1.00 0.00 N ATOM 1913 CA ALA A 133 -1.802 0.396 -12.608 1.00 0.00 C ATOM 1914 C ALA A 133 -2.040 0.180 -11.097 1.00 0.00 C ATOM 1915 O ALA A 133 -2.947 0.754 -10.497 1.00 0.00 O ATOM 1916 CB ALA A 133 -2.483 1.621 -13.236 1.00 0.00 C ATOM 0 H ALA A 133 -1.332 -1.131 -13.931 1.00 0.00 H new ATOM 0 HA ALA A 133 -0.736 0.613 -12.669 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -2.237 2.511 -12.657 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.133 1.747 -14.261 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -3.563 1.476 -13.237 1.00 0.00 H new ATOM 1922 N MET A 134 -1.214 -0.689 -10.499 1.00 0.00 N ATOM 1923 CA MET A 134 -1.182 -0.928 -9.052 1.00 0.00 C ATOM 1924 C MET A 134 -0.076 -0.127 -8.367 1.00 0.00 C ATOM 1925 O MET A 134 0.864 -0.681 -7.793 1.00 0.00 O ATOM 1926 CB MET A 134 -1.119 -2.434 -8.756 1.00 0.00 C ATOM 1927 CG MET A 134 -1.549 -2.675 -7.305 1.00 0.00 C ATOM 1928 SD MET A 134 -2.229 -4.314 -6.983 1.00 0.00 S ATOM 1929 CE MET A 134 -3.235 -3.879 -5.531 1.00 0.00 C ATOM 0 H MET A 134 -0.540 -1.254 -11.016 1.00 0.00 H new ATOM 0 HA MET A 134 -2.113 -0.561 -8.619 1.00 0.00 H new ATOM 0 HB2 MET A 134 -1.772 -2.979 -9.438 1.00 0.00 H new ATOM 0 HB3 MET A 134 -0.107 -2.807 -8.916 1.00 0.00 H new ATOM 0 HG2 MET A 134 -0.688 -2.519 -6.655 1.00 0.00 H new ATOM 0 HG3 MET A 134 -2.294 -1.927 -7.032 1.00 0.00 H new ATOM 0 HE1 MET A 134 -3.750 -4.767 -5.166 1.00 0.00 H new ATOM 0 HE2 MET A 134 -2.589 -3.486 -4.746 1.00 0.00 H new ATOM 0 HE3 MET A 134 -3.969 -3.123 -5.810 1.00 0.00 H new ATOM 1937 N LYS A 135 -0.178 1.197 -8.460 1.00 0.00 N ATOM 1938 CA LYS A 135 0.745 2.160 -7.839 1.00 0.00 C ATOM 1939 C LYS A 135 -0.015 3.231 -7.057 1.00 0.00 C ATOM 1940 O LYS A 135 -1.221 3.424 -7.247 1.00 0.00 O ATOM 1941 CB LYS A 135 1.666 2.843 -8.869 1.00 0.00 C ATOM 1942 CG LYS A 135 2.417 1.838 -9.739 1.00 0.00 C ATOM 1943 CD LYS A 135 1.803 1.575 -11.121 1.00 0.00 C ATOM 1944 CE LYS A 135 1.804 2.806 -12.040 1.00 0.00 C ATOM 1945 NZ LYS A 135 2.185 2.448 -13.440 1.00 0.00 N ATOM 0 H LYS A 135 -0.927 1.649 -8.985 1.00 0.00 H new ATOM 0 HA LYS A 135 1.367 1.582 -7.156 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.071 3.497 -9.506 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.384 3.475 -8.347 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.438 2.193 -9.876 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.478 0.892 -9.201 1.00 0.00 H new ATOM 0 HD2 LYS A 135 2.354 0.769 -11.606 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.778 1.228 -10.993 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.815 3.263 -12.037 1.00 0.00 H new ATOM 0 HE3 LYS A 135 2.500 3.550 -11.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.103 2.879 -13.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 2.256 1.414 -13.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 1.461 2.802 -14.098 1.00 0.00 H new ATOM 1955 N ILE A 136 0.711 3.934 -6.198 1.00 0.00 N ATOM 1956 CA ILE A 136 0.160 5.009 -5.393 1.00 0.00 C ATOM 1957 C ILE A 136 1.148 6.176 -5.350 1.00 0.00 C ATOM 1958 O ILE A 136 2.370 5.989 -5.346 1.00 0.00 O ATOM 1959 CB ILE A 136 -0.314 4.495 -3.992 1.00 0.00 C ATOM 1960 CG1 ILE A 136 0.698 4.684 -2.858 1.00 0.00 C ATOM 1961 CG2 ILE A 136 -0.767 3.012 -3.980 1.00 0.00 C ATOM 1962 CD1 ILE A 136 0.570 5.994 -2.098 1.00 0.00 C ATOM 0 H ILE A 136 1.706 3.771 -6.041 1.00 0.00 H new ATOM 0 HA ILE A 136 -0.749 5.394 -5.856 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.172 5.140 -3.805 1.00 0.00 H new ATOM 0 HG12 ILE A 136 0.590 3.860 -2.153 1.00 0.00 H new ATOM 0 HG13 ILE A 136 1.704 4.618 -3.273 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -1.080 2.735 -2.973 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -1.602 2.881 -4.668 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.062 2.376 -4.290 1.00 0.00 H new ATOM 0 HD11 ILE A 136 1.328 6.036 -1.316 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.710 6.828 -2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -0.420 6.058 -1.647 1.00 0.00 H new ATOM 1973 N LEU A 137 0.599 7.384 -5.240 1.00 0.00 N ATOM 1974 CA LEU A 137 1.330 8.653 -5.099 1.00 0.00 C ATOM 1975 C LEU A 137 0.815 9.354 -3.827 1.00 0.00 C ATOM 1976 O LEU A 137 -0.395 9.472 -3.618 1.00 0.00 O ATOM 1977 CB LEU A 137 1.204 9.448 -6.425 1.00 0.00 C ATOM 1978 CG LEU A 137 0.952 10.962 -6.354 1.00 0.00 C ATOM 1979 CD1 LEU A 137 2.116 11.801 -5.831 1.00 0.00 C ATOM 1980 CD2 LEU A 137 0.659 11.477 -7.763 1.00 0.00 C ATOM 0 H LEU A 137 -0.412 7.517 -5.246 1.00 0.00 H new ATOM 0 HA LEU A 137 2.403 8.530 -4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 137 2.121 9.291 -6.993 1.00 0.00 H new ATOM 0 HB3 LEU A 137 0.392 9.004 -7.001 1.00 0.00 H new ATOM 0 HG LEU A 137 0.127 11.073 -5.651 1.00 0.00 H new ATOM 0 HD11 LEU A 137 1.831 12.853 -5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 137 2.367 11.485 -4.818 1.00 0.00 H new ATOM 0 HD13 LEU A 137 2.982 11.665 -6.478 1.00 0.00 H new ATOM 0 HD21 LEU A 137 0.478 12.551 -7.727 1.00 0.00 H new ATOM 0 HD22 LEU A 137 1.513 11.274 -8.409 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -0.223 10.973 -8.158 1.00 0.00 H new ATOM 1991 N MET A 138 1.762 9.845 -3.037 1.00 0.00 N ATOM 1992 CA MET A 138 1.570 10.701 -1.885 1.00 0.00 C ATOM 1993 C MET A 138 2.374 11.984 -2.089 1.00 0.00 C ATOM 1994 O MET A 138 3.608 11.959 -2.152 1.00 0.00 O ATOM 1995 CB MET A 138 2.088 10.025 -0.618 1.00 0.00 C ATOM 1996 CG MET A 138 1.179 8.930 -0.081 1.00 0.00 C ATOM 1997 SD MET A 138 1.600 8.358 1.587 1.00 0.00 S ATOM 1998 CE MET A 138 1.459 6.553 1.437 1.00 0.00 C ATOM 0 H MET A 138 2.748 9.639 -3.200 1.00 0.00 H new ATOM 0 HA MET A 138 0.505 10.908 -1.779 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.070 9.599 -0.822 1.00 0.00 H new ATOM 0 HB3 MET A 138 2.223 10.781 0.155 1.00 0.00 H new ATOM 0 HG2 MET A 138 0.152 9.296 -0.078 1.00 0.00 H new ATOM 0 HG3 MET A 138 1.212 8.080 -0.763 1.00 0.00 H new ATOM 0 HE1 MET A 138 1.428 6.107 2.431 1.00 0.00 H new ATOM 0 HE2 MET A 138 0.545 6.303 0.898 1.00 0.00 H new ATOM 0 HE3 MET A 138 2.319 6.165 0.892 1.00 0.00 H new ATOM 2006 N LYS A 139 1.673 13.123 -2.126 1.00 0.00 N ATOM 2007 CA LYS A 139 2.253 14.475 -2.246 1.00 0.00 C ATOM 2008 C LYS A 139 1.970 15.257 -0.968 1.00 0.00 C ATOM 2009 O LYS A 139 0.813 15.451 -0.595 1.00 0.00 O ATOM 2010 CB LYS A 139 1.681 15.186 -3.494 1.00 0.00 C ATOM 2011 CG LYS A 139 2.770 15.397 -4.554 1.00 0.00 C ATOM 2012 CD LYS A 139 2.179 15.848 -5.899 1.00 0.00 C ATOM 2013 CE LYS A 139 1.685 17.299 -5.866 1.00 0.00 C ATOM 2014 NZ LYS A 139 0.677 17.553 -6.931 1.00 0.00 N ATOM 0 H LYS A 139 0.655 13.135 -2.072 1.00 0.00 H new ATOM 0 HA LYS A 139 3.334 14.410 -2.374 1.00 0.00 H new ATOM 0 HB2 LYS A 139 0.869 14.593 -3.915 1.00 0.00 H new ATOM 0 HB3 LYS A 139 1.257 16.148 -3.206 1.00 0.00 H new ATOM 0 HG2 LYS A 139 3.481 16.144 -4.201 1.00 0.00 H new ATOM 0 HG3 LYS A 139 3.325 14.470 -4.694 1.00 0.00 H new ATOM 0 HD2 LYS A 139 2.934 15.742 -6.678 1.00 0.00 H new ATOM 0 HD3 LYS A 139 1.351 15.192 -6.167 1.00 0.00 H new ATOM 0 HE2 LYS A 139 1.248 17.514 -4.891 1.00 0.00 H new ATOM 0 HE3 LYS A 139 2.530 17.976 -5.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 0.362 18.543 -6.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 1.102 17.370 -7.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -0.139 16.923 -6.794 1.00 0.00 H new ATOM 2024 N VAL A 140 3.036 15.667 -0.285 1.00 0.00 N ATOM 2025 CA VAL A 140 2.978 16.438 0.963 1.00 0.00 C ATOM 2026 C VAL A 140 4.279 17.230 1.152 1.00 0.00 C ATOM 2027 O VAL A 140 5.375 16.669 1.080 1.00 0.00 O ATOM 2028 CB VAL A 140 2.642 15.493 2.149 1.00 0.00 C ATOM 2029 CG1 VAL A 140 3.732 15.275 3.209 1.00 0.00 C ATOM 2030 CG2 VAL A 140 1.389 15.991 2.864 1.00 0.00 C ATOM 0 H VAL A 140 3.990 15.469 -0.588 1.00 0.00 H new ATOM 0 HA VAL A 140 2.177 17.176 0.919 1.00 0.00 H new ATOM 0 HB VAL A 140 2.514 14.524 1.666 1.00 0.00 H new ATOM 0 HG11 VAL A 140 3.362 14.595 3.976 1.00 0.00 H new ATOM 0 HG12 VAL A 140 4.616 14.845 2.739 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.992 16.230 3.665 1.00 0.00 H new ATOM 0 HG21 VAL A 140 1.156 15.326 3.695 1.00 0.00 H new ATOM 0 HG22 VAL A 140 1.562 16.998 3.243 1.00 0.00 H new ATOM 0 HG23 VAL A 140 0.553 16.005 2.165 1.00 0.00 H new ATOM 2040 N GLY A 141 4.158 18.550 1.328 1.00 0.00 N ATOM 2041 CA GLY A 141 5.303 19.468 1.338 1.00 0.00 C ATOM 2042 C GLY A 141 4.930 20.895 0.945 1.00 0.00 C ATOM 2043 O GLY A 141 5.268 21.337 -0.156 1.00 0.00 O ATOM 0 H GLY A 141 3.260 19.014 1.468 1.00 0.00 H new ATOM 0 HA2 GLY A 141 5.746 19.476 2.334 1.00 0.00 H new ATOM 0 HA3 GLY A 141 6.065 19.096 0.653 1.00 0.00 H new ATOM 2046 N GLN A 142 4.240 21.608 1.847 1.00 0.00 N ATOM 2047 CA GLN A 142 3.795 22.997 1.682 1.00 0.00 C ATOM 2048 C GLN A 142 4.253 23.864 2.855 1.00 0.00 C ATOM 2049 O GLN A 142 3.885 23.571 4.017 1.00 0.00 O ATOM 2050 CB GLN A 142 2.269 23.014 1.450 1.00 0.00 C ATOM 2051 CG GLN A 142 1.740 24.386 0.993 1.00 0.00 C ATOM 2052 CD GLN A 142 1.234 25.265 2.140 1.00 0.00 C ATOM 2053 OE1 GLN A 142 0.104 25.144 2.603 1.00 0.00 O ATOM 2054 NE2 GLN A 142 2.013 26.202 2.640 1.00 0.00 N ATOM 0 H GLN A 142 3.966 21.215 2.748 1.00 0.00 H new ATOM 0 HA GLN A 142 4.260 23.441 0.802 1.00 0.00 H new ATOM 0 HB2 GLN A 142 2.014 22.265 0.700 1.00 0.00 H new ATOM 0 HB3 GLN A 142 1.765 22.726 2.372 1.00 0.00 H new ATOM 0 HG2 GLN A 142 2.534 24.914 0.466 1.00 0.00 H new ATOM 0 HG3 GLN A 142 0.930 24.234 0.279 1.00 0.00 H new ATOM 0 HE21 GLN A 142 2.958 26.328 2.276 1.00 0.00 H new ATOM 0 HE22 GLN A 142 1.672 26.802 3.391 1.00 0.00 H new